#------------------------------------------------------------------------------ #$Date: 2025-07-01 14:04:12 +0300 (Tue, 01 Jul 2025) $ #$Revision: 1179 $ #$URL: svn://localhost/testcod/cif/4/00/00/4000008.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/ # # All data on this site have been placed in the public domain by the # contributors. # data_4000008 loop_ _publ_author_name 'Turrina, Alessandro' 'Garcia, Raquel' 'Cox, Paul A.' 'Casci, John L.' 'Wright, Paul A.' _publ_section_title ; Retrosynthetic Co-Templating Method for the Preparation of Silicoaluminophosphate Molecular Sieves ; _journal_issue 14 _journal_name_full 'Chemistry of Materials' _journal_page_first 4998 _journal_page_last 5012 _journal_paper_doi 10.1021/acs.chemmater.6b01676 _journal_volume 28 _journal_year 2016 _chemical_formula_moiety 'C3.78 H8.43 Al3 N0.74 O12 P2.25 Si0.75' _chemical_formula_sum 'C3.78 H8.43 Al3 N0.74 O12 P2.25 Si0.75' _chemical_formula_weight 428.02 _chemical_name_common 'SAPO-SFW as-prepared dehydrated' _space_group_IT_number 148 _space_group_name_Hall '-R 3' _space_group_name_H-M_alt 'R -3 :H' _symmetry_cell_setting trigonal _symmetry_space_group_name_Hall '-R 3' _symmetry_space_group_name_H-M 'R -3 :H' _audit_creation_date 2016-02-05T18:09 _audit_creation_method 'from EXP file using GSAS2CIF' _audit_update_record ' 2016-02-05T18:09 Initial CIF as created by GSAS2CIF' _cell_angle_alpha 90.0 _cell_angle_beta 90.0 _cell_angle_gamma 120.0 _cell_formula_units_Z 18 _cell_length_a 13.64075(31) _cell_length_b 13.64075 _cell_length_c 45.4999(13) _cell_measurement_temperature 295 _cell_volume 7331.9(3) _computing_structure_refinement GSAS _diffrn_ambient_temperature 295 _diffrn_detector 'Linear PSD' _diffrn_measurement_device_type 'Stoe STADI P01' _diffrn_radiation_polarisn_ratio 0.55 _diffrn_radiation_probe x-ray _diffrn_radiation_wavelength 1.54056 _diffrn_source X-ray _exptl_absorpt_coefficient_mu 5.216 _exptl_absorpt_correction_T_max 1.00000 _exptl_absorpt_correction_T_min 1.00000 _exptl_absorpt_process_details ; GSAS Absorption/surface roughness correction: function number 0 No correction is applied. ; _exptl_crystal_density_diffrn 1.745 _exptl_crystal_F_000 3880.4 _pd_block_id 2016-02-05T18:09|SAPO-SFW_(diDABCO-C6_trimethylamine)|A_Turrina|Stor_STADI_P01 _pd_calc_method 'Rietveld Refinement' _pd_char_colour white _pd_instr_location ' ?' _pd_meas_2theta_range_inc 0.01 _pd_meas_2theta_range_max 79.89 _pd_meas_2theta_range_min 3.0 _pd_meas_number_of_points 7690 _pd_phase_name 'from C:/gsas/PhD/SAPO-SFW/C6_as-prep_2/SFW_K1.cif' _pd_proc_2theta_range_inc 0.01 _pd_proc_2theta_range_max 79.89 _pd_proc_2theta_range_min 3.0 _pd_proc_info_datetime 2016-02-05T18:09:06 _pd_proc_info_excluded_regions ' ?' _pd_proc_ls_background_function ; GSAS Background function number 1 with 36 terms. Shifted Chebyshev function of 1st kind 1: 370.317 2: -337.048 3: 212.784 4: -143.038 5: 133.709 6: -165.354 7: 153.196 8: -121.125 9: 88.0004 10: -65.2894 11: 61.4475 12: -54.8475 13: 42.0430 14: -36.8980 15: 34.4599 16: -28.7176 17: 25.8171 18: -18.9103 19: 19.5254 20: -16.4561 21: 11.6487 22: -6.22435 23: 2.34518 24: -2.09605 25: 5.06444 26: -9.29667 27: 3.65036 28: -1.73396 29: 3.40696 30: -6.64131 31: 4.36952 32: -1.31433 33: -2.46593 34: -0.324331 35: 1.96333 36: -4.85645 ; _pd_proc_ls_peak_cutoff 0.00100 _pd_proc_ls_profile_function ; CW Profile function number 4 with 16 terms Pseudovoigt profile coefficients as parameterized in P. Thompson, D.E. Cox & J.B. Hastings (1987). J. Appl. Cryst.,20,79-83. Asymmetry correction of L.W. Finger, D.E. Cox & A. P. Jephcoat (1994). J. Appl. Cryst.,27,892-900. Microstrain broadening by P.W. Stephens, (1999). J. Appl. Cryst.,32,281-289. #1(GU) = 220.567 #2(GV) = 48.144 #3(GW) = 9.799 #4(GP) = 0.000 #5(LX) = 3.466 #6(ptec) = 0.00 #7(trns) = 0.00 #8(shft) = -1.2329 #9(sfec) = 0.00 #10(S/L) = 0.0259 #11(H/L) = 0.0277 #12(eta) = 0.0000 #13(S400 ) = 0.0E+00 #14(S004 ) = 0.0E+00 #15(S202 ) = 0.0E+00 #16(S310 ) = 0.0E+00 #17(S211 ) = 0.0E+00 Peak tails are ignored where the intensity is below 0.0010 times the peak Aniso. broadening axis 0.0 0.0 1.0 ; _pd_proc_ls_prof_R_factor 0.0685 _pd_proc_ls_prof_wR_expected 0.0464 _pd_proc_ls_prof_wR_factor 0.0886 _pd_proc_number_of_points 7690 _pd_spec_mounting ' ?' _refine_ls_goodness_of_fit_all 1.96 _refine_ls_matrix_type full _refine_ls_number_parameters 60 _refine_ls_number_restraints 24 _refine_ls_R_Fsqd_factor 0.12935 _refine_ls_shift/su_max 0.04 _refine_ls_shift/su_mean 0.01 _reflns_d_resolution_high 1.208 _reflns_d_resolution_low 15.167 _reflns_limit_h_max 11 _reflns_limit_h_min 0 _reflns_limit_k_max 5 _reflns_limit_k_min -5 _reflns_limit_l_max 37 _reflns_limit_l_min -38 _reflns_number_total 976 _cod_data_source_file cm6b01676_si_001.cif _cod_data_source_block SAPO-SFW_as-prepared_publ _cod_original_cell_volume 7331.9(4) _cod_original_sg_symbol_H-M 'R -3' _cod_database_code 4000008 _gsas_exptl_extinct_corr_t_min 1.00000 _gsas_exptl_extinct_corr_t_max 1.00000 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 +x,+y,+z 2 -y,x-y,+z 3 y-x,-x,+z -1 -x,-y,-z -2 +y,y-x,-z -3 x-y,+x,-z 101 +x+1/3,+y+2/3,+z+2/3 102 -y+1/3,x-y+2/3,+z+2/3 103 y-x+1/3,-x+2/3,+z+2/3 -101 -x+2/3,-y+1/3,-z+1/3 -102 +y+2/3,y-x+1/3,-z+1/3 -103 x-y+2/3,+x+1/3,-z+1/3 201 +x+2/3,+y+1/3,+z+1/3 202 -y+2/3,x-y+1/3,+z+1/3 203 y-x+2/3,-x+1/3,+z+1/3 -201 -x+1/3,-y+2/3,-z+2/3 -202 +y+1/3,y-x+2/3,-z+2/3 -203 x-y+1/3,+x+2/3,-z+2/3 loop_ _atom_site_type_symbol _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_site_thermal_displace_type _atom_site_U_iso_or_equiv _atom_site_symmetry_multiplicity Al Al1 0.9917(9) 0.2240(8) 0.25693(31) 1.0 Uiso 0.0181(6) 18 Al Al2 0.2349(7) -0.0019(8) 0.81222(31) 1.0 Uiso 0.0181(6) 18 Al Al3 0.9935(9) 0.2328(8) 0.03299(33) 1.0 Uiso 0.0181(6) 18 C C1 -0.2668 -0.7188 0.4436 0.4345(31) Uiso 0.005 18 C C2 0.333 0.5948 0.0176 0.1618(5) Uiso 0.005 18 C C3 0.2445 0.7023 0.0355 0.1618(5) Uiso 0.005 18 C C4 0.4505 0.7971 0.0288 0.1618(5) Uiso 0.005 18 C C5 0.3465 0.5646 0.0523 0.1618(5) Uiso 0.005 18 C C6 0.2576 0.6725 0.0703 0.1618(5) Uiso 0.005 18 C C7 0.4651 0.7675 0.0636 0.1618(5) Uiso 0.005 18 C C8 0.3745 0.6261 0.1064 0.1618(5) Uiso 0.005 18 N N1 -0.3338 -0.6672 0.434 0.2896(21) Uiso 0.005 18 N N2 0.3381 0.7083 0.0155 0.1618(5) Uiso 0.005 18 N N3 0.3617 0.6577 0.0748 0.1618(5) Uiso 0.005 18 O O1 0.2619(23) 0.9972(28) 0.77480(27) 1.0 Uiso 0.0129(11) 18 O O2 0.9998(27) 0.2674(23) 0.22079(28) 1.0 Uiso 0.0129(11) 18 O O3 0.1228(9) 0.2353(13) 0.2642(4) 1.0 Uiso 0.0129(11) 18 O O4 0.8955(7) 0.0811(9) 0.26151(34) 1.0 Uiso 0.0129(11) 18 O O5 0.3188(15) 0.9876(18) 0.7259(5) 1.0 Uiso 0.0129(11) 18 O O6 0.9702(17) 0.3120(18) 0.2807(5) 1.0 Uiso 0.0129(11) 18 O O7 0.9034(9) 0.1181(8) 0.18445(33) 1.0 Uiso 0.0129(11) 18 O O8 0.9955(15) 0.3211(15) 0.1696(7) 1.0 Uiso 0.0129(11) 18 O O9 0.1066(7) 0.2295(8) 0.17925(31) 1.0 Uiso 0.0129(11) 18 O O10 1.0014(30) 0.2671(19) 0.99597(29) 1.0 Uiso 0.0129(11) 18 O O11 0.1186(9) 0.2395(13) 0.0431(4) 1.0 Uiso 0.0129(11) 18 O O12 0.8837(8) 0.0972(8) 0.03975(35) 1.0 Uiso 0.0129(11) 18 P P1 0.23021(29) 0.00111(29) 0.74312(29) 0.75 Uiso 0.0181(6) 18 P P2 0.00752(32) 0.23612(32) 0.18912(32) 0.75 Uiso 0.0181(6) 18 P P3 0.22843(28) 0.00853(28) 0.96533(28) 0.75 Uiso 0.0181(6) 18 Si Si1 0.23021(29) 0.00111(29) 0.74312(29) 0.25 Uiso 0.0181(6) 18 Si Si2 0.00752(32) 0.23612(32) 0.18912(32) 0.25 Uiso 0.0181(6) 18 Si Si3 0.22843(28) 0.00853(28) 0.96533(28) 0.25 Uiso 0.0181(6) 18 C C9 0.3898 0.7088 0.1322 0.1618(5) Uiso 0.005 18 C C10 0.3955 0.6607 0.1629 0.1618(5) Uiso 0.005 18 H H1 -0.1804 -0.6724 0.4347 0.4345(31) Uiso 0.005 18 H H2 -0.3044 -0.8065 0.4359 0.4345(31) Uiso 0.005 18 H H3 -0.2614 -0.719 0.4681 0.4345(31) Uiso 0.005 18 H H4 0.4 0.5943 0.004 0.1618(5) Uiso 0.005 18 H H5 0.2527 0.5265 0.0087 0.1618(5) Uiso 0.005 18 H H6 0.1609 0.6382 0.0272 0.1618(5) Uiso 0.005 18 H H7 0.2451 0.7828 0.0353 0.1618(5) Uiso 0.005 18 H H8 0.5217 0.8042 0.0155 0.1618(5) Uiso 0.005 18 H H9 0.4584 0.881 0.0285 0.1618(5) Uiso 0.005 18 H H10 0.4188 0.5504 0.053 0.1618(5) Uiso 0.005 18 H H11 0.2716 0.4833 0.0578 0.1618(5) Uiso 0.005 18 H H14 0.5425 0.7621 0.0648 0.1618(5) Uiso 0.005 18 H H15 0.4803 0.8403 0.0775 0.1618(5) Uiso 0.005 18 H H16 0.4466 0.6115 0.1071 0.1618(5) Uiso 0.005 18 H H17 0.3006 0.5438 0.1118 0.1618(5) Uiso 0.005 18 H H18 0.4666 0.7905 0.1287 0.1618(5) Uiso 0.005 18 H H19 0.3192 0.7255 0.1322 0.1618(5) Uiso 0.005 18 H H20 0.4702 0.6506 0.1639 0.1618(5) Uiso 0.005 18 H H21 0.3222 0.5754 0.1654 0.1618(5) Uiso 0.005 18 H H12 0.179 0.5957 0.0767 0.1618(5) Uiso 0.005 18 H H13 0.2624 0.7408 0.0844 0.1618(5) Uiso 0.005 18 C C11 0.39739 0.73387 0.18931 0.1618(5) Uiso 0.005 18 C C12 0.38983 0.67733 0.21972 0.1618(5) Uiso 0.005 18 C C13 0.37696 0.74291 0.2464 0.1618(5) Uiso 0.005 18 C C14 0.24573 0.57449 0.27939 0.1618(5) Uiso 0.005 18 C C15 0.22447 0.52135 0.31322 0.1618(5) Uiso 0.005 18 C C16 0.45246 0.67028 0.28818 0.1618(5) Uiso 0.005 18 C C17 0.42962 0.61673 0.32197 0.1618(5) Uiso 0.005 18 C C18 0.34586 0.76628 0.30115 0.1618(5) Uiso 0.005 18 C C19 0.32381 0.71227 0.33494 0.1618(5) Uiso 0.005 18 N N4 0.35634 0.68979 0.27718 0.1618(5) Uiso 0.005 18 N N5 0.31838 0.59828 0.33483 0.1618(5) Uiso 0.005 18 H H22 0.32619 0.74921 0.18711 0.1618(5) Uiso 0.005 18 H H23 0.47421 0.81706 0.18841 0.1618(5) Uiso 0.005 18 H H24 0.31772 0.591 0.21921 0.1618(5) Uiso 0.005 18 H H25 0.46503 0.66924 0.22293 0.1618(5) Uiso 0.005 18 H H26 0.30757 0.75875 0.24105 0.1618(5) Uiso 0.005 18 H H27 0.45301 0.82698 0.24714 0.1618(5) Uiso 0.005 18 H H28 0.24625 0.51162 0.26405 0.1618(5) Uiso 0.005 18 H H29 0.17182 0.58172 0.27316 0.1618(5) Uiso 0.005 18 H H30 0.21765 0.43801 0.31172 0.1618(5) Uiso 0.005 18 H H31 0.14216 0.50665 0.32118 0.1618(5) Uiso 0.005 18 H H32 0.46307 0.61221 0.2732 0.1618(5) Uiso 0.005 18 H H33 0.53399 0.74935 0.28846 0.1618(5) Uiso 0.005 18 H H34 0.50087 0.67345 0.33646 0.1618(5) Uiso 0.005 18 H H35 0.4305 0.53702 0.32093 0.1618(5) Uiso 0.005 18 H H36 0.27614 0.78162 0.29584 0.1618(5) Uiso 0.005 18 H H37 0.4226 0.84973 0.30211 0.1618(5) Uiso 0.005 18 H H38 0.24525 0.70485 0.34369 0.1618(5) Uiso 0.005 18 H H39 0.39188 0.77248 0.3497 0.1618(5) Uiso 0.005 18 C C20 -0.2668 -0.7188 0.4244 0.4345(31) Uiso 0.005 18 H H40 -0.1804 -0.6724 0.4341 0.4345(31) Uiso 0.005 18 H H41 -0.3044 -0.8065 0.4321 0.4345(31) Uiso 0.005 18 H H42 -0.2614 -0.719 0.3999 0.4345(31) Uiso 0.005 18 loop_ _atom_type_symbol _atom_type_number_in_cell _atom_type_scat_dispersion_real _atom_type_scat_dispersion_imag _atom_type_scat_Cromer_Mann_a1 _atom_type_scat_Cromer_Mann_a2 _atom_type_scat_Cromer_Mann_a3 _atom_type_scat_Cromer_Mann_a4 _atom_type_scat_Cromer_Mann_b1 _atom_type_scat_Cromer_Mann_b2 _atom_type_scat_Cromer_Mann_b3 _atom_type_scat_Cromer_Mann_b4 _atom_type_scat_Cromer_Mann_c _atom_type_scat_source Al 54.0 0.000 0.000 6.42020 3.03870 1.90020 0.74260 1.59360 31.5472 1.96460 85.0886 1.11510 International_Tables_Vol_C C 68.081 0.000 0.000 2.31000 20.8439 1.02000 10.2075 1.58860 0.56870 0.86500 51.6512 0.21560 International_Tables_Vol_C N 16.867 0.000 0.000 12.2126 0.00570 3.13220 9.89330 2.01250 28.9975 1.16630 0.58260 -11.529 International_Tables_Vol_C O 216.0 0.000 0.000 3.04850 13.2771 2.28680 5.70110 1.54630 0.32390 0.86700 32.9089 0.25080 International_Tables_Vol_C P 40.5 0.000 0.000 6.43450 1.90670 4.17910 27.1570 1.78000 0.52600 1.49080 68.1645 1.11490 International_Tables_Vol_C Si 13.5 0.000 0.000 6.29150 2.43860 3.03530 32.3337 1.98910 0.67850 1.54100 81.6937 1.14070 International_Tables_Vol_C H 151.804 0.000 0.000 0.49300 10.5109 0.32291 26.1257 0.14019 3.14236 0.04081 57.7997 0.00304 International_Tables_Vol_C loop_ _geom_angle_atom_site_label_1 _geom_angle_atom_site_label_2 _geom_angle_atom_site_label_3 _geom_angle _geom_angle_site_symmetry_1 _geom_angle_site_symmetry_2 _geom_angle_site_symmetry_3 _geom_angle_publ_flag O2 Al1 O3 105.2(15) 1_555 . 1_655 N O2 Al1 O4 112.4(14) 1_555 . 1_555 N O2 Al1 O6 110.9(12) 1_555 . 1_555 N O3 Al1 O4 104.1(9) 1_655 . 1_555 N O3 Al1 O6 109.8(9) 1_655 . 1_555 N O4 Al1 O6 113.9(12) 1_555 . 1_555 N O1 Al2 O7 102.3(13) 1_545 . -1_656 N O1 Al2 O8 116.5(17) 1_545 . 101_445 N O1 Al2 O9 109.2(15) 1_545 . -2_556 N O7 Al2 O8 111.9(11) -1_656 . 101_445 N O7 Al2 O9 107.6(8) -1_656 . -2_556 N O8 Al2 O9 108.9(12) 101_445 . -2_556 N O5 Al3 O10 119.8(14) 201_544 . 1_554 N O5 Al3 O11 100.5(8) 201_544 . 1_655 N O5 Al3 O12 107.3(13) 201_544 . 1_555 N O10 Al3 O11 108.6(15) 1_554 . 1_655 N O10 Al3 O12 111.4(14) 1_554 . 1_555 N O11 Al3 O12 108.3(9) 1_655 . 1_555 N N1 C1 N1 0.0 1_555 . 2_445 N N1 C1 N1 0.0 1_555 . 3_545 N N1 C1 H1 111.0325(7) 1_555 . 1_555 N N1 C1 H2 111.3047(6) 1_555 . 1_555 N N1 C1 H3 110.7845(5) 1_555 . 1_555 N N1 C1 C20 72.7299(6) 1_555 . 1_555 N N1 C1 H40 110.3798(7) 1_555 . 1_555 N N1 C1 H41 107.3593(8) 1_555 . 1_555 N N1 C1 N1 0.0 2_445 . 3_545 N N1 C1 H1 110.6500(7) 2_445 . 1_555 N N1 C1 H2 111.6346(6) 2_445 . 1_555 N N1 C1 H3 110.8361(5) 2_445 . 1_555 N N1 C1 C20 72.6662(6) 2_445 . 1_555 N N1 C1 H40 110.0009(7) 2_445 . 1_555 N N1 C1 H41 107.6533(8) 2_445 . 1_555 N N1 C1 H1 110.7414(7) 3_545 . 1_555 N N1 C1 H2 111.6816(6) 3_545 . 1_555 N N1 C1 H3 110.6995(5) 3_545 . 1_555 N N1 C1 C20 72.8034(6) 3_545 . 1_555 N N1 C1 H40 110.0945(7) 3_545 . 1_555 N N1 C1 H41 107.7170(8) 3_545 . 1_555 N H1 C1 H2 107.0027(7) 1_555 . 1_555 N H1 C1 H3 108.4235(8) 1_555 . 1_555 N H1 C1 C20 68.3772(7) 1_555 . 1_555 N H1 C1 H40 1.311 1_555 . 1_555 N H1 C1 H41 102.7610(9) 1_555 . 1_555 N H2 C1 H3 108.1461(6) 1_555 . 1_555 N H2 C1 C20 71.3747(6) 1_555 . 1_555 N H2 C1 H40 106.3694(7) 1_555 . 1_555 N H2 C1 H41 8.09330(20) 1_555 . 1_555 N H3 C1 C20 176.14790(10) 1_555 . 1_555 N H3 C1 H40 109.7335(9) 1_555 . 1_555 N H3 C1 H41 116.2183(9) 1_555 . 1_555 N C20 C1 H40 67.0662(7) 1_555 . 1_555 N C20 C1 H41 63.2814(8) 1_555 . 1_555 N H40 C1 H41 101.9910(9) 1_555 . 1_555 N C2 C2 C2 60.0 2_665 . 3_565 N C2 C2 C3 127.0656(10) 2_665 . 2_665 N C2 C2 C4 126.8425(5) 2_665 . 3_565 N C2 C2 C5 102.3173(4) 2_665 . 1_555 N C2 C2 N2 28.1645 2_665 . 1_555 N C2 C2 N2 63.1224 2_665 . 2_665 N C2 C2 N2 7.63650(20) 2_665 . 3_565 N C2 C2 H4 90.1146 2_665 . 1_555 N C2 C2 H5 137.34140(30) 2_665 . 1_555 N C2 C2 H6 130.59810(20) 2_665 . 2_665 N C2 C2 H8 173.91550(10) 2_665 . 3_565 N C2 C2 C14 96.35510(20) 2_665 . -203_555 N C2 C2 C15 119.5843 2_665 . -203_555 N C2 C2 C16 111.5414(7) 2_665 . -202_455 N C2 C2 C17 159.4966(5) 2_665 . -202_455 N C2 C2 C18 116.2669(8) 2_665 . -201_565 N C2 C2 C19 70.4895(7) 2_665 . -201_565 N C2 C2 C19 31.1940(9) 2_665 . -202_455 N C2 C2 C19 63.45560(30) 2_665 . -203_555 N C2 C2 N5 81.12050(10) 2_665 . -202_455 N C2 C2 N5 54.1956(9) 2_665 . -203_555 N C2 C2 H31 161.55130(20) 2_665 . -203_555 N C2 C2 H34 131.6124(7) 2_665 . -202_455 N C2 C2 H36 109.69750(30) 2_665 . -201_565 N C2 C2 C3 101.56140(30) 3_565 . 2_665 N C2 C2 C4 141.5844(9) 3_565 . 3_565 N C2 C2 C5 108.0789(6) 3_565 . 1_555 N C2 C2 N2 32.2301 3_565 . 1_555 N C2 C2 N2 6.72790(20) 3_565 . 2_665 N C2 C2 N2 63.569 3_565 . 3_565 N C2 C2 H4 135.9682(7) 3_565 . 1_555 N C2 C2 H5 82.8138 3_565 . 1_555 N C2 C2 H6 156.2661(5) 3_565 . 2_665 N C2 C2 H8 124.5288 3_565 . 3_565 N C2 C2 C14 98.39110(30) 3_565 . -203_555 N C2 C2 C15 172.52431(30) 3_565 . -203_555 N C2 C2 C16 113.7192(7) 3_565 . -202_455 N C2 C2 C17 108.37270(10) 3_565 . -202_455 N C2 C2 C18 104.4552(4) 3_565 . -201_565 N C2 C2 C19 77.8879(4) 3_565 . -201_565 N C2 C2 C19 56.69800(30) 3_565 . -202_455 N C2 C2 C19 32.3060(9) 3_565 . -203_555 N C2 C2 N5 42.4704(9) 3_565 . -202_455 N C2 C2 N5 87.999 3_565 . -203_555 N C2 C2 H31 134.99950(10) 3_565 . -203_555 N C2 C2 H34 136.1059(8) 3_565 . -202_455 N C2 C2 H36 142.5211(10) 3_565 . -201_565 N C3 C2 C4 41.5199(6) 2_665 . 3_565 N C3 C2 C5 31.8205(8) 2_665 . 1_555 N C3 C2 N2 121.7717(6) 2_665 . 1_555 N C3 C2 N2 104.6173 2_665 . 2_665 N C3 C2 N2 134.3037(7) 2_665 . 3_565 N C3 C2 H4 122.4703(9) 2_665 . 1_555 N C3 C2 H5 77.3420(16) 2_665 . 1_555 N C3 C2 H6 54.73520(30) 2_665 . 2_665 N C3 C2 H8 57.6257(11) 2_665 . 3_565 N C3 C2 C14 33.4152(8) 2_665 . -203_555 N C3 C2 C15 72.5406 2_665 . -203_555 N C3 C2 C16 26.0315(6) 2_665 . -202_455 N C3 C2 C17 69.7277(16) 2_665 . -202_455 N C3 C2 C18 13.99220(30) 2_665 . -201_565 N C3 C2 C19 159.8125(4) 2_665 . -201_565 N C3 C2 C19 153.235 2_665 . -202_455 N C3 C2 C19 127.3706(8) 2_665 . -203_555 N C3 C2 N5 120.0001(12) 2_665 . -202_455 N C3 C2 N5 169.38161(20) 2_665 . -203_555 N C3 C2 H31 65.8829(12) 2_665 . -203_555 N C3 C2 H34 97.1303(17) 2_665 . -202_455 N C3 C2 H36 53.3985(9) 2_665 . -201_565 N C4 C2 C5 36.6069(4) 3_565 . 1_555 N C4 C2 N2 145.6885(7) 3_565 . 1_555 N C4 C2 N2 145.7057(6) 3_565 . 2_665 N C4 C2 N2 129.06650(20) 3_565 . 3_565 N C4 C2 H4 81.7355(15) 3_565 . 1_555 N C4 C2 H5 95.0342(8) 3_565 . 1_555 N C4 C2 H6 15.67030(30) 3_565 . 2_665 N C4 C2 H8 53.0174(7) 3_565 . 3_565 N C4 C2 C14 46.2713(7) 3_565 . -203_555 N C4 C2 C15 31.6954(6) 3_565 . -203_555 N C4 C2 C16 29.04010(20) 3_565 . -202_455 N C4 C2 C17 73.1672(10) 3_565 . -202_455 N C4 C2 C18 37.1310(4) 3_565 . -201_565 N C4 C2 C19 140.1182(5) 3_565 . -201_565 N C4 C2 C19 151.27831(30) 3_565 . -202_455 N C4 C2 C19 167.12430(10) 3_565 . -203_555 N C4 C2 N5 151.4661(4) 3_565 . -202_455 N C4 C2 N5 128.1037(8) 3_565 . -203_555 N C4 C2 H31 51.4471(11) 3_565 . -203_555 N C4 C2 H34 72.1786(19) 3_565 . -202_455 N C4 C2 H36 17.87650(20) 3_565 . -201_565 N C5 C2 N2 110.9637(5) 1_555 . 1_555 N C5 C2 N2 113.8654(4) 1_555 . 2_665 N C5 C2 N2 108.11940(10) 1_555 . 3_565 N C5 C2 H4 109.5657(14) 1_555 . 1_555 N C5 C2 H5 109.0166(8) 1_555 . 1_555 N C5 C2 H6 51.9143 1_555 . 2_665 N C5 C2 H8 80.4709(6) 1_555 . 3_565 N C5 C2 C14 9.80090(30) 1_555 . -203_555 N C5 C2 C15 64.47640(30) 1_555 . -203_555 N C5 C2 C16 9.38700(30) 1_555 . -202_455 N C5 C2 C17 97.3819(9) 1_555 . -202_455 N C5 C2 C18 17.8469(5) 1_555 . -201_565 N C5 C2 C19 167.2788(4) 1_555 . -201_565 N C5 C2 C19 133.4923(4) 1_555 . -202_455 N C5 C2 C19 140.37730(30) 1_555 . -203_555 N C5 C2 N5 143.8941(5) 1_555 . -202_455 N C5 C2 N5 140.3821(10) 1_555 . -203_555 N C5 C2 H31 83.8443(9) 1_555 . -203_555 N C5 C2 H34 108.6579(16) 1_555 . -202_455 N C5 C2 H36 35.4225(4) 1_555 . -201_565 N N2 C2 N2 34.963 1_555 . 2_665 N N2 C2 N2 31.3452 1_555 . 3_565 N N2 C2 H4 110.7543(4) 1_555 . 1_555 N N2 C2 H5 111.03750(20) 1_555 . 1_555 N N2 C2 H6 155.99580(30) 1_555 . 2_665 N N2 C2 H8 155.49110(10) 1_555 . 3_565 N N2 C2 C14 102.04840(20) 1_555 . -203_555 N N2 C2 C15 147.7429 1_555 . -203_555 N N2 C2 C16 119.8794(7) 1_555 . -202_455 N N2 C2 C17 136.38560(30) 1_555 . -202_455 N N2 C2 C18 117.5088(6) 1_555 . -201_565 N N2 C2 C19 67.8622(5) 1_555 . -201_565 N N2 C2 C19 31.6717(6) 1_555 . -202_455 N N2 C2 C19 40.2329(5) 1_555 . -203_555 N N2 C2 N5 57.83410(30) 1_555 . -202_455 N N2 C2 N5 64.90540(30) 1_555 . -203_555 N N2 C2 H31 162.08630(30) 1_555 . -203_555 N N2 C2 H34 139.2616(11) 1_555 . -202_455 N N2 C2 H36 132.2859(5) 1_555 . -201_565 N N2 C2 N2 65.8542 2_665 . 3_565 N N2 C2 H4 132.5564(9) 2_665 . 1_555 N N2 C2 H5 77.86050(10) 2_665 . 1_555 N N2 C2 H6 158.90150(30) 2_665 . 2_665 N N2 C2 H8 120.89650(10) 2_665 . 3_565 N N2 C2 C14 104.28580(10) 2_665 . -203_555 N N2 C2 C15 176.8517 2_665 . -203_555 N N2 C2 C16 118.9408(5) 2_665 . -202_455 N N2 C2 C17 103.59130(20) 2_665 . -202_455 N N2 C2 C18 108.87030(20) 2_665 . -201_565 N N2 C2 C19 72.90760(10) 2_665 . -201_565 N N2 C2 C19 55.71350(10) 2_665 . -202_455 N N2 C2 C19 26.6014(7) 2_665 . -203_555 N N2 C2 N5 35.7663(7) 2_665 . -202_455 N N2 C2 N5 85.38430(20) 2_665 . -203_555 N N2 C2 H31 130.49361(20) 2_665 . -203_555 N N2 C2 H34 129.3958(10) 2_665 . -202_455 N N2 C2 H36 148.7942(8) 2_665 . -201_565 N N2 C2 H4 83.50590(20) 3_565 . 1_555 N N2 C2 H5 135.8962(6) 3_565 . 1_555 N N2 C2 H6 130.1897 3_565 . 2_665 N N2 C2 H8 166.56050(30) 3_565 . 3_565 N N2 C2 C14 102.8069 3_565 . -203_555 N N2 C2 C15 117.0507 3_565 . -203_555 N N2 C2 C16 117.1382(4) 3_565 . -202_455 N N2 C2 C17 154.4926(8) 3_565 . -202_455 N N2 C2 C18 122.9400(6) 3_565 . -201_565 N N2 C2 C19 63.8600(4) 3_565 . -201_565 N N2 C2 C19 25.9432(6) 3_565 . -202_455 N N2 C2 C19 62.2991 3_565 . -203_555 N N2 C2 N5 79.42080(20) 3_565 . -202_455 N N2 C2 N5 46.5850(6) 3_565 . -203_555 N N2 C2 H31 154.7682(4) 3_565 . -203_555 N N2 C2 H34 124.0994(9) 3_565 . -202_455 N N2 C2 H36 111.3605 3_565 . -201_565 N H4 C2 H5 105.3380(11) 1_555 . 1_555 N H4 C2 H6 67.7449(12) 1_555 . 2_665 N H4 C2 H8 83.84210(10) 1_555 . 3_565 N H4 C2 C14 117.7590(12) 1_555 . -203_555 N H4 C2 C15 50.1281(10) 1_555 . -203_555 N H4 C2 C16 106.8916(15) 1_555 . -202_455 N H4 C2 C17 88.6036(7) 1_555 . -202_455 N H4 C2 C18 118.2367(11) 1_555 . -201_565 N H4 C2 C19 61.0070(11) 1_555 . -201_565 N H4 C2 C19 80.7369(10) 1_555 . -202_455 N H4 C2 C19 107.3155(17) 1_555 . -203_555 N H4 C2 N5 106.3356(19) 1_555 . -202_455 N H4 C2 N5 48.1375(7) 1_555 . -203_555 N H4 C2 H31 71.45020(20) 1_555 . -203_555 N H4 C2 H34 44.9487(6) 1_555 . -202_455 N H4 C2 H36 74.8738(18) 1_555 . -201_565 N H5 C2 H6 91.8593(5) 1_555 . 2_665 N H5 C2 H8 44.69060(10) 1_555 . 3_565 N H5 C2 C14 109.9846(8) 1_555 . -203_555 N H5 C2 C15 100.02470(10) 1_555 . -203_555 N H5 C2 C16 101.7153(10) 1_555 . -202_455 N H5 C2 C17 25.75200(10) 1_555 . -202_455 N H5 C2 C18 91.3121(13) 1_555 . -201_565 N H5 C2 C19 82.5956(12) 1_555 . -201_565 N H5 C2 C19 111.4620(11) 1_555 . -202_455 N H5 C2 C19 73.9628(6) 1_555 . -203_555 N H5 C2 N5 56.5253(4) 1_555 . -202_455 N H5 C2 N5 108.7759(17) 1_555 . -203_555 N H5 C2 H31 52.69270(10) 1_555 . -203_555 N H5 C2 H34 63.0572(5) 1_555 . -202_455 N H5 C2 H36 112.6601(6) 1_555 . -201_565 N H6 C2 H8 47.2558(4) 2_665 . 3_565 N H6 C2 C14 61.67190(30) 2_665 . -203_555 N H6 C2 C15 18.06370(20) 2_665 . -203_555 N H6 C2 C16 44.68450(10) 2_665 . -202_455 N H6 C2 C17 67.1870(6) 2_665 . -202_455 N H6 C2 C18 52.36570(10) 2_665 . -201_565 N H6 C2 C19 124.50580(20) 2_665 . -201_565 N H6 C2 C19 145.00800(10) 2_665 . -202_455 N H6 C2 C19 163.50301(20) 2_665 . -203_555 N H6 C2 N5 146.1563 2_665 . -202_455 N H6 C2 N5 115.5249(5) 2_665 . -203_555 N H6 C2 H31 41.8845(7) 2_665 . -203_555 N H6 C2 H34 57.4906(16) 2_665 . -202_455 N H6 C2 H36 23.97980(20) 2_665 . -201_565 N H8 C2 C14 87.1212(4) 3_565 . -203_555 N H8 C2 C15 56.55890(10) 3_565 . -203_555 N H8 C2 C16 71.1201(8) 3_565 . -202_455 N H8 C2 C17 20.27550(30) 3_565 . -202_455 N H8 C2 C18 67.6164(10) 3_565 . -201_565 N H8 C2 C19 105.7280(8) 3_565 . -201_565 N H8 C2 C19 145.8358(10) 3_565 . -202_455 N H8 C2 C19 117.7262(5) 3_565 . -203_555 N H8 C2 N5 99.87090(30) 3_565 . -202_455 N H8 C2 N5 120.3780(9) 3_565 . -203_555 N H8 C2 H31 12.46960(10) 3_565 . -203_555 N H8 C2 H34 42.4618(6) 3_565 . -202_455 N H8 C2 H36 69.4244(5) 3_565 . -201_565 N C14 C2 C15 74.148 -203_555 . -203_555 N C14 C2 C16 17.8548(5) -203_555 . -202_455 N C14 C2 C17 102.3361(8) -203_555 . -202_455 N C14 C2 C18 20.2649(6) -203_555 . -201_565 N C14 C2 C19 166.5181(4) -203_555 . -201_565 N C14 C2 C19 127.0241(6) -203_555 . -202_455 N C14 C2 C19 130.6958(6) -203_555 . -203_555 N C14 C2 N5 135.8638(8) -203_555 . -202_455 N C14 C2 N5 141.2010(9) -203_555 . -203_555 N C14 C2 H31 91.8293(6) -203_555 . -203_555 N C14 C2 H34 118.0754(13) -203_555 . -202_455 N C14 C2 H36 44.7408(7) -203_555 . -201_565 N C15 C2 C16 59.0134(5) -203_555 . -202_455 N C15 C2 C17 74.27260(20) -203_555 . -202_455 N C15 C2 C18 68.70260(10) -203_555 . -201_565 N C15 C2 C19 109.26050(10) -203_555 . -201_565 N C15 C2 C19 127.42080(10) -203_555 . -202_455 N C15 C2 C19 155.1460(7) -203_555 . -203_555 N C15 C2 N5 144.4547(6) -203_555 . -202_455 N C15 C2 N5 97.54020(20) -203_555 . -203_555 N C15 C2 H31 47.33240(20) -203_555 . -203_555 N C15 C2 H34 50.5153(11) -203_555 . -202_455 N C15 C2 H36 30.0445(7) -203_555 . -201_565 N C16 C2 C17 88.3617(12) -202_455 . -202_455 N C16 C2 C18 13.3419(4) -202_455 . -201_565 N C16 C2 C19 167.89830(30) -202_455 . -201_565 N C16 C2 C19 142.73540(20) -202_455 . -202_455 N C16 C2 C19 145.40160(20) -202_455 . -203_555 N C16 C2 N5 144.2505(5) -202_455 . -202_455 N C16 C2 N5 144.6026(8) -202_455 . -203_555 N C16 C2 H31 74.5329(11) -202_455 . -203_555 N C16 C2 H34 100.2684(18) -202_455 . -202_455 N C16 C2 H36 32.0913(4) -202_455 . -201_565 N C17 C2 C18 82.0808(14) -202_455 . -201_565 N C17 C2 C19 91.1159(12) -202_455 . -201_565 N C17 C2 C19 128.7330(14) -202_455 . -202_455 N C17 C2 C19 97.4850(8) -202_455 . -203_555 N C17 C2 N5 79.6189(6) -202_455 . -202_455 N C17 C2 N5 111.8652(16) -202_455 . -203_555 N C17 C2 H31 26.941 -202_455 . -203_555 N C17 C2 H34 43.65530(10) -202_455 . -202_455 N C17 C2 H36 89.6965(8) -202_455 . -201_565 N C18 C2 C19 173.19119(20) -201_565 . -201_565 N C18 C2 C19 146.09821(10) -201_565 . -202_455 N C18 C2 C19 134.3909(6) -201_565 . -203_555 N C18 C2 N5 131.0103(9) -201_565 . -202_455 N C18 C2 N5 157.7156(5) -201_565 . -203_555 N C18 C2 H31 73.8017(11) -201_565 . -203_555 N C18 C2 H34 103.1415(17) -201_565 . -202_455 N C18 C2 H36 44.3936(7) -201_565 . -201_565 N C19 C2 C19 40.36190(20) -201_565 . -202_455 N C19 C2 C19 46.5966(6) -201_565 . -203_555 N C19 C2 N5 47.1135(9) -201_565 . -202_455 N C19 C2 N5 27.0166(6) -201_565 . -203_555 N C19 C2 H31 99.9581(10) -201_565 . -203_555 N C19 C2 H34 71.4007(16) -201_565 . -202_455 N C19 C2 H36 135.8335(7) -201_565 . -201_565 N C19 C2 C19 41.4968(4) -202_455 . -203_555 N C19 C2 N5 56.4881(7) -202_455 . -202_455 N C19 C2 N5 33.38660(30) -202_455 . -203_555 N C19 C2 H31 139.9832(12) -202_455 . -203_555 N C19 C2 H34 109.4351(18) -202_455 . -202_455 N C19 C2 H36 133.7008(5) -202_455 . -201_565 N C19 C2 N5 17.87040(20) -203_555 . -202_455 N C19 C2 N5 63.2193(10) -203_555 . -203_555 N C19 C2 H31 121.8565(8) -203_555 . -203_555 N C19 C2 H34 107.4414(18) -203_555 . -202_455 N C19 C2 H36 172.5029 -203_555 . -201_565 N N5 C2 N5 70.2805(14) -202_455 . -203_555 N N5 C2 H31 104.2722(7) -202_455 . -203_555 N N5 C2 H34 93.9575(17) -202_455 . -202_455 N N5 C2 H36 169.17230(10) -202_455 . -201_565 N N5 C2 H31 110.4265(10) -203_555 . -203_555 N N5 C2 H34 78.6860(15) -203_555 . -202_455 N N5 C2 H36 116.0172(12) -203_555 . -201_565 N H31 C2 H34 31.7405(5) -203_555 . -202_455 N H31 C2 H36 65.6196(8) -203_555 . -201_565 N H34 C2 H36 79.2732(18) -202_455 . -201_565 N C2 C3 C4 58.1589(6) 3_565 . 2_665 N C2 C3 C5 113.5709(17) 3_565 . 3_565 N C2 C3 C6 123.9707(16) 3_565 . 1_555 N C2 C3 C7 144.5221(9) 3_565 . 2_665 N C2 C3 N2 34.8553(5) 3_565 . 1_555 N C2 C3 N2 19.79610(10) 3_565 . 2_665 N C2 C3 H5 53.6387(15) 3_565 . 3_565 N C2 C3 H6 75.2971(8) 3_565 . 1_555 N C2 C3 H7 124.9724(9) 3_565 . 1_555 N C2 C3 H8 76.0206(19) 3_565 . 2_665 N C2 C3 H11 170.58290(20) 3_565 . 3_565 N C2 C3 C14 111.6005(19) 3_565 . -202_455 N C2 C3 C15 47.5160(8) 3_565 . -202_455 N C2 C3 C16 110.2378(15) 3_565 . -201_565 N C2 C3 C17 51.2507(15) 3_565 . -201_565 N C2 C3 C18 29.74670(10) 3_565 . -203_555 N C2 C3 N4 85.4420(19) 3_565 . -201_565 N C2 C3 N4 92.9423(18) 3_565 . -203_555 N C2 C3 H29 162.5887(4) 3_565 . -202_455 N C2 C3 H31 72.5665(18) 3_565 . -202_455 N C2 C3 H32 165.72231(30) 3_565 . -201_565 N C2 C3 H33 93.6511(8) 3_565 . -201_565 N C2 C3 H36 83.4018(4) 3_565 . -203_555 N C2 C3 H37 112.4773(15) 3_565 . -203_555 N C4 C3 C5 80.7888(18) 2_665 . 3_565 N C4 C3 C6 108.5958(11) 2_665 . 1_555 N C4 C3 C7 111.4838(10) 2_665 . 2_665 N C4 C3 N2 92.8310(11) 2_665 . 1_555 N C4 C3 N2 64.4478(6) 2_665 . 2_665 N C4 C3 H5 87.3393(16) 2_665 . 3_565 N C4 C3 H6 20.05340(10) 2_665 . 1_555 N C4 C3 H7 123.59890(30) 2_665 . 1_555 N C4 C3 H8 64.9808(8) 2_665 . 2_665 N C4 C3 H11 113.5374(8) 2_665 . 3_565 N C4 C3 C14 92.9119(14) 2_665 . -202_455 N C4 C3 C15 12.38540(20) 2_665 . -202_455 N C4 C3 C16 68.3079(18) 2_665 . -201_565 N C4 C3 C17 68.7558(10) 2_665 . -201_565 N C4 C3 C18 49.9020(4) 2_665 . -203_555 N C4 C3 N4 98.9871(8) 2_665 . -201_565 N C4 C3 N4 116.8313(6) 2_665 . -203_555 N C4 C3 H29 131.2500(4) 2_665 . -202_455 N C4 C3 H31 54.3293(6) 2_665 . -202_455 N C4 C3 H32 109.5571(10) 2_665 . -201_565 N C4 C3 H33 41.5524(13) 2_665 . -201_565 N C4 C3 H36 30.4687(10) 2_665 . -203_555 N C4 C3 H37 111.9361(7) 2_665 . -203_555 N C5 C3 C6 28.4858(7) 3_565 . 1_555 N C5 C3 C7 34.7116(9) 3_565 . 2_665 N C5 C3 N2 121.5593(10) 3_565 . 1_555 N C5 C3 N2 98.2713(15) 3_565 . 2_665 N C5 C3 H5 166.34470(20) 3_565 . 3_565 N C5 C3 H6 80.8793(14) 3_565 . 1_555 N C5 C3 H7 121.0460(8) 3_565 . 1_555 N C5 C3 H8 132.4287(11) 3_565 . 2_665 N C5 C3 H11 58.5694(15) 3_565 . 3_565 N C5 C3 C14 16.7222(4) 3_565 . -202_455 N C5 C3 C15 91.9268(20) 3_565 . -202_455 N C5 C3 C16 14.64850(20) 3_565 . -201_565 N C5 C3 C17 149.4828(8) 3_565 . -201_565 N C5 C3 C18 83.8447(16) 3_565 . -203_555 N C5 C3 N4 49.6603(7) 3_565 . -201_565 N C5 C3 N4 60.0483(11) 3_565 . -203_555 N C5 C3 H29 60.5416(17) 3_565 . -202_455 N C5 C3 H31 123.7687(13) 3_565 . -202_455 N C5 C3 H32 54.1739(14) 3_565 . -201_565 N C5 C3 H33 42.42000(30) 3_565 . -201_565 N C5 C3 H36 51.8923(7) 3_565 . -203_555 N C5 C3 H37 131.45340(20) 3_565 . -203_555 N C6 C3 C7 21.5701(7) 1_555 . 2_665 N C6 C3 N2 112.8408(14) 1_555 . 1_555 N C6 C3 N2 104.4857(16) 1_555 . 2_665 N C6 C3 H5 159.5821(6) 1_555 . 3_565 N C6 C3 H6 109.1014(7) 1_555 . 1_555 N C6 C3 H7 107.7482(6) 1_555 . 1_555 N C6 C3 H8 153.5986(5) 1_555 . 2_665 N C6 C3 H11 52.1391(16) 1_555 . 3_565 N C6 C3 C14 16.5174(4) 1_555 . -202_455 N C6 C3 C15 118.8809(13) 1_555 . -202_455 N C6 C3 C16 42.6303(9) 1_555 . -201_565 N C6 C3 C17 175.17599(10) 1_555 . -201_565 N C6 C3 C18 97.0272(14) 1_555 . -203_555 N C6 C3 N4 40.0488(4) 1_555 . -201_565 N C6 C3 N4 40.5665(5) 1_555 . -203_555 N C6 C3 H29 42.7580(14) 1_555 . -202_455 N C6 C3 H31 148.7476(7) 1_555 . -202_455 N C6 C3 H32 49.7811(15) 1_555 . -201_565 N C6 C3 H33 70.7874(4) 1_555 . -201_565 N C6 C3 H36 80.3674 1_555 . -203_555 N C6 C3 H37 121.86510(10) 1_555 . -203_555 N C7 C3 N2 132.2939(8) 2_665 . 1_555 N C7 C3 N2 125.5945(8) 2_665 . 2_665 N C7 C3 H5 158.9272(7) 2_665 . 3_565 N C7 C3 H6 104.2426(9) 2_665 . 1_555 N C7 C3 H7 89.7248 2_665 . 1_555 N C7 C3 H8 133.8036(12) 2_665 . 2_665 N C7 C3 H11 30.6590(8) 2_665 . 3_565 N C7 C3 C14 33.0034(10) 2_665 . -202_455 N C7 C3 C15 123.6731(12) 2_665 . -202_455 N C7 C3 C16 43.9716(9) 2_665 . -201_565 N C7 C3 C17 162.7929(6) 2_665 . -201_565 N C7 C3 C18 115.7495(8) 2_665 . -203_555 N C7 C3 N4 61.5941(11) 2_665 . -201_565 N C7 C3 N4 59.8471(12) 2_665 . -203_555 N C7 C3 H29 25.9288(8) 2_665 . -202_455 N C7 C3 H31 132.3920(12) 2_665 . -202_455 N C7 C3 H32 28.2194(8) 2_665 . -201_565 N C7 C3 H33 69.9722(4) 2_665 . -201_565 N C7 C3 H36 81.0154 2_665 . -203_555 N C7 C3 H37 102.8678(5) 2_665 . -203_555 N N2 C3 N2 33.1574(4) 1_555 . 2_665 N N2 C3 H5 51.9768(9) 1_555 . 3_565 N N2 C3 H6 110.0327(13) 1_555 . 1_555 N N2 C3 H7 110.64850(30) 1_555 . 1_555 N N2 C3 H8 93.3552(20) 1_555 . 2_665 N N2 C3 H11 152.27901(30) 1_555 . 3_565 N N2 C3 C14 109.7610(14) 1_555 . -202_455 N N2 C3 C15 82.3640(13) 1_555 . -202_455 N N2 C3 C16 127.4853(8) 1_555 . -201_565 N N2 C3 C17 63.8215(13) 1_555 . -201_565 N N2 C3 C18 51.8835(5) 1_555 . -203_555 N N2 C3 N4 74.8673(17) 1_555 . -201_565 N N2 C3 N4 72.6604(20) 1_555 . -203_555 N N2 C3 H29 131.5527(8) 1_555 . -202_455 N N2 C3 H31 95.2438(20) 1_555 . -202_455 N N2 C3 H32 154.76030(20) 1_555 . -201_565 N N2 C3 H33 123.34010(20) 1_555 . -201_565 N N2 C3 H36 114.88680(10) 1_555 . -203_555 N N2 C3 H37 104.9435(9) 1_555 . -203_555 N N2 C3 H5 70.2970(13) 2_665 . 3_565 N N2 C3 H6 84.0821(7) 2_665 . 1_555 N N2 C3 H7 140.2493(8) 2_665 . 1_555 N N2 C3 H8 95.6355(19) 2_665 . 2_665 N N2 C3 H11 155.8743 2_665 . 3_565 N N2 C3 C14 93.3061(18) 2_665 . -202_455 N N2 C3 C15 56.9236(7) 2_665 . -202_455 N N2 C3 C16 98.7424(13) 2_665 . -201_565 N N2 C3 C17 70.7893(14) 2_665 . -201_565 N N2 C3 C18 18.73320(10) 2_665 . -203_555 N N2 C3 N4 65.6466(19) 2_665 . -201_565 N N2 C3 N4 74.0227(17) 2_665 . -203_555 N N2 C3 H29 143.68559(30) 2_665 . -202_455 N N2 C3 H31 91.3989(17) 2_665 . -202_455 N N2 C3 H32 152.12041(10) 2_665 . -201_565 N N2 C3 H33 90.1828(6) 2_665 . -201_565 N N2 C3 H36 82.02770(30) 2_665 . -203_555 N N2 C3 H37 129.9167(13) 2_665 . -203_555 N H5 C3 H6 90.2835(13) 3_565 . 1_555 N H5 C3 H7 71.3529(6) 3_565 . 1_555 N H5 C3 H8 45.0799(11) 3_565 . 2_665 N H5 C3 H11 133.5624(13) 3_565 . 3_565 N H5 C3 C14 161.6923(5) 3_565 . -202_455 N H5 C3 C15 75.6764(18) 3_565 . -202_455 N H5 C3 C16 155.61870(30) 3_565 . -201_565 N H5 C3 C17 20.4411(6) 3_565 . -201_565 N H5 C3 C18 83.3477(14) 3_565 . -203_555 N H5 C3 N4 126.7722(8) 3_565 . -201_565 N H5 C3 N4 121.0187(11) 3_565 . -203_555 N H5 C3 H29 133.1118(15) 3_565 . -202_455 N H5 C3 H31 51.4439(13) 3_565 . -202_455 N H5 C3 H32 137.5819(12) 3_565 . -201_565 N H5 C3 H33 127.76210(20) 3_565 . -201_565 N H5 C3 H36 117.3080(6) 3_565 . -203_555 N H5 C3 H37 59.633 3_565 . -203_555 N H6 C3 H7 106.22600(10) 1_555 . 1_555 N H6 C3 H8 55.64220(30) 1_555 . 2_665 N H6 C3 H11 97.5027(10) 1_555 . 3_565 N H6 C3 C14 96.2136(10) 1_555 . -202_455 N H6 C3 C15 27.93700(10) 1_555 . -202_455 N H6 C3 C16 66.4843(16) 1_555 . -201_565 N H6 C3 C17 69.8970(7) 1_555 . -201_565 N H6 C3 C18 69.9484(4) 1_555 . -203_555 N H6 C3 N4 112.7264(5) 1_555 . -201_565 N H6 C3 N4 130.69119(30) 1_555 . -203_555 N H6 C3 H29 117.4796(4) 1_555 . -202_455 N H6 C3 H31 45.10350(10) 1_555 . -202_455 N H6 C3 H32 94.2640(11) 1_555 . -201_565 N H6 C3 H33 38.4795(11) 1_555 . -201_565 N H6 C3 H36 30.2438(7) 1_555 . -203_555 N H6 C3 H37 96.6861(4) 1_555 . -203_555 N H7 C3 H8 63.1812(6) 1_555 . 2_665 N H7 C3 H11 62.4860(8) 1_555 . 3_565 N H7 C3 C14 122.5269(9) 1_555 . -202_455 N H7 C3 C15 121.6419(5) 1_555 . -202_455 N H7 C3 C16 120.7284(5) 1_555 . -201_565 N H7 C3 C17 76.9711(4) 1_555 . -201_565 N H7 C3 C18 154.5074(8) 1_555 . -203_555 N H7 C3 N4 135.8395(6) 1_555 . -201_565 N H7 C3 N4 118.9481(4) 1_555 . -203_555 N H7 C3 H29 65.1307(8) 1_555 . -202_455 N H7 C3 H31 72.46320(30) 1_555 . -202_455 N H7 C3 H32 66.8861(7) 1_555 . -201_565 N H7 C3 H33 122.01710(10) 1_555 . -201_565 N H7 C3 H36 125.6423 1_555 . -203_555 N H7 C3 H37 14.5282(4) 1_555 . -203_555 N H8 C3 H11 105.1575(20) 2_665 . 3_565 N H8 C3 C14 149.1484(7) 2_665 . -202_455 N H8 C3 C15 59.3394(11) 2_665 . -202_455 N H8 C3 C16 118.0704(13) 2_665 . -201_565 N H8 C3 C17 29.5371(6) 2_665 . -201_565 N H8 C3 C18 96.7425(15) 2_665 . -203_555 N H8 C3 N4 160.0349 2_665 . -201_565 N H8 C3 N4 165.828 2_665 . -203_555 N H8 C3 H29 120.5587(16) 2_665 . -202_455 N H8 C3 H31 10.79530(20) 2_665 . -202_455 N H8 C3 H32 106.3898(20) 2_665 . -201_565 N H8 C3 H33 92.5537(8) 2_665 . -201_565 N H8 C3 H36 85.78410(30) 2_665 . -203_555 N H8 C3 H37 49.15280(10) 2_665 . -203_555 N H11 C3 C14 62.5705(18) 3_565 . -202_455 N H11 C3 C15 124.7774(10) 3_565 . -202_455 N H11 C3 C16 60.7746(13) 3_565 . -201_565 N H11 C3 C17 132.4259(14) 3_565 . -201_565 N H11 C3 C18 142.14391(10) 3_565 . -203_555 N H11 C3 N4 91.9384(19) 3_565 . -201_565 N H11 C3 N4 87.1983(19) 3_565 . -203_555 N H11 C3 H29 20.9128(5) 3_565 . -202_455 N H11 C3 H31 106.8253(19) 3_565 . -202_455 N H11 C3 H32 4.90300(10) 3_565 . -201_565 N H11 C3 H33 76.9966(6) 3_565 . -201_565 N H11 C3 H36 87.35580(20) 3_565 . -203_555 N H11 C3 H37 73.9829(13) 3_565 . -203_555 N C14 C3 C15 102.6491(17) -202_455 . -202_455 N C14 C3 C16 31.1518(5) -202_455 . -201_565 N C14 C3 C17 159.4334(5) -202_455 . -201_565 N C14 C3 C18 82.8528(17) -202_455 . -203_555 N C14 C3 N4 35.16480(30) -202_455 . -201_565 N C14 C3 N4 43.5057(7) -202_455 . -203_555 N C14 C3 H29 57.5661(17) -202_455 . -202_455 N C14 C3 H31 140.2235(9) -202_455 . -202_455 N C14 C3 H32 59.1166(17) -202_455 . -201_565 N C14 C3 H33 57.89960(10) -202_455 . -201_565 N C14 C3 H36 66.3048(4) -202_455 . -203_555 N C14 C3 H37 135.8707(4) -202_455 . -203_555 N C15 C3 C16 80.1125(20) -202_455 . -201_565 N C15 C3 C17 57.9854(12) -202_455 . -201_565 N C15 C3 C18 45.5139(4) -202_455 . -203_555 N C15 C3 N4 102.4696(11) -202_455 . -201_565 N C15 C3 N4 119.2088(9) -202_455 . -203_555 N C15 C3 H29 143.3897(5) -202_455 . -202_455 N C15 C3 H31 49.3855(8) -202_455 . -202_455 N C15 C3 H32 121.0891(11) -202_455 . -201_565 N C15 C3 H33 53.8621(15) -202_455 . -201_565 N C15 C3 H36 42.7310(11) -202_455 . -203_555 N C15 C3 H37 108.2782(10) -202_455 . -203_555 N C16 C3 C17 135.9785(9) -201_565 . -201_565 N C16 C3 C18 81.7618(14) -201_565 . -203_555 N C16 C3 N4 61.5244(9) -201_565 . -201_565 N C16 C3 N4 73.8350(12) -201_565 . -203_555 N C16 C3 H29 68.2434(17) -201_565 . -202_455 N C16 C3 H31 109.1570(15) -201_565 . -202_455 N C16 C3 H32 55.9324(12) -201_565 . -201_565 N C16 C3 H33 28.2124(5) -201_565 . -201_565 N C16 C3 H36 38.3567(9) -201_565 . -203_555 N C16 C3 H37 127.5448 -201_565 . -203_555 N C17 C3 C18 78.1758(12) -201_565 . -203_555 N C17 C3 N4 135.5645(5) -201_565 . -201_565 N C17 C3 N4 136.4435(6) -201_565 . -203_555 N C17 C3 H29 142.0222(12) -201_565 . -202_455 N C17 C3 H31 32.9410(7) -201_565 . -202_455 N C17 C3 H32 134.6033(14) -201_565 . -201_565 N C17 C3 H33 107.7835(4) -201_565 . -201_565 N C17 C3 H36 97.7678 -201_565 . -203_555 N C17 C3 H37 62.9106 -201_565 . -203_555 N C18 C3 N4 63.2945(15) -203_555 . -201_565 N C18 C3 N4 76.6391(13) -203_555 . -203_555 N C18 C3 H29 139.7691 -203_555 . -202_455 N C18 C3 H31 89.5391(13) -203_555 . -202_455 N C18 C3 H32 137.45630(20) -203_555 . -201_565 N C18 C3 H33 71.4592(6) -203_555 . -201_565 N C18 C3 H36 63.57120(30) -203_555 . -203_555 N C18 C3 H37 141.0467(13) -203_555 . -203_555 N N4 C3 N4 18.09030(20) -201_565 . -203_555 N N4 C3 H29 78.6967(16) -201_565 . -202_455 N N4 C3 H31 151.66350(30) -201_565 . -202_455 N N4 C3 H32 89.8132(19) -201_565 . -201_565 N N4 C3 H33 81.1425(5) -201_565 . -201_565 N N4 C3 H36 84.76920(10) -201_565 . -203_555 N N4 C3 H37 148.98190(10) -201_565 . -203_555 N N4 C3 H29 69.8168(14) -203_555 . -202_455 N N4 C3 H31 165.4214 -203_555 . -202_455 N N4 C3 H32 86.5119(19) -203_555 . -201_565 N N4 C3 H33 97.0632(7) -203_555 . -201_565 N N4 C3 H36 101.97440(30) -203_555 . -203_555 N N4 C3 H37 131.22830(10) -203_555 . -203_555 N H29 C3 H31 124.7279(14) -202_455 . -202_455 N H29 C3 H32 23.3718(6) -202_455 . -201_565 N H29 C3 H33 90.9796(10) -202_455 . -201_565 N H29 C3 H36 102.0731(7) -202_455 . -203_555 N H29 C3 H37 79.1118(13) -202_455 . -203_555 N H31 C3 H32 107.1141(19) -202_455 . -201_565 N H31 C3 H33 82.6316(10) -202_455 . -201_565 N H31 C3 H36 75.3311(5) -202_455 . -203_555 N H31 C3 H37 58.89390(10) -202_455 . -203_555 N H32 C3 H33 72.2899(4) -201_565 . -201_565 N H32 C3 H36 82.75950(10) -201_565 . -203_555 N H32 C3 H37 77.9536(12) -201_565 . -203_555 N H33 C3 H36 11.1695(4) -201_565 . -203_555 N H33 C3 H37 120.63410(20) -201_565 . -203_555 N H36 C3 H37 121.0471 -203_555 . -203_555 N C2 C4 C3 80.3212(12) 2_665 . 3_565 N C2 C4 C5 114.2583(14) 2_665 . 2_665 N C2 C4 C7 115.9666(13) 2_665 . 1_555 N C2 C4 N2 24.02630(10) 2_665 . 1_555 N C2 C4 N2 17.32690(20) 2_665 . 3_565 N C2 C4 H4 56.3085(10) 2_665 . 2_665 N C2 C4 H5 48.0412(7) 2_665 . 2_665 N C2 C4 H6 136.0965(12) 2_665 . 3_565 N C2 C4 H7 95.0108(4) 2_665 . 3_565 N C2 C4 H8 87.0577(12) 2_665 . 1_555 N C2 C4 H9 126.7429(5) 2_665 . 1_555 N C2 C4 H10 142.5113(5) 2_665 . 2_665 N C2 C4 H11 123.7366(9) 2_665 . 2_665 N C2 C4 C14 102.4713(17) 2_665 . -201_565 N C2 C4 C15 73.0051(14) 2_665 . -201_565 N C2 C4 C16 116.2477(13) 2_665 . -203_555 N C2 C4 C17 55.5012(9) 2_665 . -203_555 N C2 C4 C18 56.2345(14) 2_665 . -202_455 N C2 C4 C19 20.39 2_665 . -202_455 N C2 C4 H30 113.4499(10) 2_665 . -201_565 N C2 C4 H31 91.7662(16) 2_665 . -201_565 N C2 C4 H32 127.5652(9) 2_665 . -203_555 N C2 C4 H33 142.6460(5) 2_665 . -203_555 N C2 C4 H34 74.8477(16) 2_665 . -203_555 N C3 C4 C5 60.2449(7) 3_565 . 2_665 N C3 C4 C7 45.77980(20) 3_565 . 1_555 N C3 C4 N2 91.3267(7) 3_565 . 1_555 N C3 C4 N2 63.3624(10) 3_565 . 3_565 N C3 C4 H4 135.44200(30) 3_565 . 2_665 N C3 C4 H5 64.6208(18) 3_565 . 2_665 N C3 C4 H6 132.0023 3_565 . 3_565 N C3 C4 H7 35.04570(10) 3_565 . 3_565 N C3 C4 H8 80.4026(12) 3_565 . 1_555 N C3 C4 H9 151.7909(7) 3_565 . 1_555 N C3 C4 H10 105.2794(18) 3_565 . 2_665 N C3 C4 H11 43.59550(30) 3_565 . 2_665 N C3 C4 C14 53.0613(5) 3_565 . -201_565 N C3 C4 C15 149.66850(10) 3_565 . -201_565 N C3 C4 C16 53.4195(4) 3_565 . -203_555 N C3 C4 C17 74.8555(18) 3_565 . -203_555 N C3 C4 C18 30.88860(10) 3_565 . -202_455 N C3 C4 C19 97.8483(12) 3_565 . -202_455 N C3 C4 H30 165.83170(30) 3_565 . -201_565 N C3 C4 H31 96.6314(10) 3_565 . -201_565 N C3 C4 H32 47.7726(4) 3_565 . -203_555 N C3 C4 H33 115.9134(18) 3_565 . -203_555 N C3 C4 H34 119.2553(7) 3_565 . -203_555 N C5 C4 C7 19.4985(7) 2_665 . 1_555 N C5 C4 N2 102.6494(11) 2_665 . 1_555 N C5 C4 N2 100.5575(10) 2_665 . 3_565 N C5 C4 H4 143.7755(11) 2_665 . 2_665 N C5 C4 H5 124.4847(11) 2_665 . 2_665 N C5 C4 H6 108.45590(10) 2_665 . 3_565 N C5 C4 H7 81.5282(5) 2_665 . 3_565 N C5 C4 H8 128.8802(7) 2_665 . 1_555 N C5 C4 H9 96.98850(20) 2_665 . 1_555 N C5 C4 H10 47.8291(12) 2_665 . 2_665 N C5 C4 H11 41.6975(12) 2_665 . 2_665 N C5 C4 C14 12.0181(4) 2_665 . -201_565 N C5 C4 C15 145.2596(10) 2_665 . -201_565 N C5 C4 C16 9.54040(30) 2_665 . -203_555 N C5 C4 C17 135.0600(11) 2_665 . -203_555 N C5 C4 C18 64.63810(30) 2_665 . -202_455 N C5 C4 C19 133.1349(14) 2_665 . -202_455 N C5 C4 H30 108.79450(30) 2_665 . -201_565 N C5 C4 H31 139.0627(7) 2_665 . -201_565 N C5 C4 H32 39.1847(12) 2_665 . -203_555 N C5 C4 H33 58.6234(12) 2_665 . -203_555 N C5 C4 H34 169.77820(30) 2_665 . -203_555 N C7 C4 N2 112.2141(8) 1_555 . 1_555 N C7 C4 N2 99.4169(11) 1_555 . 3_565 N C7 C4 H4 161.9973(5) 1_555 . 2_665 N C7 C4 H5 109.8313(16) 1_555 . 2_665 N C7 C4 H6 107.6439 1_555 . 3_565 N C7 C4 H7 62.23070(20) 1_555 . 3_565 N C7 C4 H8 109.5116(14) 1_555 . 1_555 N C7 C4 H9 107.6516(5) 1_555 . 1_555 N C7 C4 H10 59.4999(16) 1_555 . 2_665 N C7 C4 H11 23.2673(6) 1_555 . 2_665 N C7 C4 C14 22.3959(7) 1_555 . -201_565 N C7 C4 C15 163.47760(30) 1_555 . -201_565 N C7 C4 C16 10.01810(30) 1_555 . -203_555 N C7 C4 C17 118.2863(17) 1_555 . -203_555 N C7 C4 C18 60.27240(10) 1_555 . -202_455 N C7 C4 C19 136.3473(12) 1_555 . -202_455 N C7 C4 H30 121.14990(10) 1_555 . -201_565 N C7 C4 H31 120.9521(13) 1_555 . -201_565 N C7 C4 H32 21.9052(6) 1_555 . -203_555 N C7 C4 H33 70.1761(16) 1_555 . -203_555 N C7 C4 H34 153.0795(9) 1_555 . -203_555 N N2 C4 N2 32.75660(20) 1_555 . 3_565 N N2 C4 H4 53.3827(4) 1_555 . 2_665 N N2 C4 H5 72.0666(7) 1_555 . 2_665 N N2 C4 H6 135.2307(7) 1_555 . 3_565 N N2 C4 H7 115.08450(20) 1_555 . 3_565 N N2 C4 H8 110.0119(13) 1_555 . 1_555 N N2 C4 H9 111.08110(10) 1_555 . 1_555 N N2 C4 H10 118.9386(6) 1_555 . 2_665 N N2 C4 H11 129.33540(30) 1_555 . 2_665 N N2 C4 C14 92.6151(14) 1_555 . -201_565 N N2 C4 C15 69.8362(8) 1_555 . -201_565 N N2 C4 C16 108.1818(9) 1_555 . -203_555 N N2 C4 C17 78.9186(9) 1_555 . -203_555 N N2 C4 C18 61.4579(8) 1_555 . -202_455 N N2 C4 C19 32.44960(20) 1_555 . -202_455 N N2 C4 H30 100.3076(5) 1_555 . -201_565 N N2 C4 H31 111.7892(16) 1_555 . -201_565 N N2 C4 H32 131.26469(30) 1_555 . -203_555 N N2 C4 H33 118.6663(5) 1_555 . -203_555 N N2 C4 H34 87.5234(14) 1_555 . -203_555 N N2 C4 H4 73.6346(8) 3_565 . 2_665 N N2 C4 H5 46.16150(20) 3_565 . 2_665 N N2 C4 H6 150.9773(10) 3_565 . 3_565 N N2 C4 H7 82.37870(30) 3_565 . 3_565 N N2 C4 H8 87.8166(8) 3_565 . 1_555 N N2 C4 H9 142.6702(4) 3_565 . 1_555 N N2 C4 H10 139.5714 3_565 . 2_665 N N2 C4 H11 106.5256(8) 3_565 . 2_665 N N2 C4 C14 88.5399(14) 3_565 . -201_565 N N2 C4 C15 90.3056(12) 3_565 . -201_565 N N2 C4 C16 100.9159(10) 3_565 . -203_555 N N2 C4 C17 57.1379(4) 3_565 . -203_555 N N2 C4 C18 39.2308(12) 3_565 . -202_455 N N2 C4 C19 37.14210(20) 3_565 . -202_455 N N2 C4 H30 130.0921(8) 3_565 . -201_565 N N2 C4 H31 96.9077(11) 3_565 . -201_565 N N2 C4 H32 110.2695(7) 3_565 . -203_555 N N2 C4 H33 144.89200(10) 3_565 . -203_555 N N2 C4 H34 87.4268(13) 3_565 . -203_555 N H4 C4 H5 77.7145(18) 2_665 . 2_665 N H4 C4 H6 83.16090(30) 2_665 . 3_565 N H4 C4 H7 131.1292(5) 2_665 . 3_565 N H4 C4 H8 87.1148(18) 2_665 . 1_555 N H4 C4 H9 72.7520(4) 2_665 . 1_555 N H4 C4 H10 115.1155(17) 2_665 . 2_665 N H4 C4 H11 174.52440(10) 2_665 . 2_665 N H4 C4 C14 139.6221(12) 2_665 . -201_565 N H4 C4 C15 17.0522(4) 2_665 . -201_565 N H4 C4 C16 153.1161(8) 2_665 . -203_555 N H4 C4 C17 72.4405(19) 2_665 . -203_555 N H4 C4 C18 111.8511(4) 2_665 . -202_455 N H4 C4 C19 37.6470(10) 2_665 . -202_455 N H4 C4 H30 58.7257 2_665 . -201_565 N H4 C4 H31 76.7916(18) 2_665 . -201_565 N H4 C4 H32 175.34340(10) 2_665 . -203_555 N H4 C4 H33 105.6953(16) 2_665 . -203_555 N H4 C4 H34 44.6999(14) 2_665 . -203_555 N H5 C4 H6 112.4567(7) 2_665 . 3_565 N H5 C4 H7 55.5083(12) 2_665 . 3_565 N H5 C4 H8 41.6630(5) 2_665 . 1_555 N H5 C4 H9 137.4008(9) 2_665 . 1_555 N H5 C4 H10 166.27390(10) 2_665 . 2_665 N H5 C4 H11 98.3834(18) 2_665 . 2_665 N H5 C4 C14 115.3365(14) 2_665 . -201_565 N H5 C4 C15 86.5403(20) 2_665 . -201_565 N H5 C4 C16 118.0299(14) 2_665 . -203_555 N H5 C4 C17 13.10790(10) 2_665 . -203_555 N H5 C4 C18 65.1663(13) 2_665 . -202_455 N H5 C4 C19 49.3328(9) 2_665 . -202_455 N H5 C4 H30 126.6699(14) 2_665 . -201_565 N H5 C4 H31 52.4211(8) 2_665 . -201_565 N H5 C4 H32 103.0384(17) 2_665 . -203_555 N H5 C4 H33 168.80991(20) 2_665 . -203_555 N H5 C4 H34 57.4506(12) 2_665 . -203_555 N H6 C4 H7 100.87480(10) 3_565 . 3_565 N H6 C4 H8 73.59510(10) 3_565 . 1_555 N H6 C4 H9 34.8592 3_565 . 1_555 N H6 C4 H10 66.4944(10) 3_565 . 2_665 N H6 C4 H11 94.9322(4) 3_565 . 2_665 N H6 C4 C14 120.4707(4) 3_565 . -201_565 N H6 C4 C15 66.18190(10) 3_565 . -201_565 N H6 C4 C16 107.565 3_565 . -203_555 N H6 C4 C17 99.6333(6) 3_565 . -203_555 N H6 C4 C18 162.85860(10) 3_565 . -202_455 N H6 C4 C19 115.7805(12) 3_565 . -202_455 N H6 C4 H30 39.4036 3_565 . -201_565 N H6 C4 H31 60.25790(10) 3_565 . -201_565 N H6 C4 H32 92.3400(4) 3_565 . -203_555 N H6 C4 H33 58.1908(9) 3_565 . -203_555 N H6 C4 H34 63.66750(30) 3_565 . -203_555 N H7 C4 H8 49.4207(11) 3_565 . 1_555 N H7 C4 H9 132.98019(10) 3_565 . 1_555 N H7 C4 H10 110.8147(11) 3_565 . 2_665 N H7 C4 H11 44.1208(6) 3_565 . 2_665 N H7 C4 C14 79.6405(4) 3_565 . -201_565 N H7 C4 C15 132.9096(5) 3_565 . -201_565 N H7 C4 C16 72.22190(10) 3_565 . -203_555 N H7 C4 C17 58.8010(14) 3_565 . -203_555 N H7 C4 C18 63.26550(10) 3_565 . -202_455 N H7 C4 C19 103.84840(30) 3_565 . -202_455 N H7 C4 H30 140.24420(10) 3_565 . -201_565 N H7 C4 H31 64.4398(10) 3_565 . -201_565 N H7 C4 H32 48.5062(5) 3_565 . -203_555 N H7 C4 H33 117.7927(10) 3_565 . -203_555 N H7 C4 H34 93.3363(6) 3_565 . -203_555 N H8 C4 H9 106.16230(20) 1_555 . 1_555 N H8 C4 H10 130.3558(7) 1_555 . 2_665 N H8 C4 H11 87.4221(19) 1_555 . 2_665 N H8 C4 C14 128.9541(8) 1_555 . -201_565 N H8 C4 C15 84.0146(17) 1_555 . -201_565 N H8 C4 C16 119.3493(11) 1_555 . -203_555 N H8 C4 C17 31.6458(4) 1_555 . -203_555 N H8 C4 C18 98.1395(5) 1_555 . -202_455 N H8 C4 C19 79.7722(15) 1_555 . -202_455 N H8 C4 H30 102.8411(7) 1_555 . -201_565 N H8 C4 H31 16.35570(10) 1_555 . -201_565 N H8 C4 H32 90.4680(19) 1_555 . -203_555 N H8 C4 H33 127.2711(7) 1_555 . -203_555 N H8 C4 H34 44.3439(5) 1_555 . -203_555 N H9 C4 H10 49.3128(10) 1_555 . 2_665 N H9 C4 H11 108.4933(4) 1_555 . 2_665 N H9 C4 C14 107.0501(5) 1_555 . -201_565 N H9 C4 C15 58.0954(8) 1_555 . -201_565 N H9 C4 C16 101.6744(4) 1_555 . -203_555 N H9 C4 C17 124.8166(8) 1_555 . -203_555 N H9 C4 C18 155.54269(30) 1_555 . -202_455 N H9 C4 C19 110.2707(5) 1_555 . -202_455 N H9 C4 H30 14.0550(4) 1_555 . -201_565 N H9 C4 H31 90.8319 1_555 . -201_565 N H9 C4 H32 104.16820(30) 1_555 . -203_555 N H9 C4 H33 38.4413(10) 1_555 . -203_555 N H9 C4 H34 80.00000(30) 1_555 . -203_555 N H10 C4 H11 68.4648(17) 2_665 . 2_665 N H10 C4 C14 58.6172(16) 2_665 . -201_565 N H10 C4 C15 104.6564(20) 2_665 . -201_565 N H10 C4 C16 52.5105(14) 2_665 . -203_555 N H10 C4 C17 161.9799(4) 2_665 . -203_555 N H10 C4 C18 111.4627(15) 2_665 . -202_455 N H10 C4 C19 144.2166(8) 2_665 . -202_455 N H10 C4 H30 61.9809(15) 2_665 . -201_565 N H10 C4 H31 123.4271(11) 2_665 . -201_565 N H10 C4 H32 63.7656(16) 2_665 . -203_555 N H10 C4 H33 10.8817 2_665 . -203_555 N H10 C4 H34 127.6808(14) 2_665 . -203_555 N H11 C4 C14 45.5481(13) 2_665 . -201_565 N H11 C4 C15 160.8126(5) 2_665 . -201_565 N H11 C4 C16 32.3367(8) 2_665 . -203_555 N H11 C4 C17 102.9198(19) 2_665 . -203_555 N H11 C4 C18 69.3417(5) 2_665 . -202_455 N H11 C4 C19 141.1622(10) 2_665 . -202_455 N H11 C4 H30 122.3518 2_665 . -201_565 N H11 C4 H31 97.7975(19) 2_665 . -201_565 N H11 C4 H32 4.72150(10) 2_665 . -203_555 N H11 C4 H33 77.4202(16) 2_665 . -203_555 N H11 C4 H34 129.9136(14) 2_665 . -203_555 N C14 C4 C15 146.9115(9) -201_565 . -201_565 N C14 C4 C16 15.6258(5) -201_565 . -203_555 N C14 C4 C17 127.1393(13) -201_565 . -203_555 N C14 C4 C18 53.12120(10) -201_565 . -202_455 N C14 C4 C19 121.7987(17) -201_565 . -202_455 N C14 C4 H30 117.7258 -201_565 . -201_565 N C14 C4 H31 142.4173(7) -201_565 . -201_565 N C14 C4 H32 44.2743(13) -201_565 . -203_555 N C14 C4 H33 69.1862(15) -201_565 . -203_555 N C14 C4 H34 172.31520(20) -201_565 . -203_555 N C15 C4 C16 154.1012(7) -201_565 . -203_555 N C15 C4 C17 78.2167(20) -201_565 . -203_555 N C15 C4 C18 128.8672 -201_565 . -202_455 N C15 C4 C19 53.5955(14) -201_565 . -202_455 N C15 C4 H30 44.1376(4) -201_565 . -201_565 N C15 C4 H31 70.4856(15) -201_565 . -201_565 N C15 C4 H32 158.5178(5) -201_565 . -203_555 N C15 C4 H33 94.2221(19) -201_565 . -203_555 N C15 C4 H34 39.7081(11) -201_565 . -203_555 N C16 C4 C17 127.4286(14) -203_555 . -203_555 N C16 C4 C18 62.84160(20) -203_555 . -202_455 N C16 C4 C19 136.2726(13) -203_555 . -202_455 N C16 C4 H30 114.46050(10) -203_555 . -201_565 N C16 C4 H31 130.0412(10) -203_555 . -201_565 N C16 C4 H32 30.1202(8) -203_555 . -203_555 N C16 C4 H33 63.3788(14) -203_555 . -203_555 N C16 C4 H34 161.9495(6) -203_555 . -203_555 N C17 C4 C18 78.2052(11) -203_555 . -202_455 N C17 C4 C19 51.2624(12) -203_555 . -202_455 N C17 C4 H30 115.1259(14) -203_555 . -201_565 N C17 C4 H31 40.0940(7) -203_555 . -201_565 N C17 C4 H32 107.2879(19) -203_555 . -203_555 N C17 C4 H33 157.50320(30) -203_555 . -203_555 N C17 C4 H34 45.3892(11) -203_555 . -203_555 N C18 C4 C19 76.3643(14) -202_455 . -202_455 N C18 C4 H30 156.1908 -202_455 . -201_565 N C18 C4 H31 113.6224(4) -202_455 . -201_565 N C18 C4 H32 72.4279(5) -202_455 . -203_555 N C18 C4 H33 121.6217(14) -202_455 . -203_555 N C18 C4 H34 120.85600(10) -202_455 . -203_555 N C19 C4 H30 96.3041(10) -202_455 . -201_565 N C19 C4 H31 79.4466(18) -202_455 . -201_565 N C19 C4 H32 145.5580(9) -202_455 . -203_555 N C19 C4 H33 138.3588(7) -202_455 . -203_555 N C19 C4 H34 56.6260(17) -202_455 . -203_555 N H30 C4 H31 86.5979(6) -201_565 . -201_565 N H30 C4 H32 118.10530(10) -201_565 . -203_555 N H30 C4 H33 51.1490(15) -201_565 . -203_555 N H30 C4 H34 69.74620(30) -201_565 . -203_555 N H31 C4 H32 99.9510(19) -201_565 . -203_555 N H31 C4 H33 117.4147(10) -201_565 . -203_555 N H31 C4 H34 32.1327(5) -201_565 . -203_555 N H32 C4 H33 72.6994(15) -203_555 . -203_555 N H32 C4 H34 131.8682(14) -203_555 . -203_555 N H33 C4 H34 117.3682(13) -203_555 . -203_555 N C2 C5 C3 34.6086(9) 1_555 . 2_665 N C2 C5 C4 29.1348(10) 1_555 . 3_565 N C2 C5 C6 132.0394(15) 1_555 . 2_665 N C2 C5 C7 129.3944(12) 1_555 . 3_565 N C2 C5 N3 113.9802(16) 1_555 . 1_555 N C2 C5 N3 106.3315(16) 1_555 . 3_565 N C2 C5 H6 49.9925(15) 1_555 . 2_665 N C2 C5 H9 65.0952(16) 1_555 . 3_565 N C2 C5 H10 106.9644(4) 1_555 . 1_555 N C2 C5 H11 107.70610(30) 1_555 . 1_555 N C2 C5 H15 166.15790(30) 1_555 . 3_565 N C2 C5 H12 152.2739(8) 1_555 . 2_665 N C2 C5 C14 86.7269(11) 1_555 . -203_555 N C2 C5 C15 31.6650(11) 1_555 . -203_555 N C2 C5 C16 38.8717(12) 1_555 . -202_455 N C2 C5 C18 13.2969(4) 1_555 . -201_565 N C2 C5 N4 78.6726(9) 1_555 . -201_565 N C2 C5 N4 80.4019(8) 1_555 . -202_455 N C2 C5 H28 145.8602(8) 1_555 . -203_555 N C2 C5 H29 105.2208(7) 1_555 . -203_555 N C2 C5 H32 114.8901(4) 1_555 . -202_455 N C2 C5 H33 88.3420(11) 1_555 . -202_455 N C2 C5 H36 62.8561(16) 1_555 . -201_565 N C2 C5 H37 55.5867(11) 1_555 . -201_565 N C3 C5 C4 38.9663(11) 2_665 . 3_565 N C3 C5 C6 122.5276(16) 2_665 . 2_665 N C3 C5 C7 97.7531(20) 2_665 . 3_565 N C3 C5 N3 124.8136(11) 2_665 . 1_555 N C3 C5 N3 103.5078(15) 2_665 . 3_565 N C3 C5 H6 54.2023(14) 2_665 . 2_665 N C3 C5 H9 79.4498(18) 2_665 . 3_565 N C3 C5 H10 120.6552(7) 2_665 . 1_555 N C3 C5 H11 73.2684(12) 2_665 . 1_555 N C3 C5 H15 139.5418(10) 2_665 . 3_565 N C3 C5 H12 172.98320(10) 2_665 . 2_665 N C3 C5 C14 88.2490(9) 2_665 . -203_555 N C3 C5 C15 48.7680(14) 2_665 . -203_555 N C3 C5 C16 27.0739(7) 2_665 . -202_455 N C3 C5 C18 21.3217(5) 2_665 . -201_565 N C3 C5 N4 83.6529(6) 2_665 . -201_565 N C3 C5 N4 97.40100(30) 2_665 . -202_455 N C3 C5 H28 171.57561(20) 2_665 . -203_555 N C3 C5 H29 72.2506(16) 2_665 . -203_555 N C3 C5 H32 80.6680(13) 2_665 . -202_455 N C3 C5 H33 102.5382(14) 2_665 . -202_455 N C3 C5 H36 77.5003(18) 2_665 . -201_565 N C3 C5 H37 21.82610(20) 2_665 . -201_565 N C4 C5 C6 159.3367(6) 3_565 . 2_665 N C4 C5 C7 131.0525(11) 3_565 . 3_565 N C4 C5 N3 141.7164(6) 3_565 . 1_555 N C4 C5 N3 134.6369(6) 3_565 . 3_565 N C4 C5 H6 21.0729(6) 3_565 . 2_665 N C4 C5 H9 41.6360(8) 3_565 . 3_565 N C4 C5 H10 84.76790(30) 3_565 . 1_555 N C4 C5 H11 96.9722(7) 3_565 . 1_555 N C4 C5 H15 137.0485(13) 3_565 . 3_565 N C4 C5 H12 144.1823(11) 3_565 . 2_665 N C4 C5 C14 115.33730(20) 3_565 . -203_555 N C4 C5 C15 10.4936(4) 3_565 . -203_555 N C4 C5 C16 20.1915(6) 3_565 . -202_455 N C4 C5 C18 29.4988(10) 3_565 . -201_565 N C4 C5 N4 107.59530(10) 3_565 . -201_565 N C4 C5 N4 108.39190(10) 3_565 . -202_455 N C4 C5 H28 135.2442(12) 3_565 . -203_555 N C4 C5 H29 106.0986(7) 3_565 . -203_555 N C4 C5 H32 101.8946(9) 3_565 . -202_455 N C4 C5 H33 65.6582(4) 3_565 . -202_455 N C4 C5 H36 39.5114(8) 3_565 . -201_565 N C4 C5 H37 50.4158(9) 3_565 . -201_565 N C6 C5 C7 44.7093(10) 2_665 . 3_565 N C6 C5 N3 29.9940(5) 2_665 . 1_555 N C6 C5 N3 25.76820(10) 2_665 . 3_565 N C6 C5 H6 172.77580(20) 2_665 . 2_665 N C6 C5 H9 158.01421(20) 2_665 . 3_565 N C6 C5 H10 115.6051(9) 2_665 . 1_555 N C6 C5 H11 81.1674(6) 2_665 . 1_555 N C6 C5 H15 61.2242(18) 2_665 . 3_565 N C6 C5 H12 55.5449(16) 2_665 . 2_665 N C6 C5 C14 45.4230(4) 2_665 . -203_555 N C6 C5 C15 163.2511(4) 2_665 . -203_555 N C6 C5 C16 147.5097(9) 2_665 . -202_455 N C6 C5 C18 129.8608(16) 2_665 . -201_565 N C6 C5 N4 53.7635(6) 2_665 . -201_565 N C6 C5 N4 58.5799(4) 2_665 . -202_455 N C6 C5 H28 64.2722(17) 2_665 . -203_555 N C6 C5 H29 65.1662(4) 2_665 . -203_555 N C6 C5 H32 78.7449(8) 2_665 . -202_455 N C6 C5 H33 134.53130(20) 2_665 . -202_455 N C6 C5 H36 159.90480(30) 2_665 . -201_565 N C6 C5 H37 116.8630(13) 2_665 . -201_565 N C7 C5 N3 74.3742(14) 3_565 . 1_555 N C7 C5 N3 58.3750(9) 3_565 . 3_565 N C7 C5 H6 128.0856(12) 3_565 . 2_665 N C7 C5 H9 140.8922(7) 3_565 . 3_565 N C7 C5 H10 116.1209(6) 3_565 . 1_555 N C7 C5 H11 36.4899(4) 3_565 . 1_555 N C7 C5 H15 54.6318(12) 3_565 . 3_565 N C7 C5 H12 76.2949(19) 3_565 . 2_665 N C7 C5 C14 72.1575(4) 3_565 . -203_555 N C7 C5 C15 141.1410(8) 3_565 . -203_555 N C7 C5 C16 110.9134(17) 3_565 . -202_455 N C7 C5 C18 117.2721(16) 3_565 . -201_565 N C7 C5 N4 80.29900(20) 3_565 . -201_565 N C7 C5 N4 96.3328(5) 3_565 . -202_455 N C7 C5 H28 84.0957(20) 3_565 . -203_555 N C7 C5 H29 25.6924(4) 3_565 . -203_555 N C7 C5 H32 34.39420(10) 3_565 . -202_455 N C7 C5 H33 129.52220(10) 3_565 . -202_455 N C7 C5 H36 141.9342(7) 3_565 . -201_565 N C7 C5 H37 81.2420(20) 3_565 . -201_565 N N3 C5 N3 26.31110(30) 1_555 . 3_565 N N3 C5 H6 156.93170(30) 1_555 . 2_665 N N3 C5 H9 138.6706(7) 1_555 . 3_565 N N3 C5 H10 111.0431(4) 1_555 . 1_555 N N3 C5 H11 110.5055(10) 1_555 . 1_555 N N3 C5 H15 79.6388(19) 1_555 . 3_565 N N3 C5 H12 57.6106(12) 1_555 . 2_665 N N3 C5 C14 36.81780(20) 1_555 . -203_555 N N3 C5 C15 137.5961(8) 1_555 . -203_555 N N3 C5 C16 149.7379(5) 1_555 . -202_455 N N3 C5 C18 119.0371(14) 1_555 . -201_565 N N3 C5 N4 41.2542(5) 1_555 . -201_565 N N3 C5 N4 33.6010(8) 1_555 . -202_455 N N3 C5 H28 63.6082(13) 1_555 . -203_555 N N3 C5 H29 91.7931(9) 1_555 . -203_555 N N3 C5 H32 108.6519(13) 1_555 . -202_455 N N3 C5 H33 124.84960(20) 1_555 . -202_455 N N3 C5 H36 139.1009(7) 1_555 . -201_565 N N3 C5 H37 132.1209(7) 1_555 . -201_565 N N3 C5 H6 155.52271(10) 3_565 . 2_665 N N3 C5 H9 160.51570(20) 3_565 . 3_565 N N3 C5 H10 135.4733(8) 3_565 . 1_555 N N3 C5 H11 90.6778(5) 3_565 . 1_555 N N3 C5 H15 86.9919(19) 3_565 . 3_565 N N3 C5 H12 76.7040(15) 3_565 . 2_665 N N3 C5 C14 19.6559(4) 3_565 . -203_555 N N3 C5 C15 137.5564(5) 3_565 . -203_555 N N3 C5 C16 130.5775(8) 3_565 . -202_455 N N3 C5 C18 105.5239(16) 3_565 . -201_565 N N3 C5 N4 28.1047(7) 3_565 . -201_565 N N3 C5 N4 38.0478(4) 3_565 . -202_455 N N3 C5 H28 84.4883(16) 3_565 . -203_555 N N3 C5 H29 69.0241(5) 3_565 . -203_555 N N3 C5 H32 91.4015(8) 3_565 . -202_455 N N3 C5 H33 151.06140(10) 3_565 . -202_455 N N3 C5 H36 159.68370(20) 3_565 . -201_565 N N3 C5 H37 106.3702(11) 3_565 . -201_565 N H6 C5 H9 26.3858(4) 2_665 . 3_565 N H6 C5 H10 66.6425(8) 2_665 . 1_555 N H6 C5 H11 91.6161(8) 2_665 . 1_555 N H6 C5 H15 116.3092(19) 2_665 . 3_565 N H6 C5 H12 126.7525(15) 2_665 . 2_665 N H6 C5 C14 136.4035(4) 2_665 . -203_555 N H6 C5 C15 20.7840(6) 2_665 . -203_555 N H6 C5 C16 27.8719(8) 2_665 . -202_455 N H6 C5 C18 50.0000(15) 2_665 . -201_565 N H6 C5 N4 128.6280(7) 2_665 . -201_565 N H6 C5 N4 126.7200(6) 2_665 . -202_455 N H6 C5 H28 118.3954(16) 2_665 . -203_555 N H6 C5 H29 107.8392(6) 2_665 . -203_555 N H6 C5 H32 94.1430(10) 2_665 . -202_455 N H6 C5 H33 48.35590(10) 2_665 . -202_455 N H6 C5 H36 24.8498(4) 2_665 . -201_565 N H6 C5 H37 57.4312(11) 2_665 . -201_565 N H9 C5 H10 43.2844(11) 3_565 . 1_555 N H9 C5 H11 108.46980(30) 3_565 . 1_555 N H9 C5 H15 103.3458(18) 3_565 . 3_565 N H9 C5 H12 102.7350(18) 3_565 . 2_665 N H9 C5 C14 145.68770(30) 3_565 . -203_555 N H9 C5 C15 34.2536(5) 3_565 . -203_555 N H9 C5 C16 54.0808(12) 3_565 . -202_455 N H9 C5 C18 70.2768(17) 3_565 . -201_565 N H9 C5 N4 136.9859(5) 3_565 . -201_565 N H9 C5 N4 122.76590(20) 3_565 . -202_455 N H9 C5 H28 93.9046(19) 3_565 . -203_555 N H9 C5 H29 129.22501(20) 3_565 . -203_555 N H9 C5 H32 108.0606(6) 3_565 . -202_455 N H9 C5 H33 24.1050(4) 3_565 . -202_455 N H9 C5 H36 2.2438 3_565 . -201_565 N H9 C5 H37 83.6463(15) 3_565 . -201_565 N H10 C5 H11 106.26820(10) 1_555 . 1_555 N H10 C5 H15 63.7746(6) 1_555 . 3_565 N H10 C5 H12 60.2068(7) 1_555 . 2_665 N H10 C5 C14 146.25121(30) 1_555 . -203_555 N H10 C5 C15 77.4136(6) 1_555 . -203_555 N H10 C5 C16 93.6666 1_555 . -202_455 N H10 C5 C18 113.5207(7) 1_555 . -201_565 N H10 C5 N4 145.61240(10) 1_555 . -201_565 N H10 C5 N4 123.1319 1_555 . -202_455 N H10 C5 H28 51.7535(8) 1_555 . -203_555 N H10 C5 H29 127.43060(20) 1_555 . -203_555 N H10 C5 H32 100.47360(10) 1_555 . -202_455 N H10 C5 H33 19.1815(7) 1_555 . -202_455 N H10 C5 H36 45.4798(11) 1_555 . -201_565 N H10 C5 H37 116.64570(30) 1_555 . -201_565 N H11 C5 H15 67.56810(20) 1_555 . 3_565 N H11 C5 H12 99.7340(11) 1_555 . 2_665 N H11 C5 C14 98.18150(30) 1_555 . -203_555 N H11 C5 C15 106.0904(4) 1_555 . -203_555 N H11 C5 C16 77.0864(13) 1_555 . -202_455 N H11 C5 C18 94.5220(7) 1_555 . -201_565 N H11 C5 N4 103.91140(20) 1_555 . -201_565 N H11 C5 N4 125.40630(30) 1_555 . -202_455 N H11 C5 H28 104.3599(11) 1_555 . -203_555 N H11 C5 H29 23.1179 1_555 . -203_555 N H11 C5 H32 7.82380(10) 1_555 . -202_455 N H11 C5 H33 108.80050(20) 1_555 . -202_455 N H11 C5 H36 108.75960(30) 1_555 . -201_565 N H11 C5 H37 52.1884(14) 1_555 . -201_565 N H15 C5 H12 33.5807(9) 3_565 . 2_665 N H15 C5 C14 106.6472(14) 3_565 . -203_555 N H15 C5 C15 135.3968(14) 3_565 . -203_555 N H15 C5 C16 128.5715(15) 3_565 . -202_455 N H15 C5 C18 158.6047(6) 3_565 . -201_565 N H15 C5 N4 114.8923(12) 3_565 . -201_565 N H15 C5 N4 113.1183(11) 3_565 . -202_455 N H15 C5 H28 36.8429(9) 3_565 . -203_555 N H15 C5 H29 75.6459(7) 3_565 . -203_555 N H15 C5 H32 59.84490(30) 3_565 . -202_455 N H15 C5 H33 81.3087(13) 3_565 . -202_455 N H15 C5 H36 105.5423(18) 3_565 . -201_565 N H15 C5 H37 117.7186(12) 3_565 . -201_565 N H12 C5 C14 93.3591(10) 2_665 . -203_555 N H12 C5 C15 135.0980(14) 2_665 . -203_555 N H12 C5 C16 152.1008(8) 2_665 . -202_455 N H12 C5 C18 165.5679(4) 2_665 . -201_565 N H12 C5 N4 98.8055(7) 2_665 . -201_565 N H12 C5 N4 87.0533(4) 2_665 . -202_455 N H12 C5 H28 8.96850(10) 2_665 . -203_555 N H12 C5 H29 101.5561(15) 2_665 . -203_555 N H12 C5 H32 92.3183(12) 2_665 . -202_455 N H12 C5 H33 78.9880(14) 2_665 . -202_455 N H12 C5 H36 104.8025(19) 2_665 . -201_565 N H12 C5 H37 151.23080(30) 2_665 . -201_565 N C14 C5 C15 117.91040(10) -203_555 . -203_555 N C14 C5 C16 114.53960(20) -203_555 . -202_455 N C14 C5 C18 86.7858(11) -203_555 . -201_565 N C14 C5 N4 8.81100(20) -203_555 . -201_565 N C14 C5 N4 27.2612 -203_555 . -202_455 N C14 C5 H28 100.1271(11) -203_555 . -203_555 N C14 C5 H29 75.07480(30) -203_555 . -203_555 N C14 C5 H32 101.2412(4) -203_555 . -202_455 N C14 C5 H33 152.79131(10) -203_555 . -202_455 N C14 C5 H36 143.97490(30) -203_555 . -201_565 N C14 C5 H37 96.6592(6) -203_555 . -201_565 N C15 C5 C16 30.2897(10) -203_555 . -202_455 N C15 C5 C18 36.1162(12) -203_555 . -201_565 N C15 C5 N4 109.50250(20) -203_555 . -201_565 N C15 C5 N4 105.9607 -203_555 . -202_455 N C15 C5 H28 126.1400(15) -203_555 . -203_555 N C15 C5 H29 116.49640(30) -203_555 . -203_555 N C15 C5 H32 110.3640(6) -203_555 . -202_455 N C15 C5 H33 58.25780(10) -203_555 . -202_455 N C15 C5 H36 32.0235(5) -203_555 . -201_565 N C15 C5 H37 60.8902(13) -203_555 . -201_565 N C16 C5 C18 31.1843(10) -202_455 . -201_565 N C16 C5 N4 108.90650(10) -202_455 . -201_565 N C16 C5 N4 117.69340(30) -202_455 . -202_455 N C16 C5 H28 144.8814(8) -202_455 . -203_555 N C16 C5 H29 86.3039(13) -202_455 . -203_555 N C16 C5 H32 82.4751(15) -202_455 . -202_455 N C16 C5 H33 76.0203(7) -202_455 . -202_455 N C16 C5 H36 52.3754(12) -202_455 . -201_565 N C16 C5 H37 31.31010(30) -202_455 . -201_565 N C18 C5 N4 79.7778(8) -201_565 . -201_565 N C18 C5 N4 86.5139(6) -201_565 . -202_455 N C18 C5 H28 158.6194(4) -201_565 . -203_555 N C18 C5 H29 92.4359(11) -201_565 . -203_555 N C18 C5 H32 101.8177(9) -201_565 . -202_455 N C18 C5 H33 94.3495(13) -201_565 . -202_455 N C18 C5 H36 68.0648(17) -201_565 . -201_565 N C18 C5 H37 42.5594(7) -201_565 . -201_565 N N4 C5 N4 22.7737 -201_565 . -202_455 N N4 C5 H28 104.7689(7) -201_565 . -203_555 N N4 C5 H29 80.87870(10) -201_565 . -203_555 N N4 C5 H32 107.76440(30) -201_565 . -202_455 N N4 C5 H33 147.12990(10) -201_565 . -202_455 N N4 C5 H36 135.2256(5) -201_565 . -201_565 N N4 C5 H37 94.83660(20) -201_565 . -201_565 N N4 C5 H28 90.5398(4) -202_455 . -203_555 N N4 C5 H29 102.32010(20) -202_455 . -203_555 N N4 C5 H32 128.0000(4) -202_455 . -202_455 N N4 C5 H33 125.5783 -202_455 . -202_455 N N4 C5 H36 121.70770(20) -202_455 . -201_565 N N4 C5 H37 113.3351 -202_455 . -201_565 N H28 C5 H29 108.8689(15) -203_555 . -203_555 N H28 C5 H32 96.6730(12) -203_555 . -202_455 N H28 C5 H33 70.3113(15) -203_555 . -202_455 N H28 C5 H36 95.9483(19) -203_555 . -201_565 N H28 C5 H37 153.1158(4) -203_555 . -201_565 N H29 C5 H32 27.35030(10) -203_555 . -202_455 N H29 C5 H33 131.90491(20) -203_555 . -202_455 N H29 C5 H36 129.03461(20) -203_555 . -201_565 N H29 C5 H37 55.7957(16) -203_555 . -201_565 N H32 C5 H33 105.09690(30) -202_455 . -202_455 N H32 C5 H36 108.6665(6) -202_455 . -201_565 N H32 C5 H37 59.3054(15) -202_455 . -201_565 N H33 C5 H36 26.2983(4) -202_455 . -201_565 N H33 C5 H37 102.5030(10) -202_455 . -201_565 N H36 C5 H37 82.2445(15) -201_565 . -201_565 N C3 C6 C5 28.9866(9) 1_555 . 3_565 N C3 C6 C7 45.17980(20) 1_555 . 2_665 N C3 C6 C8 171.89420(30) 1_555 . 3_565 N C3 C6 N3 112.05870(20) 1_555 . 1_555 N C3 C6 N3 108.73750(20) 1_555 . 2_665 N C3 C6 N3 120.92760(10) 1_555 . 3_565 N C3 C6 H11 46.86160(20) 1_555 . 3_565 N C3 C6 H14 63.32080(30) 1_555 . 2_665 N C3 C6 H15 96.4381(8) 1_555 . 2_665 N C3 C6 H12 108.1615(4) 1_555 . 1_555 N C3 C6 H13 108.3084(16) 1_555 . 1_555 N C3 C6 C13 136.69910(30) 1_555 . -201_565 N C3 C6 C13 138.2644(12) 1_555 . -203_555 N C3 C6 C14 21.4710(7) 1_555 . -202_455 N C3 C6 C16 20.5323(6) 1_555 . -201_565 N C3 C6 C18 11.8245(4) 1_555 . -203_555 N C3 C6 N4 73.6740(15) 1_555 . -201_565 N C3 C6 N4 79.4875(13) 1_555 . -202_455 N C3 C6 N4 66.9532(13) 1_555 . -203_555 N C3 C6 H26 147.2205(10) 1_555 . -203_555 N C3 C6 H27 102.4269(14) 1_555 . -203_555 N C3 C6 H28 90.41590(20) 1_555 . -202_455 N C3 C6 H29 48.23260(20) 1_555 . -202_455 N C3 C6 H32 51.63380(10) 1_555 . -201_565 N C5 C6 C7 51.2667(5) 3_565 . 2_665 N C5 C6 C8 143.0397(11) 3_565 . 3_565 N C5 C6 N3 121.0435(4) 3_565 . 1_555 N C5 C6 N3 130.8348(5) 3_565 . 2_665 N C5 C6 N3 117.71900(10) 3_565 . 3_565 N C5 C6 H11 54.4631(5) 3_565 . 3_565 N C5 C6 H14 77.69200(20) 3_565 . 2_665 N C5 C6 H15 76.2665(14) 3_565 . 2_665 N C5 C6 H12 79.4613(13) 3_565 . 1_555 N C5 C6 H13 121.3729(11) 3_565 . 1_555 N C5 C6 C13 122.8801(7) 3_565 . -201_565 N C5 C6 C13 165.11920(30) 3_565 . -203_555 N C5 C6 C14 15.3070(4) 3_565 . -202_455 N C5 C6 C16 8.89160(20) 3_565 . -201_565 N C5 C6 C18 25.6807(7) 3_565 . -203_555 N C5 C6 N4 78.0394(16) 3_565 . -201_565 N C5 C6 N4 91.0108(15) 3_565 . -202_455 N C5 C6 N4 84.2428(18) 3_565 . -203_555 N C5 C6 H26 123.6620(17) 3_565 . -203_555 N C5 C6 H27 121.7772(7) 3_565 . -203_555 N C5 C6 H28 61.5500(7) 3_565 . -202_455 N C5 C6 H29 65.7156(7) 3_565 . -202_455 N C5 C6 H32 55.84080(30) 3_565 . -201_565 N C7 C6 C8 132.46860(30) 2_665 . 3_565 N C7 C6 N3 150.38490(30) 2_665 . 1_555 N C7 C6 N3 129.22169(10) 2_665 . 2_665 N C7 C6 N3 166.0988(4) 2_665 . 3_565 N C7 C6 H11 3.4928 2_665 . 3_565 N C7 C6 H14 27.61950(30) 2_665 . 2_665 N C7 C6 H15 63.9319(8) 2_665 . 2_665 N C7 C6 H12 95.9636(4) 2_665 . 1_555 N C7 C6 H13 70.2409(16) 2_665 . 1_555 N C7 C6 C13 167.40160(10) 2_665 . -201_565 N C7 C6 C13 115.3510(8) 2_665 . -203_555 N C7 C6 C14 58.3700(7) 2_665 . -202_455 N C7 C6 C16 45.92920(30) 2_665 . -201_565 N C7 C6 C18 55.7927(6) 2_665 . -203_555 N C7 C6 N4 118.7823(18) 2_665 . -201_565 N C7 C6 N4 121.6961(14) 2_665 . -202_455 N C7 C6 N4 106.3413(14) 2_665 . -203_555 N C7 C6 H26 107.9330(11) 2_665 . -203_555 N C7 C6 H27 71.3798(12) 2_665 . -203_555 N C7 C6 H28 85.66810(10) 2_665 . -202_455 N C7 C6 H29 21.79780(10) 2_665 . -202_455 N C7 C6 H32 6.52440(10) 2_665 . -201_565 N C8 C6 N3 72.8654 3_565 . 1_555 N C8 C6 N3 78.6901(4) 3_565 . 2_665 N C8 C6 N3 61.3058 3_565 . 3_565 N C8 C6 H11 131.38580(30) 3_565 . 3_565 N C8 C6 H14 118.20960(30) 3_565 . 2_665 N C8 C6 H15 76.8909(6) 3_565 . 2_665 N C8 C6 H12 63.74590(20) 3_565 . 1_555 N C8 C6 H13 74.7149(16) 3_565 . 1_555 N C8 C6 C13 43.23170(30) 3_565 . -201_565 N C8 C6 C13 49.1763(14) 3_565 . -203_555 N C8 C6 C14 152.1150(9) 3_565 . -202_455 N C8 C6 C16 151.3835(9) 3_565 . -201_565 N C8 C6 C18 164.0132(5) 3_565 . -203_555 N C8 C6 N4 108.4433(14) 3_565 . -201_565 N C8 C6 N4 104.8902(11) 3_565 . -202_455 N C8 C6 N4 118.5842(12) 3_565 . -203_555 N C8 C6 H26 26.4817(8) 3_565 . -203_555 N C8 C6 H27 82.1892(15) 3_565 . -203_555 N C8 C6 H28 81.5317(4) 3_565 . -202_455 N C8 C6 H29 133.60910(10) 3_565 . -202_455 N C8 C6 H32 125.94720(20) 3_565 . -201_565 N N3 C6 N3 28.0042 1_555 . 2_665 N N3 C6 N3 21.9349 1_555 . 3_565 N N3 C6 H11 149.02530(20) 1_555 . 3_565 N N3 C6 H14 135.2739 1_555 . 2_665 N N3 C6 H15 145.6744(5) 1_555 . 2_665 N N3 C6 H12 111.26200(20) 1_555 . 1_555 N N3 C6 H13 111.2342(6) 1_555 . 1_555 N N3 C6 C13 41.15140(20) 1_555 . -201_565 N N3 C6 C13 66.44780(10) 1_555 . -203_555 N N3 C6 C14 107.83190(10) 1_555 . -202_455 N N3 C6 C16 121.3711(5) 1_555 . -201_565 N N3 C6 C18 104.4567 1_555 . -203_555 N N3 C6 N4 43.0341(12) 1_555 . -201_565 N N3 C6 N4 32.6862(11) 1_555 . -202_455 N N3 C6 N4 45.8162(11) 1_555 . -203_555 N N3 C6 H26 99.1247(8) 1_555 . -203_555 N N3 C6 H27 102.9835(4) 1_555 . -203_555 N N3 C6 H28 117.104 1_555 . -202_455 N N3 C6 H29 131.8184 1_555 . -202_455 N N3 C6 H32 155.18410(20) 1_555 . -201_565 N N3 C6 N3 48.47010(10) 2_665 . 3_565 N N3 C6 H11 126.52640(10) 2_665 . 3_565 N N3 C6 H14 107.93360(10) 2_665 . 2_665 N N3 C6 H15 152.8969(9) 2_665 . 2_665 N N3 C6 H12 134.3959(5) 2_665 . 1_555 N N3 C6 H13 87.2351(4) 2_665 . 1_555 N N3 C6 C13 63.37120(20) 2_665 . -201_565 N N3 C6 C13 49.2929(4) 2_665 . -203_555 N N3 C6 C14 115.52810(10) 2_665 . -202_455 N N3 C6 C16 126.2543(4) 2_665 . -201_565 N N3 C6 C18 106.56740(20) 2_665 . -203_555 N N3 C6 N4 60.0659(9) 2_665 . -201_565 N N3 C6 N4 43.3960(10) 2_665 . -202_455 N N3 C6 N4 46.7438(13) 2_665 . -203_555 N N3 C6 H26 103.5181(12) 2_665 . -203_555 N N3 C6 H27 76.73050(30) 2_665 . -203_555 N N3 C6 H28 144.32941(10) 2_665 . -202_455 N N3 C6 H29 107.71690(20) 2_665 . -202_455 N N3 C6 H32 131.38820(10) 2_665 . -201_565 N N3 C6 H11 167.18860(30) 3_565 . 3_565 N N3 C6 H14 156.3247 3_565 . 2_665 N N3 C6 H15 125.1464(5) 3_565 . 2_665 N N3 C6 H12 89.34870(30) 3_565 . 1_555 N N3 C6 H13 120.6754(11) 3_565 . 1_555 N N3 C6 C13 21.27090(20) 3_565 . -201_565 N N3 C6 C13 74.2572(4) 3_565 . -203_555 N N3 C6 C14 108.79520(30) 3_565 . -202_455 N N3 C6 C16 121.83130(10) 3_565 . -201_565 N N3 C6 C18 110.45650(20) 3_565 . -203_555 N N3 C6 N4 47.3208(14) 3_565 . -201_565 N N3 C6 N4 45.5473(10) 3_565 . -202_455 N N3 C6 N4 61.4954(10) 3_565 . -203_555 N N3 C6 H26 85.1595(7) 3_565 . -203_555 N N3 C6 H27 116.8867(8) 3_565 . -203_555 N N3 C6 H28 95.9188 3_565 . -202_455 N N3 C6 H29 153.3664 3_565 . -202_455 N N3 C6 H32 172.54201(20) 3_565 . -201_565 N H11 C6 H14 24.14160(30) 3_565 . 2_665 N H11 C6 H15 65.2420(8) 3_565 . 2_665 N H11 C6 H12 98.3371(4) 3_565 . 1_555 N H11 C6 H13 67.1824(16) 3_565 . 1_555 N H11 C6 C13 169.7216 3_565 . -201_565 N H11 C6 C13 111.9999(8) 3_565 . -203_555 N H11 C6 C14 61.0345(7) 3_565 . -202_455 N H11 C6 C16 48.86100(30) 3_565 . -201_565 N H11 C6 C18 57.7975(6) 3_565 . -203_555 N H11 C6 N4 120.1375(17) 3_565 . -201_565 N H11 C6 N4 121.8514(13) 3_565 . -202_455 N H11 C6 N4 106.1483(13) 3_565 . -203_555 N H11 C6 H26 107.6044(10) 3_565 . -203_555 N H11 C6 H27 67.9874(12) 3_565 . -203_555 N H11 C6 H28 88.62570(10) 3_565 . -202_455 N H11 C6 H29 18.84360(10) 3_565 . -202_455 N H11 C6 H32 6.35030(10) 3_565 . -201_565 N H14 C6 H15 74.17500(20) 2_665 . 2_665 N H14 C6 H12 112.07240(10) 2_665 . 1_555 N H14 C6 H13 45.6194(12) 2_665 . 1_555 N H14 C6 C13 158.9749(5) 2_665 . -201_565 N H14 C6 C13 88.2240(6) 2_665 . -203_555 N H14 C6 C14 81.64940(30) 2_665 . -202_455 N H14 C6 C16 71.0644 2_665 . -201_565 N H14 C6 C18 75.13520(10) 2_665 . -203_555 N H14 C6 N4 128.4486(10) 2_665 . -201_565 N H14 C6 N4 121.6414(6) 2_665 . -202_455 N H14 C6 N4 105.5062(6) 2_665 . -203_555 N H14 C6 H26 101.39580(20) 2_665 . -203_555 N H14 C6 H27 44.1724(9) 2_665 . -203_555 N H14 C6 H28 107.5421 2_665 . -202_455 N H14 C6 H29 15.4083(5) 2_665 . -202_455 N H14 C6 H32 25.68080(10) 2_665 . -201_565 N H15 C6 H12 38.33450(10) 2_665 . 1_555 N H15 C6 H13 75.1610(4) 2_665 . 1_555 N H15 C6 C13 104.6890(7) 2_665 . -201_565 N H15 C6 C13 104.7082(13) 2_665 . -203_555 N H15 C6 C14 91.5735(10) 2_665 . -202_455 N H15 C6 C16 80.4907(13) 2_665 . -201_565 N H15 C6 C18 100.1116(7) 2_665 . -203_555 N H15 C6 N4 140.2172 2_665 . -201_565 N H15 C6 N4 157.5547 2_665 . -202_455 N H15 C6 N4 160.1578(4) 2_665 . -203_555 N H15 C6 H26 50.78400(20) 2_665 . -203_555 N H15 C6 H27 88.4291(5) 2_665 . -203_555 N H15 C6 H28 41.17530(20) 2_665 . -202_455 N H15 C6 H29 81.4570(5) 2_665 . -202_455 N H15 C6 H32 58.9914(7) 2_665 . -201_565 N H12 C6 H13 105.5377(9) 1_555 . 1_555 N H12 C6 C13 71.48450(30) 1_555 . -201_565 N H12 C6 C13 110.7618(15) 1_555 . -203_555 N H12 C6 C14 91.4294(10) 1_555 . -202_455 N H12 C6 C16 87.6376(11) 1_555 . -201_565 N H12 C6 C18 104.0616(6) 1_555 . -203_555 N H12 C6 N4 107.1551(4) 1_555 . -201_565 N H12 C6 N4 121.80260(20) 1_555 . -202_455 N H12 C6 N4 134.31970(10) 1_555 . -203_555 N H12 C6 H26 48.11280(30) 1_555 . -203_555 N H12 C6 H27 119.6585(9) 1_555 . -203_555 N H12 C6 H28 18.0511(6) 1_555 . -202_455 N H12 C6 H29 116.69390(30) 1_555 . -202_455 N H12 C6 H32 92.8128(4) 1_555 . -201_565 N H13 C6 C13 113.4237(18) 1_555 . -201_565 N H13 C6 C13 46.5830(7) 1_555 . -203_555 N H13 C6 C14 127.2533(9) 1_555 . -202_455 N H13 C6 C16 115.9885(13) 1_555 . -201_565 N H13 C6 C18 120.0775(12) 1_555 . -203_555 N H13 C6 N4 144.6188(4) 1_555 . -201_565 N H13 C6 N4 127.1709(5) 1_555 . -202_455 N H13 C6 N4 119.3162(8) 1_555 . -203_555 N H13 C6 H26 67.1211(13) 1_555 . -203_555 N H13 C6 H27 14.1416 1_555 . -203_555 N H13 C6 H28 115.65520(20) 1_555 . -202_455 N H13 C6 H29 60.1892(17) 1_555 . -202_455 N H13 C6 H32 65.5406(14) 1_555 . -201_565 N C13 C6 C13 71.5911(11) -201_565 . -203_555 N C13 C6 C14 119.3223(8) -201_565 . -202_455 N C13 C6 C16 129.8644(5) -201_565 . -201_565 N C13 C6 C18 125.0423(6) -201_565 . -203_555 N C13 C6 N4 65.8401(17) -201_565 . -201_565 N C13 C6 N4 66.6078(13) -201_565 . -202_455 N C13 C6 N4 82.7083(13) -201_565 . -203_555 N C13 C6 H26 64.7570(10) -201_565 . -203_555 N C13 C6 H27 115.3193(15) -201_565 . -203_555 N C13 C6 H28 81.92550(20) -201_565 . -202_455 N C13 C6 H29 170.1468 -201_565 . -202_455 N C13 C6 H32 163.6582 -201_565 . -201_565 N C13 C6 C14 157.7495(5) -203_555 . -202_455 N C13 C6 C16 156.6375(6) -203_555 . -201_565 N C13 C6 C18 144.9752(9) -203_555 . -203_555 N C13 C6 N4 107.8489(13) -203_555 . -201_565 N C13 C6 N4 92.3487(13) -203_555 . -202_455 N C13 C6 N4 95.0812(17) -203_555 . -203_555 N C13 C6 H26 63.5018(18) -203_555 . -203_555 N C13 C6 H27 44.0664(4) -203_555 . -203_555 N C13 C6 H28 128.7488(9) -203_555 . -202_455 N C13 C6 H29 99.5682(11) -203_555 . -202_455 N C13 C6 H32 111.4978(6) -203_555 . -201_565 N C14 C6 C16 13.6447(4) -202_455 . -201_565 N C14 C6 C18 12.8114(4) -202_455 . -203_555 N C14 C6 N4 65.0323(12) -202_455 . -201_565 N C14 C6 N4 76.5248(12) -202_455 . -202_455 N C14 C6 N4 68.9702(14) -202_455 . -203_555 N C14 C6 H26 137.9195(14) -202_455 . -203_555 N C14 C6 H27 123.3243(7) -202_455 . -203_555 N C14 C6 H28 73.4002(4) -202_455 . -202_455 N C14 C6 H29 67.4913(8) -202_455 . -202_455 N C14 C6 H32 64.0373(5) -202_455 . -201_565 N C16 C6 C18 19.6869(6) -201_565 . -203_555 N C16 C6 N4 78.6680(16) -201_565 . -201_565 N C16 C6 N4 89.6410(16) -201_565 . -202_455 N C16 C6 N4 80.7308(18) -201_565 . -203_555 N C16 C6 H26 129.8794(16) -201_565 . -203_555 N C16 C6 H27 114.6423(9) -201_565 . -203_555 N C16 C6 H28 69.8926(4) -201_565 . -202_455 N C16 C6 H29 58.1743(5) -201_565 . -202_455 N C16 C6 H32 51.20710(10) -201_565 . -201_565 N C18 C6 N4 63.7451(12) -203_555 . -201_565 N C18 C6 N4 71.8659(10) -203_555 . -202_455 N C18 C6 N4 61.4559(12) -203_555 . -203_555 N C18 C6 H26 149.2816(10) -203_555 . -203_555 N C18 C6 H27 113.5918(10) -203_555 . -203_555 N C18 C6 H28 86.0115 -203_555 . -202_455 N C18 C6 H29 60.0544(6) -203_555 . -202_455 N C18 C6 H32 62.0911(4) -203_555 . -201_565 N N4 C6 N4 17.5816 -201_565 . -202_455 N N4 C6 N4 27.26530(30) -201_565 . -203_555 N N4 C6 H26 129.8448(7) -201_565 . -203_555 N N4 C6 H27 131.1275(5) -201_565 . -203_555 N N4 C6 H28 99.49780(20) -201_565 . -202_455 N N4 C6 H29 114.3650(15) -201_565 . -202_455 N N4 C6 H32 125.2767(16) -201_565 . -201_565 N N4 C6 N4 16.3835 -202_455 . -203_555 N N4 C6 H26 130.35750(30) -202_455 . -203_555 N N4 C6 H27 114.0157(5) -202_455 . -203_555 N N4 C6 H28 116.44600(30) -202_455 . -202_455 N N4 C6 H29 110.3907(10) -202_455 . -202_455 N N4 C6 H32 127.9875(13) -202_455 . -201_565 N N4 C6 H26 144.9398(4) -203_555 . -203_555 N N4 C6 H27 105.2437(8) -203_555 . -203_555 N N4 C6 H28 124.6140(6) -203_555 . -202_455 N N4 C6 H29 94.0097(10) -203_555 . -202_455 N N4 C6 H32 112.4133(13) -203_555 . -201_565 N H26 C6 H27 79.2046(13) -203_555 . -203_555 N H26 C6 H28 65.6269(9) -203_555 . -202_455 N H26 C6 H29 115.7898(7) -203_555 . -202_455 N H26 C6 H32 101.5850(9) -203_555 . -201_565 N H27 C6 H28 129.37469(30) -203_555 . -202_455 N H27 C6 H29 56.4991(15) -203_555 . -202_455 N H27 C6 H32 68.0156(10) -203_555 . -201_565 N H28 C6 H29 107.44680(20) -202_455 . -202_455 N H28 C6 H32 84.1435 -202_455 . -201_565 N H29 C6 H32 23.91560(10) -202_455 . -201_565 N C3 C7 C4 22.7364(8) 3_565 . 1_555 N C3 C7 C5 47.5354(11) 3_565 . 2_665 N C3 C7 C6 113.2500(10) 3_565 . 3_565 N C3 C7 N3 103.2814(9) 3_565 . 1_555 N C3 C7 N3 105.3339(8) 3_565 . 2_665 N C3 C7 H7 40.4934(10) 3_565 . 3_565 N C3 C7 H10 76.7240(8) 3_565 . 2_665 N C3 C7 H11 70.0850(9) 3_565 . 2_665 N C3 C7 H14 93.25870(10) 3_565 . 1_555 N C3 C7 H15 130.5700(8) 3_565 . 1_555 N C3 C7 H12 118.8262(7) 3_565 . 3_565 N C3 C7 H13 147.0186(10) 3_565 . 3_565 N C3 C7 C13 134.8472(12) 3_565 . -202_455 N C3 C7 C14 49.8454(9) 3_565 . -201_565 N C3 C7 C16 29.1594(9) 3_565 . -203_555 N C3 C7 C18 12.6904(4) 3_565 . -202_455 N C3 C7 N4 70.99900(30) 3_565 . -202_455 N C3 C7 N4 73.48700(30) 3_565 . -203_555 N C3 C7 H26 152.6452(8) 3_565 . -202_455 N C3 C7 H27 130.0190(12) 3_565 . -202_455 N C3 C7 H28 105.19370(30) 3_565 . -201_565 N C3 C7 H29 72.7724(5) 3_565 . -201_565 N C3 C7 H32 79.9242(6) 3_565 . -203_555 N C3 C7 H33 64.5271(11) 3_565 . -203_555 N C4 C7 C5 29.4490(5) 1_555 . 2_665 N C4 C7 C6 109.9710(11) 1_555 . 3_565 N C4 C7 N3 112.7170(5) 1_555 . 1_555 N C4 C7 N3 102.8457(9) 1_555 . 2_665 N C4 C7 H7 56.4540(16) 1_555 . 3_565 N C4 C7 H10 53.9877 1_555 . 2_665 N C4 C7 H11 75.5463(10) 1_555 . 2_665 N C4 C7 H14 107.3852(4) 1_555 . 1_555 N C4 C7 H15 108.4515(15) 1_555 . 1_555 N C4 C7 H12 97.9820(14) 1_555 . 3_565 N C4 C7 H13 169.64500(30) 1_555 . 3_565 N C4 C7 C13 144.0728(9) 1_555 . -202_455 N C4 C7 C14 41.9144(7) 1_555 . -201_565 N C4 C7 C16 8.12080(20) 1_555 . -203_555 N C4 C7 C18 18.3967(6) 1_555 . -202_455 N C4 C7 N4 79.6979(6) 1_555 . -202_455 N C4 C7 N4 74.31780(30) 1_555 . -203_555 N C4 C7 H26 134.6825(14) 1_555 . -202_455 N C4 C7 H27 152.4166(4) 1_555 . -202_455 N C4 C7 H28 84.0581(11) 1_555 . -201_565 N C4 C7 H29 91.5029(11) 1_555 . -201_565 N C4 C7 H32 81.3183(7) 1_555 . -203_555 N C4 C7 H33 41.80690(30) 1_555 . -203_555 N C5 C7 C6 84.0240(15) 2_665 . 3_565 N C5 C7 N3 97.5398(8) 2_665 . 1_555 N C5 C7 N3 78.0446(12) 2_665 . 2_665 N C5 C7 H7 85.6263(20) 2_665 . 3_565 N C5 C7 H10 38.85370(10) 2_665 . 2_665 N C5 C7 H11 102.3269(15) 2_665 . 2_665 N C5 C7 H14 136.6214(9) 2_665 . 1_555 N C5 C7 H15 92.3351(16) 2_665 . 1_555 N C5 C7 H12 71.3905(18) 2_665 . 3_565 N C5 C7 H13 157.90120(30) 2_665 . 3_565 N C5 C7 C13 122.0868(12) 2_665 . -202_455 N C5 C7 C14 22.61310(30) 2_665 . -201_565 N C5 C7 C16 21.36080(30) 2_665 . -203_555 N C5 C7 C18 36.3551(7) 2_665 . -202_455 N C5 C7 N4 69.99270(30) 2_665 . -202_455 N C5 C7 N4 56.3751 2_665 . -203_555 N C5 C7 H26 106.2923(19) 2_665 . -202_455 N C5 C7 H27 163.52161(30) 2_665 . -202_455 N C5 C7 H28 58.0458(14) 2_665 . -201_565 N C5 C7 H29 120.0262(16) 2_665 . -201_565 N C5 C7 H32 104.8817(10) 2_665 . -203_555 N C5 C7 H33 30.81110(30) 2_665 . -203_555 N C6 C7 N3 31.21470(10) 3_565 . 1_555 N C6 C7 N3 7.92190(20) 3_565 . 2_665 N C6 C7 H7 143.33611(20) 3_565 . 3_565 N C6 C7 H10 92.1054(6) 3_565 . 2_665 N C6 C7 H11 173.0195 3_565 . 2_665 N C6 C7 H14 135.9957(6) 3_565 . 1_555 N C6 C7 H15 83.2784(10) 3_565 . 1_555 N C6 C7 H12 54.4623(4) 3_565 . 3_565 N C6 C7 H13 74.2790(12) 3_565 . 3_565 N C6 C7 C13 38.44230(20) 3_565 . -202_455 N C6 C7 C14 68.1264(18) 3_565 . -201_565 N C6 C7 C16 103.1890(13) 3_565 . -203_555 N C6 C7 C18 102.3222(14) 3_565 . -202_455 N C6 C7 N4 47.8662(11) 3_565 . -202_455 N C6 C7 N4 39.8308(13) 3_565 . -203_555 N C6 C7 H26 46.5940(4) 3_565 . -202_455 N C6 C7 H27 83.4197(12) 3_565 . -202_455 N C6 C7 H28 60.63200(20) 3_565 . -201_565 N C6 C7 H29 132.41090(20) 3_565 . -201_565 N C6 C7 H32 166.67830(30) 3_565 . -203_555 N C6 C7 H33 98.3002(8) 3_565 . -203_555 N N3 C7 N3 30.00820(10) 1_555 . 2_665 N N3 C7 H7 116.8810(4) 1_555 . 3_565 N N3 C7 H10 119.62500(20) 1_555 . 2_665 N N3 C7 H11 143.21710(20) 1_555 . 2_665 N N3 C7 H14 111.23460(20) 1_555 . 1_555 N N3 C7 H15 110.6569(12) 1_555 . 1_555 N N3 C7 H12 85.5134(6) 1_555 . 3_565 N N3 C7 H13 65.7325(5) 1_555 . 3_565 N N3 C7 C13 32.28480(30) 1_555 . -202_455 N N3 C7 C14 75.7477(11) 1_555 . -201_565 N N3 C7 C16 109.4221(6) 1_555 . -203_555 N N3 C7 C18 97.2920(11) 1_555 . -202_455 N N3 C7 N4 33.2766(11) 1_555 . -202_455 N N3 C7 N4 41.2467(8) 1_555 . -203_555 N N3 C7 H26 68.3568(6) 1_555 . -202_455 N N3 C7 H27 66.3875(5) 1_555 . -202_455 N N3 C7 H28 91.58290(30) 1_555 . -201_565 N N3 C7 H29 101.57520(30) 1_555 . -201_565 N N3 C7 H32 151.26930(10) 1_555 . -203_555 N N3 C7 H33 122.09190(30) 1_555 . -203_555 N N3 C7 H7 136.5589 2_665 . 3_565 N N3 C7 H10 90.5368(4) 2_665 . 2_665 N N3 C7 H11 171.9749 2_665 . 2_665 N N3 C7 H14 139.4943(4) 2_665 . 1_555 N N3 C7 H15 88.7759(8) 2_665 . 1_555 N N3 C7 H12 57.74480(30) 2_665 . 3_565 N N3 C7 H13 80.7018(9) 2_665 . 3_565 N N3 C7 C13 44.0438 2_665 . -202_455 N N3 C7 C14 60.9315(15) 2_665 . -201_565 N N3 C7 C16 96.3801(10) 2_665 . -203_555 N N3 C7 C18 94.4961(12) 2_665 . -202_455 N N3 C7 N4 40.9790(9) 2_665 . -202_455 N N3 C7 N4 31.9114(11) 2_665 . -203_555 N N3 C7 H26 54.08090(20) 2_665 . -202_455 N N3 C7 H27 88.3991(9) 2_665 . -202_455 N N3 C7 H28 61.91390(20) 2_665 . -201_565 N N3 C7 H29 131.26559(20) 2_665 . -201_565 N N3 C7 H32 174.47220(10) 2_665 . -203_555 N N3 C7 H33 95.2738(6) 2_665 . -203_555 N H7 C7 H10 101.4443(13) 3_565 . 2_665 N H7 C7 H11 36.1764 3_565 . 2_665 N H7 C7 H14 52.8436(11) 3_565 . 1_555 N H7 C7 H15 132.2811(7) 3_565 . 1_555 N H7 C7 H12 150.2176 3_565 . 3_565 N H7 C7 H13 114.3595(18) 3_565 . 3_565 N H7 C7 C13 132.7838(11) 3_565 . -202_455 N H7 C7 C14 90.1843(20) 3_565 . -201_565 N H7 C7 C16 64.5530(18) 3_565 . -203_555 N H7 C7 C18 53.1822(15) 3_565 . -202_455 N H7 C7 N4 95.6123(9) 3_565 . -202_455 N H7 C7 N4 107.0518(11) 3_565 . -203_555 N H7 C7 H26 166.63980(20) 3_565 . -202_455 N H7 C7 H27 98.2061(19) 3_565 . -202_455 N H7 C7 H28 137.2372(4) 3_565 . -201_565 N H7 C7 H29 35.3488(4) 3_565 . -201_565 N H7 C7 H32 48.84360(10) 3_565 . -203_555 N H7 C7 H33 90.2733(16) 3_565 . -203_555 N H10 C7 H11 94.6757(5) 2_665 . 2_665 N H10 C7 H14 129.13139(10) 2_665 . 1_555 N H10 C7 H15 55.6144(15) 2_665 . 1_555 N H10 C7 H12 48.8329(13) 2_665 . 3_565 N H10 C7 H13 136.17780(20) 2_665 . 3_565 N H10 C7 C13 124.40110(20) 2_665 . -202_455 N H10 C7 C14 58.51420(30) 2_665 . -201_565 N H10 C7 C16 48.31650(10) 2_665 . -203_555 N H10 C7 C18 69.6834(5) 2_665 . -202_455 N H10 C7 N4 103.5206(4) 2_665 . -202_455 N H10 C7 N4 85.24650(20) 2_665 . -203_555 N H10 C7 H26 85.0067(13) 2_665 . -202_455 N H10 C7 H27 152.3573(4) 2_665 . -202_455 N H10 C7 H28 36.0914(9) 2_665 . -201_565 N H10 C7 H29 133.1713(8) 2_665 . -201_565 N H10 C7 H32 89.02730(30) 2_665 . -203_555 N H10 C7 H33 12.30140(30) 2_665 . -203_555 N H11 C7 H14 37.0538(6) 2_665 . 1_555 N H11 C7 H15 99.2027(8) 2_665 . 1_555 N H11 C7 H12 130.11520(30) 2_665 . 3_565 N H11 C7 H13 99.5664(11) 2_665 . 3_565 N H11 C7 C13 134.83099(20) 2_665 . -202_455 N H11 C7 C14 117.0632(17) 2_665 . -201_565 N H11 C7 C16 82.6365(12) 2_665 . -203_555 N H11 C7 C18 81.6454(13) 2_665 . -202_455 N H11 C7 N4 131.4306(9) 2_665 . -202_455 N H11 C7 N4 142.5207(11) 2_665 . -203_555 N H11 C7 H26 132.42490(20) 2_665 . -202_455 N H11 C7 H27 89.7943(11) 2_665 . -202_455 N H11 C7 H28 125.19890(10) 2_665 . -201_565 N H11 C7 H29 41.64300(10) 2_665 . -201_565 N H11 C7 H32 12.90980(20) 2_665 . -203_555 N H11 C7 H33 88.6708(8) 2_665 . -203_555 N H14 C7 H15 106.10950(30) 1_555 . 1_555 N H14 C7 H12 139.9896(6) 1_555 . 3_565 N H14 C7 H13 65.2913(5) 1_555 . 3_565 N H14 C7 C13 98.06570(30) 1_555 . -202_455 N H14 C7 C14 142.1580(8) 1_555 . -201_565 N H14 C7 C16 115.3655(6) 1_555 . -203_555 N H14 C7 C18 105.91200(30) 1_555 . -202_455 N H14 C7 N4 120.228 1_555 . -202_455 N H14 C7 N4 140.0081 1_555 . -203_555 N H14 C7 H26 114.0908(9) 1_555 . -202_455 N H14 C7 H27 53.1399(6) 1_555 . -202_455 N H14 C7 H28 146.63170(20) 1_555 . -201_565 N H14 C7 H29 24.9988(5) 1_555 . -201_565 N H14 C7 H32 40.22710(20) 1_555 . -203_555 N H14 C7 H33 125.22870(20) 1_555 . -203_555 N H15 C7 H12 35.02850(30) 1_555 . 3_565 N H15 C7 H13 81.1803(17) 1_555 . 3_565 N H15 C7 C13 87.6120(18) 1_555 . -202_455 N H15 C7 C14 105.4967(11) 1_555 . -201_565 N H15 C7 C16 103.7166(16) 1_555 . -203_555 N H15 C7 C18 125.2355(10) 1_555 . -202_455 N H15 C7 N4 128.28101(10) 1_555 . -202_455 N H15 C7 N4 111.10480(20) 1_555 . -203_555 N H15 C7 H26 43.2457(6) 1_555 . -202_455 N H15 C7 H27 96.7440(19) 1_555 . -202_455 N H15 C7 H28 41.18030(10) 1_555 . -201_565 N H15 C7 H29 130.49060(10) 1_555 . -201_565 N H15 C7 H32 86.4303(6) 1_555 . -203_555 N H15 C7 H33 67.1913(18) 1_555 . -203_555 N H12 C7 H13 92.1366(17) 3_565 . 3_565 N H12 C7 C13 76.6631(11) 3_565 . -202_455 N H12 C7 C14 75.9428(15) 3_565 . -201_565 N H12 C7 C16 90.3895(16) 3_565 . -203_555 N H12 C7 C18 107.6027(11) 3_565 . -202_455 N H12 C7 N4 94.0310(4) 3_565 . -202_455 N H12 C7 N4 76.1086(5) 3_565 . -203_555 N H12 C7 H26 37.1988 3_565 . -202_455 N H12 C7 H27 109.2286(18) 3_565 . -202_455 N H12 C7 H28 13.9452(4) 3_565 . -201_565 N H12 C7 H29 164.98590(20) 3_565 . -201_565 N H12 C7 H32 118.40870(20) 3_565 . -203_555 N H12 C7 H33 60.2994(16) 3_565 . -203_555 N H13 C7 C13 37.0879(9) 3_565 . -202_455 N H13 C7 C14 140.4899(6) 3_565 . -201_565 N H13 C7 C16 174.31250(20) 3_565 . -203_555 N H13 C7 C18 153.2543(8) 3_565 . -202_455 N H13 C7 N4 97.4730(6) 3_565 . -202_455 N H13 C7 N4 106.24170(30) 3_565 . -203_555 N H13 C7 H26 55.1705(17) 3_565 . -202_455 N H13 C7 H27 17.25000(20) 3_565 . -202_455 N H13 C7 H28 106.0797(13) 3_565 . -201_565 N H13 C7 H29 79.0522(13) 3_565 . -201_565 N H13 C7 H32 95.8270(7) 3_565 . -203_555 N H13 C7 H33 148.23740(10) 3_565 . -203_555 N C13 C7 C14 103.5226(16) -202_455 . -201_565 N C13 C7 C16 139.1932(10) -202_455 . -203_555 N C13 C7 C18 129.5730(14) -202_455 . -202_455 N C13 C7 N4 65.5243(14) -202_455 . -202_455 N C13 C7 N4 69.8963(12) -202_455 . -203_555 N C13 C7 H26 45.3041(12) -202_455 . -202_455 N C13 C7 H27 45.0449(9) -202_455 . -202_455 N C13 C7 H28 88.4407(7) -202_455 . -201_565 N C13 C7 H29 102.2286(6) -202_455 . -201_565 N C13 C7 H32 132.84010(20) -202_455 . -203_555 N C13 C7 H33 133.8207(5) -202_455 . -203_555 N C14 C7 C16 35.7552(5) -201_565 . -203_555 N C14 C7 C18 37.2150(5) -201_565 . -202_455 N C14 C7 N4 47.4312 -201_565 . -202_455 N C14 C7 N4 34.56880(30) -201_565 . -203_555 N C14 C7 H26 103.1386(18) -201_565 . -202_455 N C14 C7 H27 140.9236(6) -201_565 . -202_455 N C14 C7 H28 65.3478(10) -201_565 . -201_565 N C14 C7 H29 118.4825(13) -201_565 . -201_565 N C14 C7 H32 123.1294(14) -201_565 . -203_555 N C14 C7 H33 52.6566(6) -201_565 . -203_555 N C16 C7 C18 21.5689(7) -203_555 . -202_455 N C16 C7 N4 77.2584(5) -203_555 . -202_455 N C16 C7 N4 69.44950(20) -203_555 . -203_555 N C16 C7 H26 126.7728(17) -203_555 . -202_455 N C16 C7 H27 159.05490(20) -203_555 . -202_455 N C16 C7 H28 76.5241(13) -203_555 . -201_565 N C16 C7 H29 99.5170(13) -203_555 . -201_565 N C16 C7 H32 87.4389(8) -203_555 . -203_555 N C16 C7 H33 36.52530(20) -203_555 . -203_555 N C18 C7 N4 64.058 -202_455 . -202_455 N C18 C7 N4 63.14680(10) -202_455 . -203_555 N C18 C7 H26 139.9950(13) -202_455 . -202_455 N C18 C7 H27 137.9326(9) -202_455 . -202_455 N C18 C7 H28 94.3983(7) -202_455 . -201_565 N C18 C7 H29 84.8165(9) -202_455 . -201_565 N C18 C7 H32 90.5205(10) -202_455 . -203_555 N C18 C7 H33 58.0640(8) -202_455 . -203_555 N N4 C7 N4 19.8315 -202_455 . -203_555 N N4 C7 H26 94.1956(7) -202_455 . -202_455 N N4 C7 H27 93.6317(6) -202_455 . -202_455 N N4 C7 H28 92.31010(20) -202_455 . -201_565 N N4 C7 H29 99.11920(30) -202_455 . -201_565 N N4 C7 H32 144.3175(7) -202_455 . -203_555 N N4 C7 H33 99.7836(6) -202_455 . -203_555 N N4 C7 H26 84.9846(9) -203_555 . -202_455 N N4 C7 H27 107.34420(30) -203_555 . -202_455 N N4 C7 H28 72.87570(30) -203_555 . -201_565 N N4 C7 H29 117.8907(4) -203_555 . -201_565 N N4 C7 H32 153.4095(9) -203_555 . -203_555 N N4 C7 H33 83.5188(4) -203_555 . -203_555 N H26 C7 H27 72.0991(18) -202_455 . -202_455 N H26 C7 H28 51.1026(4) -202_455 . -201_565 N H26 C7 H29 133.62640(30) -202_455 . -201_565 N H26 C7 H32 120.3944 -202_455 . -203_555 N H26 C7 H33 96.9805(16) -202_455 . -203_555 N H27 C7 H28 123.1692(15) -202_455 . -201_565 N H27 C7 H29 62.9206(15) -202_455 . -201_565 N H27 C7 H32 89.4311(7) -202_455 . -203_555 N H27 C7 H33 163.3649 -202_455 . -203_555 N H28 C7 H29 166.8172 -201_565 . -201_565 N H28 C7 H32 115.42860(10) -201_565 . -203_555 N H28 C7 H33 46.9647(12) -201_565 . -203_555 N H29 C7 H32 51.48950(10) -201_565 . -203_555 N H29 C7 H33 123.7105(11) -201_565 . -203_555 N H32 C7 H33 85.4054(5) -203_555 . -203_555 N C6 C8 C8 97.76130(20) 2_665 . 2_665 N C6 C8 C8 78.0120(4) 2_665 . 3_565 N C6 C8 N3 30.2566(10) 2_665 . 1_555 N C6 C8 C9 145.9147(8) 2_665 . 1_555 N C6 C8 C9 132.5472(15) 2_665 . 3_565 N C6 C8 H16 100.81400(20) 2_665 . 1_555 N C6 C8 H17 83.1608(11) 2_665 . 1_555 N C6 C8 H17 116.47040(30) 2_665 . 2_665 N C6 C8 H18 115.2462(16) 2_665 . 3_565 N C6 C8 H19 116.8391(16) 2_665 . 2_665 N C6 C8 H19 164.5741(4) 2_665 . 3_565 N C6 C8 H12 37.9576(11) 2_665 . 2_665 N C6 C8 C11 169.90080(30) 2_665 . -202_455 N C6 C8 C12 93.1511(7) 2_665 . -201_565 N C6 C8 C12 114.8006(15) 2_665 . -202_455 N C6 C8 C12 112.08750(20) 2_665 . -203_555 N C6 C8 C13 32.0073(5) 2_665 . -201_565 N C6 C8 C13 61.2045(16) 2_665 . -202_455 N C6 C8 H24 88.6574(9) 2_665 . -202_455 N C6 C8 H24 156.8785(4) 2_665 . -203_555 N C6 C8 H25 84.4733(9) 2_665 . -202_455 N C6 C8 H26 34.0921(7) 2_665 . -201_565 N C8 C8 C8 60.0 2_665 . 3_565 N C8 C8 N3 70.2501(7) 2_665 . 1_555 N C8 C8 C9 49.2784(10) 2_665 . 1_555 N C8 C8 C9 83.02650(20) 2_665 . 3_565 N C8 C8 H16 129.2711 2_665 . 1_555 N C8 C8 H17 124.06410(10) 2_665 . 1_555 N C8 C8 H17 39.33220(10) 2_665 . 2_665 N C8 C8 H18 127.8559(7) 2_665 . 3_565 N C8 C8 H19 81.62470(10) 2_665 . 2_665 N C8 C8 H19 66.8352(7) 2_665 . 3_565 N C8 C8 H12 119.4676(8) 2_665 . 2_665 N C8 C8 C11 76.5075(5) 2_665 . -202_455 N C8 C8 C12 47.92580(10) 2_665 . -201_565 N C8 C8 C12 74.20780(20) 2_665 . -202_455 N C8 C8 C12 14.4848(5) 2_665 . -203_555 N C8 C8 C13 85.89640(10) 2_665 . -201_565 N C8 C8 C13 52.2839(8) 2_665 . -202_455 N C8 C8 H24 69.3161 2_665 . -202_455 N C8 C8 H24 63.1877(6) 2_665 . -203_555 N C8 C8 H25 152.31531(10) 2_665 . -202_455 N C8 C8 H26 131.7705(10) 2_665 . -201_565 N C8 C8 N3 75.3460(5) 3_565 . 1_555 N C8 C8 C9 77.05750(30) 3_565 . 1_555 N C8 C8 C9 61.3453(9) 3_565 . 3_565 N C8 C8 H16 170.5625 3_565 . 1_555 N C8 C8 H17 65.7521 3_565 . 1_555 N C8 C8 H17 98.3585 3_565 . 2_665 N C8 C8 H18 87.598 3_565 . 3_565 N C8 C8 H19 47.1318(9) 3_565 . 2_665 N C8 C8 H19 92.71080(10) 3_565 . 3_565 N C8 C8 H12 115.7440(7) 3_565 . 2_665 N C8 C8 C11 91.89660(10) 3_565 . -202_455 N C8 C8 C12 17.60550(30) 3_565 . -201_565 N C8 C8 C12 41.2609(10) 3_565 . -202_455 N C8 C8 C12 63.59120(10) 3_565 . -203_555 N C8 C8 C13 46.9392(8) 3_565 . -201_565 N C8 C8 C13 89.213 3_565 . -202_455 N C8 C8 H24 15.9125(4) 3_565 . -202_455 N C8 C8 H24 100.94880(20) 3_565 . -203_555 N C8 C8 H25 93.9376 3_565 . -202_455 N C8 C8 H26 98.90280(20) 3_565 . -201_565 N N3 C8 C9 119.4623(17) 1_555 . 1_555 N N3 C8 C9 136.3471(13) 1_555 . 3_565 N N3 C8 H16 108.4291(5) 1_555 . 1_555 N N3 C8 H17 108.74830(30) 1_555 . 1_555 N N3 C8 H17 86.7834(7) 1_555 . 2_665 N N3 C8 H18 143.5221(7) 1_555 . 3_565 N N3 C8 H19 122.4014(14) 1_555 . 2_665 N N3 C8 H19 135.5356(14) 1_555 . 3_565 N N3 C8 H12 52.9962(16) 1_555 . 2_665 N N3 C8 C11 146.4860(11) 1_555 . -202_455 N N3 C8 C12 83.9815(10) 1_555 . -201_565 N N3 C8 C12 116.4995(15) 1_555 . -202_455 N N3 C8 C12 84.6923(11) 1_555 . -203_555 N N3 C8 C13 44.3286(9) 1_555 . -201_565 N N3 C8 C13 32.4529(6) 1_555 . -202_455 N N3 C8 H24 90.5228(9) 1_555 . -202_455 N N3 C8 H24 126.7744(14) 1_555 . -203_555 N N3 C8 H25 114.67550(10) 1_555 . -202_455 N N3 C8 H26 62.2285(16) 1_555 . -201_565 N C9 C8 C9 47.8512(12) 1_555 . 3_565 N C9 C8 H16 107.4521(5) 1_555 . 1_555 N C9 C8 H17 106.9780(11) 1_555 . 1_555 N C9 C8 H17 46.0839(5) 1_555 . 2_665 N C9 C8 H18 86.5288(20) 1_555 . 3_565 N C9 C8 H19 57.6882(12) 1_555 . 2_665 N C9 C8 H19 19.0810(4) 1_555 . 3_565 N C9 C8 H12 157.8763(5) 1_555 . 2_665 N C9 C8 C11 27.2523(5) 1_555 . -202_455 N C9 C8 C12 59.634 1_555 . -201_565 N C9 C8 C12 54.6092(10) 1_555 . -202_455 N C9 C8 C12 34.8001(5) 1_555 . -203_555 N C9 C8 C13 122.4285(11) 1_555 . -201_565 N C9 C8 C13 95.5523(20) 1_555 . -202_455 N C9 C8 H24 72.7519(4) 1_555 . -202_455 N C9 C8 H24 23.8917(5) 1_555 . -203_555 N C9 C8 H25 120.0401(13) 1_555 . -202_455 N C9 C8 H26 174.58600(10) 1_555 . -201_565 N C9 C8 H16 115.2027(8) 3_565 . 1_555 N C9 C8 H17 59.22060(10) 3_565 . 1_555 N C9 C8 H17 93.9208(7) 3_565 . 2_665 N C9 C8 H18 44.8514(9) 3_565 . 3_565 N C9 C8 H19 15.91480(10) 3_565 . 2_665 N C9 C8 H19 47.9248(14) 3_565 . 3_565 N C9 C8 H12 153.5949(7) 3_565 . 2_665 N C9 C8 C11 39.2712(12) 3_565 . -202_455 N C9 C8 C12 52.89840(30) 3_565 . -201_565 N C9 C8 C12 20.11760(10) 3_565 . -202_455 N C9 C8 C12 72.0136(4) 3_565 . -203_555 N C9 C8 C13 101.7043(19) 3_565 . -201_565 N C9 C8 C13 135.1612(10) 3_565 . -202_455 N C9 C8 H24 47.0236(4) 3_565 . -202_455 N C9 C8 H24 61.6334(16) 3_565 . -203_555 N C9 C8 H25 75.54090(20) 3_565 . -202_455 N C9 C8 H26 127.0609(12) 3_565 . -201_565 N H16 C8 H17 104.83230(10) 1_555 . 1_555 N H16 C8 H17 90.5594 1_555 . 2_665 N H16 C8 H18 84.4548 1_555 . 3_565 N H16 C8 H19 127.9236(9) 1_555 . 2_665 N H16 C8 H19 90.32380(10) 1_555 . 3_565 N H16 C8 H12 62.9222(9) 1_555 . 2_665 N H16 C8 C11 89.20550(10) 1_555 . -202_455 N H16 C8 C12 166.0256(5) 1_555 . -201_565 N H16 C8 C12 134.6995(10) 1_555 . -202_455 N H16 C8 C12 124.79160(10) 1_555 . -203_555 N H16 C8 C13 129.9738(7) 1_555 . -201_565 N H16 C8 C13 98.45520(10) 1_555 . -202_455 N H16 C8 H24 156.66020(30) 1_555 . -202_455 N H16 C8 H24 83.8312 1_555 . -203_555 N H16 C8 H25 76.6252 1_555 . -202_455 N H16 C8 H26 76.0208(4) 1_555 . -201_565 N H17 C8 H17 152.6844(6) 1_555 . 2_665 N H17 C8 H18 35.2215(4) 1_555 . 3_565 N H17 C8 H19 50.65040(10) 1_555 . 2_665 N H17 C8 H19 104.4289(13) 1_555 . 3_565 N H17 C8 H12 94.9702(6) 1_555 . 2_665 N H17 C8 C11 93.1210(10) 1_555 . -202_455 N H17 C8 C12 76.13870(10) 1_555 . -201_565 N H17 C8 C12 55.96410(10) 1_555 . -202_455 N H17 C8 C12 121.5669(4) 1_555 . -203_555 N H17 C8 C13 65.9279(11) 1_555 . -201_565 N H17 C8 C13 140.5207(4) 1_555 . -202_455 N H17 C8 H24 54.76350(10) 1_555 . -202_455 N H17 C8 H24 117.8305(15) 1_555 . -203_555 N H17 C8 H25 28.4996 1_555 . -202_455 N H17 C8 H26 67.8571(12) 1_555 . -201_565 N H17 C8 H18 128.0565(13) 2_665 . 3_565 N H17 C8 H19 102.1102(7) 2_665 . 2_665 N H17 C8 H19 52.1551(6) 2_665 . 3_565 N H17 C8 H12 112.21 2_665 . 2_665 N H17 C8 C11 64.17720(30) 2_665 . -202_455 N H17 C8 C12 83.59930(10) 2_665 . -201_565 N H17 C8 C12 97.2029(5) 2_665 . -202_455 N H17 C8 C12 35.4056 2_665 . -203_555 N H17 C8 C13 120.43060(10) 2_665 . -201_565 N H17 C8 C13 55.3108(13) 2_665 . -202_455 N H17 C8 H24 104.34860(20) 2_665 . -202_455 N H17 C8 H24 40.4700(7) 2_665 . -203_555 N H17 C8 H25 157.4767(6) 2_665 . -202_455 N H17 C8 H26 138.8763(6) 2_665 . -201_565 N H18 C8 H19 48.1714(9) 3_565 . 2_665 N H18 C8 H19 76.1435(19) 3_565 . 3_565 N H18 C8 H12 110.9923(16) 3_565 . 2_665 N H18 C8 C11 64.0840(16) 3_565 . -202_455 N H18 C8 C12 89.1610(6) 3_565 . -201_565 N H18 C8 C12 55.9649(10) 3_565 . -202_455 N H18 C8 C12 116.4500(13) 3_565 . -203_555 N H18 C8 C13 101.0628(15) 3_565 . -201_565 N H18 C8 C13 175.7114 3_565 . -202_455 N H18 C8 H24 72.22300(30) 3_565 . -202_455 N H18 C8 H24 87.6438(20) 3_565 . -203_555 N H18 C8 H25 33.5338(7) 3_565 . -202_455 N H18 C8 H26 89.7200(20) 3_565 . -201_565 N H19 C8 H19 61.9505(15) 2_665 . 3_565 N H19 C8 H12 144.3297(7) 2_665 . 2_665 N H19 C8 C11 54.5298(13) 2_665 . -202_455 N H19 C8 C12 42.22760(30) 2_665 . -201_565 N H19 C8 C12 7.79990(10) 2_665 . -202_455 N H19 C8 C12 73.6940(4) 2_665 . -203_555 N H19 C8 C13 85.7899(21) 2_665 . -201_565 N H19 C8 C13 130.2943(10) 2_665 . -202_455 N H19 C8 H24 31.9362(5) 2_665 . -202_455 N H19 C8 H24 75.2719(17) 2_665 . -203_555 N H19 C8 H25 72.93960(20) 2_665 . -202_455 N H19 C8 H26 116.9173(13) 2_665 . -201_565 N H19 C8 H12 150.4585(8) 3_565 . 2_665 N H19 C8 C11 12.06000(30) 3_565 . -202_455 N H19 C8 C12 76.05940(30) 3_565 . -201_565 N H19 C8 C12 61.6837(13) 3_565 . -202_455 N H19 C8 C12 52.48820(20) 3_565 . -203_555 N H19 C8 C13 139.5241(8) 3_565 . -201_565 N H19 C8 C13 106.8879(19) 3_565 . -202_455 N H19 C8 H24 85.0734(7) 3_565 . -202_455 N H19 C8 H24 13.77910(20) 3_565 . -203_555 N H19 C8 H25 108.6821(12) 3_565 . -202_455 N H19 C8 H26 161.33231(30) 3_565 . -201_565 N H12 C8 C11 152.1102(8) 2_665 . -202_455 N H12 C8 C12 131.0522(4) 2_665 . -201_565 N H12 C8 C12 146.6404(6) 2_665 . -202_455 N H12 C8 C12 132.35860(30) 2_665 . -203_555 N H12 C8 C13 68.9361(16) 2_665 . -201_565 N H12 C8 C13 67.9362(17) 2_665 . -202_455 N H12 C8 H24 124.46140(10) 2_665 . -202_455 N H12 C8 H24 138.7626(10) 2_665 . -203_555 N H12 C8 H25 78.6135(9) 2_665 . -202_455 N H12 C8 H26 27.4746(5) 2_665 . -201_565 N C11 C8 C12 76.8216(4) -202_455 . -201_565 N C11 C8 C12 55.8650(12) -202_455 . -202_455 N C11 C8 C12 62.0229 -202_455 . -203_555 N C11 C8 C13 138.1484(8) -202_455 . -201_565 N C11 C8 C13 118.9219(16) -202_455 . -202_455 N C11 C8 H24 81.5539(6) -202_455 . -202_455 N C11 C8 H24 24.7214(5) -202_455 . -203_555 N C11 C8 H25 96.7533(9) -202_455 . -202_455 N C11 C8 H26 151.2787(5) -202_455 . -201_565 N C12 C8 C12 34.7198(4) -201_565 . -202_455 N C12 C8 C12 48.20140(10) -201_565 . -203_555 N C12 C8 C13 63.4833(11) -201_565 . -201_565 N C12 C8 C13 88.6647(6) -201_565 . -202_455 N C12 C8 H24 21.4345 -201_565 . -202_455 N C12 C8 H24 83.4966(5) -201_565 . -203_555 N C12 C8 H25 104.48920(20) -201_565 . -202_455 N C12 C8 H26 116.45830(10) -201_565 . -201_565 N C12 C8 C12 67.00040(30) -202_455 . -203_555 N C12 C8 C13 82.9939(20) -202_455 . -201_565 N C12 C8 C13 122.5034(10) -202_455 . -202_455 N C12 C8 H24 27.0649(6) -202_455 . -202_455 N C12 C8 H24 74.3481(15) -202_455 . -203_555 N C12 C8 H25 79.80320(30) -202_455 . -202_455 N C12 C8 H26 119.9871(11) -202_455 . -201_565 N C12 C8 C13 97.3076(5) -203_555 . -201_565 N C12 C8 C13 64.4287(14) -203_555 . -202_455 N C12 C8 H24 69.04250(20) -203_555 . -202_455 N C12 C8 H24 49.93700(10) -203_555 . -203_555 N C12 C8 H25 146.6065(6) -203_555 . -202_455 N C12 C8 H26 146.1648(5) -203_555 . -201_565 N C13 C8 C13 74.6555(15) -201_565 . -202_455 N C13 C8 H24 56.6507(14) -201_565 . -202_455 N C13 C8 H24 145.4353(6) -201_565 . -203_555 N C13 C8 H25 81.5885(6) -201_565 . -202_455 N C13 C8 H26 54.5575(10) -201_565 . -201_565 N C13 C8 H24 104.7824(4) -202_455 . -202_455 N C13 C8 H24 95.7805(20) -202_455 . -203_555 N C13 C8 H25 144.0804(7) -202_455 . -202_455 N C13 C8 H26 87.9407(21) -202_455 . -201_565 N H24 C8 H24 95.8303(9) -202_455 . -203_555 N H24 C8 H25 83.20250(10) -202_455 . -202_455 N H24 C8 H26 102.3781(4) -202_455 . -201_565 N H24 C8 H25 118.5486(13) -203_555 . -202_455 N H24 C8 H26 159.8406(4) -203_555 . -201_565 N H25 C8 H26 56.2071(14) -202_455 . -201_565 N C1 N1 C1 111.2663(5) 1_555 . 2_445 N C1 N1 C1 111.9162(5) 1_555 . 3_545 N C1 N1 N1 63.64920(10) 1_555 . 2_445 N C1 N1 N1 120.68240(10) 1_555 . 3_545 N C1 N1 C20 34.5402(12) 1_555 . 1_555 N C1 N1 C20 122.56440(20) 1_555 . 2_445 N C1 N1 C20 123.37740(20) 1_555 . 3_545 N C1 N1 C1 111.5648(5) 2_445 . 3_545 N C1 N1 N1 58.92080(10) 2_445 . 2_445 N C1 N1 N1 17.4078(6) 2_445 . 3_545 N C1 N1 C20 122.56440(20) 2_445 . 1_555 N C1 N1 C20 34.3931(12) 2_445 . 2_445 N C1 N1 C20 122.93750(20) 2_445 . 3_545 N C1 N1 N1 162.4572(6) 3_545 . 2_445 N C1 N1 N1 115.93200(10) 3_545 . 3_545 N C1 N1 C20 123.37740(20) 3_545 . 1_555 N C1 N1 C20 122.93750(20) 3_545 . 2_445 N C1 N1 C20 34.6675(12) 3_545 . 3_545 N N1 N1 N1 60.0 2_445 . 3_545 N N1 N1 C20 63.64960(10) 2_445 . 1_555 N N1 N1 C20 58.92120(10) 2_445 . 2_445 N N1 N1 C20 162.4587(6) 2_445 . 3_545 N N1 N1 C20 120.68280(10) 3_545 . 1_555 N N1 N1 C20 17.4087(6) 3_545 . 2_445 N N1 N1 C20 115.93250(10) 3_545 . 3_545 N C20 N1 C20 111.2664(5) 1_555 . 2_445 N C20 N1 C20 111.9162(5) 1_555 . 3_545 N C20 N1 C20 111.5648(5) 2_445 . 3_545 N C2 N2 C2 88.2665 1_555 . 2_665 N C2 N2 C2 84.6475 1_555 . 3_565 N C2 N2 C3 107.1802(4) 1_555 . 1_555 N C2 N2 C3 84.11780(10) 1_555 . 3_565 N C2 N2 C4 107.47450(20) 1_555 . 1_555 N C2 N2 C4 92.37880(10) 1_555 . 2_665 N C2 N2 N2 33.8941 1_555 . 2_665 N C2 N2 N2 26.5051 1_555 . 3_565 N C2 N2 H4 136.11690(20) 1_555 . 2_665 N C2 N2 H5 138.87450(10) 1_555 . 3_565 N C2 N2 C15 121.00650(10) 1_555 . -201_565 N C2 N2 C15 85.9857 1_555 . -202_455 N C2 N2 C17 121.8127 1_555 . -201_565 N C2 N2 C17 85.2483 1_555 . -203_555 N C2 N2 C18 88.72540(10) 1_555 . -202_455 N C2 N2 C18 95.89070(20) 1_555 . -203_555 N C2 N2 C19 36.3683(11) 1_555 . -201_565 N C2 N2 C19 88.37870(30) 1_555 . -202_455 N C2 N2 C19 75.8008(5) 1_555 . -203_555 N C2 N2 N5 114.5893(5) 1_555 . -201_565 N C2 N2 N5 56.2885(6) 1_555 . -202_455 N C2 N2 N5 45.3780(8) 1_555 . -203_555 N C2 N2 H38 130.8869(8) 1_555 . -202_455 N C2 N2 C2 165.6356(4) 2_665 . 3_565 N C2 N2 C3 131.6773(11) 2_665 . 1_555 N C2 N2 C3 25.9003(7) 2_665 . 3_565 N C2 N2 C4 26.90730(30) 2_665 . 1_555 N C2 N2 C4 152.3813(9) 2_665 . 2_665 N C2 N2 N2 122.1498 2_665 . 2_665 N C2 N2 N2 62.6239 2_665 . 3_565 N C2 N2 H4 58.4599(5) 2_665 . 2_665 N C2 N2 H5 131.9863 2_665 . 3_565 N C2 N2 C15 33.1273 2_665 . -201_565 N C2 N2 C15 165.5264(5) 2_665 . -202_455 N C2 N2 C17 149.92 2_665 . -201_565 N C2 N2 C17 13.7873(5) 2_665 . -203_555 N C2 N2 C18 27.3267(7) 2_665 . -202_455 N C2 N2 C18 138.0027(12) 2_665 . -203_555 N C2 N2 C19 88.46720(30) 2_665 . -201_565 N C2 N2 C19 64.8713(12) 2_665 . -202_455 N C2 N2 C19 135.3457(6) 2_665 . -203_555 N C2 N2 N5 89.4191(5) 2_665 . -201_565 N C2 N2 N5 129.69290(20) 2_665 . -202_455 N C2 N2 N5 68.1220(5) 2_665 . -203_555 N C2 N2 H38 82.8421(5) 2_665 . -202_455 N C2 N2 C3 40.5274(5) 3_565 . 1_555 N C2 N2 C3 140.3009(11) 3_565 . 3_565 N C2 N2 C4 146.7873(8) 3_565 . 1_555 N C2 N2 C4 16.9673(4) 3_565 . 2_665 N C2 N2 N2 51.5219 3_565 . 2_665 N C2 N2 N2 111.1429 3_565 . 3_565 N C2 N2 H4 133.58701(10) 3_565 . 2_665 N C2 N2 H5 57.86110(20) 3_565 . 3_565 N C2 N2 C15 149.37170(20) 3_565 . -201_565 N C2 N2 C15 1.5488 3_565 . -202_455 N C2 N2 C17 38.96420(20) 3_565 . -201_565 N C2 N2 C17 169.8498 3_565 . -203_555 N C2 N2 C18 139.6590(12) 3_565 . -202_455 N C2 N2 C18 31.4209(6) 3_565 . -203_555 N C2 N2 C19 93.15780(20) 3_565 . -201_565 N C2 N2 C19 127.2070(7) 3_565 . -202_455 N C2 N2 C19 54.4333(12) 3_565 . -203_555 N C2 N2 N5 104.88920(10) 3_565 . -201_565 N C2 N2 N5 54.6334(8) 3_565 . -202_455 N C2 N2 N5 114.1823 3_565 . -203_555 N C2 N2 H38 111.19340(10) 3_565 . -202_455 N C3 N2 C3 108.6726(18) 1_555 . 3_565 N C3 N2 C4 106.6114(13) 1_555 . 1_555 N C3 N2 C4 23.80670(10) 1_555 . 2_665 N C3 N2 N2 82.52940(10) 1_555 . 2_665 N C3 N2 N2 128.5807(6) 1_555 . 3_565 N C3 N2 H4 116.2412(6) 1_555 . 2_665 N C3 N2 H5 55.7589(13) 1_555 . 3_565 N C3 N2 C15 110.6641(7) 1_555 . -201_565 N C3 N2 C15 39.1313(5) 1_555 . -202_455 N C3 N2 C17 44.2935(12) 1_555 . -201_565 N C3 N2 C17 145.2597(6) 1_555 . -203_555 N C3 N2 C18 105.7091(18) 1_555 . -202_455 N C3 N2 C18 12.19430(10) 1_555 . -203_555 N C3 N2 C19 130.6246(6) 1_555 . -201_565 N C3 N2 C19 156.21989(10) 1_555 . -202_455 N C3 N2 C19 92.9748(17) 1_555 . -203_555 N C3 N2 N5 121.5425(11) 1_555 . -201_565 N C3 N2 N5 95.0999(12) 1_555 . -202_455 N C3 N2 N5 150.21271(30) 1_555 . -203_555 N C3 N2 H38 114.6249(12) 1_555 . -202_455 N C3 N2 C4 24.22560(10) 3_565 . 1_555 N C3 N2 C4 126.7838(16) 3_565 . 2_665 N C3 N2 N2 114.15220(30) 3_565 . 2_665 N C3 N2 N2 64.31320(30) 3_565 . 3_565 N C3 N2 H4 76.6538(12) 3_565 . 2_665 N C3 N2 H5 135.162 3_565 . 3_565 N C3 N2 C15 41.69100(20) 3_565 . -201_565 N C3 N2 C15 139.8934(12) 3_565 . -202_455 N C3 N2 C17 144.5566(4) 3_565 . -201_565 N C3 N2 C17 38.9459(12) 3_565 . -203_555 N C3 N2 C18 4.911 3_565 . -202_455 N C3 N2 C18 112.8769(19) 3_565 . -203_555 N C3 N2 C19 99.8151(10) 3_565 . -201_565 N C3 N2 C19 90.3624(19) 3_565 . -202_455 N C3 N2 C19 154.09891(20) 3_565 . -203_555 N C3 N2 N5 114.4172(12) 3_565 . -201_565 N C3 N2 N5 138.7171(5) 3_565 . -202_455 N C3 N2 N5 83.0507(13) 3_565 . -203_555 N C3 N2 H38 104.8802(13) 3_565 . -202_455 N C4 N2 C4 129.8331(12) 1_555 . 2_665 N C4 N2 N2 138.3744(4) 1_555 . 2_665 N C4 N2 N2 84.9707 1_555 . 3_565 N C4 N2 H4 54.9725(13) 1_555 . 2_665 N C4 N2 H5 113.22010(20) 1_555 . 3_565 N C4 N2 C15 18.44910(30) 1_555 . -201_565 N C4 N2 C15 145.5189(9) 1_555 . -202_455 N C4 N2 C17 127.3361 1_555 . -201_565 N C4 N2 C17 39.1060(7) 1_555 . -203_555 N C4 N2 C18 20.421 1_555 . -202_455 N C4 N2 C18 115.4000(15) 1_555 . -203_555 N C4 N2 C19 115.1438(5) 1_555 . -201_565 N C4 N2 C19 84.7897(16) 1_555 . -202_455 N C4 N2 C19 157.64841(30) 1_555 . -203_555 N C4 N2 N5 97.9643(12) 1_555 . -201_565 N C4 N2 N5 156.57069(10) 1_555 . -202_455 N C4 N2 N5 95.0170(8) 1_555 . -203_555 N C4 N2 H38 84.5532(14) 1_555 . -202_455 N C4 N2 N2 62.27270(10) 2_665 . 2_665 N C4 N2 N2 118.06950(10) 2_665 . 3_565 N C4 N2 H4 130.62019(30) 2_665 . 2_665 N C4 N2 H5 56.8119(7) 2_665 . 3_565 N C4 N2 C15 134.2134(6) 2_665 . -201_565 N C4 N2 C15 15.6904(4) 2_665 . -202_455 N C4 N2 C17 39.1339(7) 2_665 . -201_565 N C4 N2 C17 165.6774(5) 2_665 . -203_555 N C4 N2 C18 125.0582(16) 2_665 . -202_455 N C4 N2 C18 14.65550(30) 2_665 . -203_555 N C4 N2 C19 108.0768(5) 2_665 . -201_565 N C4 N2 C19 142.74310(20) 2_665 . -202_455 N C4 N2 C19 71.0270(16) 2_665 . -203_555 N C4 N2 N5 115.0908(5) 2_665 . -201_565 N C4 N2 N5 71.3187(11) 2_665 . -202_455 N C4 N2 N5 128.83659(30) 2_665 . -203_555 N C4 N2 H38 116.3950(5) 2_665 . -202_455 N N2 N2 N2 60.0 2_665 . 3_565 N N2 N2 H4 155.2225(7) 2_665 . 2_665 N N2 N2 H5 105.4556 2_665 . 3_565 N N2 N2 C15 154.46500(10) 2_665 . -201_565 N N2 N2 C15 52.9565 2_665 . -202_455 N N2 N2 C17 87.924 2_665 . -201_565 N N2 N2 C17 118.336 2_665 . -203_555 N N2 N2 C18 118.06760(30) 2_665 . -202_455 N N2 N2 C18 70.33620(20) 2_665 . -203_555 N N2 N2 C19 48.7687(5) 2_665 . -201_565 N N2 N2 C19 103.00500(30) 2_665 . -202_455 N N2 N2 C19 53.4310(8) 2_665 . -203_555 N N2 N2 N5 111.7325(7) 2_665 . -201_565 N N2 N2 N5 34.9735(9) 2_665 . -202_455 N N2 N2 N5 67.74230(20) 2_665 . -203_555 N N2 N2 H38 129.3337(10) 2_665 . -202_455 N N2 N2 H4 111.26230(10) 3_565 . 2_665 N N2 N2 H5 160.19960(30) 3_565 . 3_565 N N2 N2 C15 95.7436 3_565 . -201_565 N N2 N2 C15 112.4884 3_565 . -202_455 N N2 N2 C17 147.14211(10) 3_565 . -201_565 N N2 N2 C17 58.7447 3_565 . -203_555 N N2 N2 C18 69.22170(20) 3_565 . -202_455 N N2 N2 C18 118.9664(4) 3_565 . -203_555 N N2 N2 C19 38.2056(8) 3_565 . -201_565 N N2 N2 C19 72.1303(5) 3_565 . -202_455 N N2 N2 C19 91.2301 3_565 . -203_555 N N2 N2 N5 105.3168(5) 3_565 . -201_565 N N2 N2 N5 74.44590(20) 3_565 . -202_455 N N2 N2 N5 32.0293(9) 3_565 . -203_555 N N2 N2 H38 116.2898(6) 3_565 . -202_455 N H4 N2 H5 75.97360(30) 2_665 . 3_565 N H4 N2 C15 36.6230(9) 2_665 . -201_565 N H4 N2 C15 132.67950(10) 2_665 . -202_455 N H4 N2 C17 94.86250(30) 2_665 . -201_565 N H4 N2 C17 55.3858 2_665 . -203_555 N H4 N2 C18 74.2412(13) 2_665 . -202_455 N H4 N2 C18 127.8851(4) 2_665 . -203_555 N H4 N2 C19 108.9762(13) 2_665 . -201_565 N H4 N2 C19 53.2496(4) 2_665 . -202_455 N H4 N2 C19 106.8844(17) 2_665 . -203_555 N H4 N2 N5 45.45060(10) 2_665 . -201_565 N H4 N2 N5 122.5735(17) 2_665 . -202_455 N H4 N2 N5 92.8460(9) 2_665 . -203_555 N H4 N2 H38 29.74170(10) 2_665 . -202_455 N H5 N2 C15 99.97860(10) 3_565 . -201_565 N H5 N2 C15 56.83260(20) 3_565 . -202_455 N H5 N2 C17 18.91290(10) 3_565 . -201_565 N H5 N2 C17 131.35860(30) 3_565 . -203_555 N H5 N2 C18 130.27859(10) 3_565 . -202_455 N H5 N2 C18 61.6085(11) 3_565 . -203_555 N H5 N2 C19 122.4302(11) 3_565 . -201_565 N H5 N2 C19 100.7054(12) 3_565 . -202_455 N H5 N2 C19 68.97010(30) 3_565 . -203_555 N H5 N2 N5 65.86710(20) 3_565 . -201_565 N H5 N2 N5 86.1098(5) 3_565 . -202_455 N H5 N2 N5 132.9542(14) 3_565 . -203_555 N H5 N2 H38 60.68860(10) 3_565 . -202_455 N C15 N2 C15 147.82310(30) -201_565 . -202_455 N C15 N2 C17 116.962 -201_565 . -201_565 N C15 N2 C17 40.00470(20) -201_565 . -203_555 N C15 N2 C18 38.47230(30) -201_565 . -202_455 N C15 N2 C18 121.7586(8) -201_565 . -203_555 N C15 N2 C19 117.3731 -201_565 . -201_565 N C15 N2 C19 74.0091(10) -201_565 . -202_455 N C15 N2 C19 142.3383(7) -201_565 . -203_555 N C15 N2 N5 80.6963(9) -201_565 . -201_565 N C15 N2 N5 152.3924(6) -201_565 . -202_455 N C15 N2 N5 96.36760(30) -201_565 . -203_555 N C15 N2 H38 66.3193(10) -201_565 . -202_455 N C15 N2 C17 37.92150(20) -202_455 . -201_565 N C15 N2 C17 171.2321 -202_455 . -203_555 N C15 N2 C18 139.0596(12) -202_455 . -202_455 N C15 N2 C18 30.2347(6) -202_455 . -203_555 N C15 N2 C19 94.70030(20) -202_455 . -201_565 N C15 N2 C19 128.1154(7) -202_455 . -202_455 N C15 N2 C19 55.5149(12) -202_455 . -203_555 N C15 N2 N5 105.0512 -202_455 . -201_565 N C15 N2 N5 56.0750(8) -202_455 . -202_455 N C15 N2 N5 115.7248 -202_455 . -203_555 N C15 N2 H38 110.87120(10) -202_455 . -202_455 N C17 N2 C17 150.22591(20) -201_565 . -203_555 N C17 N2 C18 139.89600(30) -201_565 . -202_455 N C17 N2 C18 46.7220(11) -201_565 . -203_555 N C17 N2 C19 115.3735(6) -201_565 . -201_565 N C17 N2 C19 112.2277(11) -201_565 . -202_455 N C17 N2 C19 61.34330(20) -201_565 . -203_555 N C17 N2 N5 78.64200(10) -201_565 . -201_565 N C17 N2 N5 74.75570(10) -201_565 . -202_455 N C17 N2 N5 132.1532(9) -201_565 . -203_555 N C17 N2 H38 77.30510(10) -201_565 . -202_455 N C17 N2 C18 40.8914(12) -203_555 . -202_455 N C17 N2 C18 151.6812(7) -203_555 . -203_555 N C17 N2 C19 78.06920(10) -203_555 . -201_565 N C17 N2 C19 51.4299(7) -203_555 . -202_455 N C17 N2 C19 121.7083(11) -203_555 . -203_555 N C17 N2 N5 78.54040(10) -203_555 . -201_565 N C17 N2 N5 118.0785(6) -203_555 . -202_455 N C17 N2 N5 57.13880(10) -203_555 . -203_555 N C17 N2 H38 75.0411 -203_555 . -202_455 N C18 N2 C18 110.7898(19) -202_455 . -203_555 N C18 N2 C19 104.6054(10) -202_455 . -201_565 N C18 N2 C19 92.1974(19) -202_455 . -202_455 N C18 N2 C19 158.69550(20) -202_455 . -203_555 N C18 N2 N5 113.9754(13) -202_455 . -201_565 N C18 N2 N5 143.6100(4) -202_455 . -202_455 N C18 N2 N5 87.4924(13) -202_455 . -203_555 N C18 N2 H38 103.1140(14) -202_455 . -202_455 N C18 N2 C19 118.5748(7) -203_555 . -201_565 N C18 N2 C19 156.6568 -203_555 . -202_455 N C18 N2 C19 85.6772(18) -203_555 . -203_555 N C18 N2 N5 125.3080(9) -203_555 . -201_565 N C18 N2 N5 84.9171(14) -203_555 . -202_455 N C18 N2 N5 138.0291(5) -203_555 . -203_555 N C18 N2 H38 122.1899(9) -203_555 . -202_455 N C19 N2 C19 55.9050(9) -201_565 . -202_455 N C19 N2 C19 54.4563(8) -201_565 . -203_555 N C19 N2 N5 78.2280(16) -201_565 . -201_565 N C19 N2 N5 41.5118(5) -201_565 . -202_455 N C19 N2 N5 21.02450(20) -201_565 . -203_555 N C19 N2 H38 94.9739(19) -201_565 . -202_455 N C19 N2 C19 73.1069(18) -202_455 . -203_555 N C19 N2 N5 34.8408(10) -202_455 . -201_565 N C19 N2 N5 78.4070(15) -202_455 . -202_455 N C19 N2 N5 43.1847(5) -202_455 . -203_555 N C19 N2 H38 44.3998(11) -202_455 . -202_455 N C19 N2 N5 61.7970(16) -203_555 . -201_565 N C19 N2 N5 19.87120(10) -203_555 . -202_455 N C19 N2 N5 71.2235(11) -203_555 . -203_555 N C19 N2 H38 77.4076(18) -203_555 . -202_455 N N5 N2 N5 77.3271(16) -201_565 . -202_455 N N5 N2 N5 73.8420(14) -201_565 . -203_555 N N5 N2 H38 18.15410(30) -201_565 . -202_455 N N5 N2 N5 61.5711(7) -202_455 . -203_555 N N5 N2 H38 94.4874(19) -202_455 . -202_455 N N5 N2 H38 87.1193(16) -203_555 . -202_455 N C5 N3 C5 100.2220(19) 1_555 . 2_665 N C5 N3 C6 105.2106(6) 1_555 . 1_555 N C5 N3 C6 32.2871(4) 1_555 . 2_665 N C5 N3 C6 120.8845(12) 1_555 . 3_565 N C5 N3 C7 104.9556(12) 1_555 . 1_555 N C5 N3 C7 27.58120(20) 1_555 . 3_565 N C5 N3 C8 111.8906(17) 1_555 . 1_555 N C5 N3 N3 133.0033(8) 1_555 . 2_665 N C5 N3 N3 93.43330(10) 1_555 . 3_565 N C5 N3 H12 52.1511(9) 1_555 . 2_665 N C5 N3 H13 116.7472(4) 1_555 . 3_565 N C5 N3 C13 87.1592(14) 1_555 . -201_565 N C5 N3 C13 137.2282(7) 1_555 . -202_455 N C5 N3 C13 140.79240(20) 1_555 . -203_555 N C5 N3 C14 97.0160(19) 1_555 . -201_565 N C5 N3 C14 7.30370(10) 1_555 . -203_555 N C5 N3 N4 61.1931(13) 1_555 . -201_565 N C5 N3 N4 59.1448(14) 1_555 . -202_455 N C5 N3 N4 83.5804(19) 1_555 . -203_555 N C5 N3 H26 76.6981(20) 1_555 . -201_565 N C5 N3 H27 102.2650(6) 1_555 . -202_455 N C5 N3 H28 39.5736(4) 1_555 . -203_555 N C5 N3 C6 85.33820(30) 2_665 . 1_555 N C5 N3 C6 131.2243(14) 2_665 . 2_665 N C5 N3 C6 23.3971(6) 2_665 . 3_565 N C5 N3 C7 24.08530(10) 2_665 . 1_555 N C5 N3 C7 125.4560(16) 2_665 . 3_565 N C5 N3 C8 135.2178(6) 2_665 . 1_555 N C5 N3 N3 60.2556(4) 2_665 . 2_665 N C5 N3 N3 108.61050(20) 2_665 . 3_565 N C5 N3 H12 118.61690(20) 2_665 . 2_665 N C5 N3 H13 65.3998(12) 2_665 . 3_565 N C5 N3 C13 156.65570(20) 2_665 . -201_565 N C5 N3 C13 81.7070(18) 2_665 . -202_455 N C5 N3 C13 86.5263(10) 2_665 . -203_555 N C5 N3 C14 3.5949 2_665 . -201_565 N C5 N3 C14 98.5228(19) 2_665 . -203_555 N C5 N3 N4 73.8318(14) 2_665 . -201_565 N C5 N3 N4 49.7278(8) 2_665 . -202_455 N C5 N3 N4 48.2447(7) 2_665 . -203_555 N C5 N3 H26 151.85120(30) 2_665 . -201_565 N C5 N3 H27 79.1532(9) 2_665 . -202_455 N C5 N3 H28 111.0505(7) 2_665 . -203_555 N C6 N3 C6 96.38730(10) 1_555 . 2_665 N C6 N3 C6 90.29630(10) 1_555 . 3_565 N C6 N3 C7 106.45870(30) 1_555 . 1_555 N C6 N3 C7 94.65710(20) 1_555 . 3_565 N C6 N3 C8 113.68670(30) 1_555 . 1_555 N C6 N3 N3 37.4145 1_555 . 2_665 N C6 N3 N3 24.40730(10) 1_555 . 3_565 N C6 N3 H12 147.546 1_555 . 2_665 N C6 N3 H13 131.7139 1_555 . 3_565 N C6 N3 C13 71.3360(5) 1_555 . -201_565 N C6 N3 C13 117.49130(10) 1_555 . -202_455 N C6 N3 C13 36.3469(8) 1_555 . -203_555 N C6 N3 C14 84.57630(30) 1_555 . -201_565 N C6 N3 C14 98.0315(5) 1_555 . -203_555 N C6 N3 N4 49.2579(6) 1_555 . -201_565 N C6 N3 N4 72.79330(10) 1_555 . -202_455 N C6 N3 N4 47.2801(6) 1_555 . -203_555 N C6 N3 H26 122.66220(10) 1_555 . -201_565 N C6 N3 H27 150.40930(10) 1_555 . -202_455 N C6 N3 H28 141.68320(30) 1_555 . -203_555 N C6 N3 C6 153.1088(8) 2_665 . 3_565 N C6 N3 C7 136.6193(8) 2_665 . 1_555 N C6 N3 C7 5.97930(20) 2_665 . 3_565 N C6 N3 C8 88.4376(10) 2_665 . 1_555 N C6 N3 N3 133.65781(10) 2_665 . 2_665 N C6 N3 N3 75.6255 2_665 . 3_565 N C6 N3 H12 51.65060(20) 2_665 . 2_665 N C6 N3 H13 131.87070(10) 2_665 . 3_565 N C6 N3 C13 55.2198(10) 2_665 . -201_565 N C6 N3 C13 135.93770(10) 2_665 . -202_455 N C6 N3 C13 122.06290(20) 2_665 . -203_555 N C6 N3 C14 127.7752(15) 2_665 . -201_565 N C6 N3 C14 32.8116(5) 2_665 . -203_555 N C6 N3 N4 71.20560(30) 2_665 . -201_565 N C6 N3 N4 84.1474(7) 2_665 . -202_455 N C6 N3 N4 99.8615(10) 2_665 . -203_555 N C6 N3 H26 54.9553(12) 2_665 . -201_565 N C6 N3 H27 112.80390(20) 2_665 . -202_455 N C6 N3 H28 46.45280(10) 2_665 . -203_555 N C6 N3 C7 19.56360(10) 3_565 . 1_555 N C6 N3 C7 147.8001(10) 3_565 . 3_565 N C6 N3 C8 112.6419 3_565 . 1_555 N C6 N3 N3 55.90450(10) 3_565 . 2_665 N C6 N3 N3 114.5813 3_565 . 3_565 N C6 N3 H12 120.5839 3_565 . 2_665 N C6 N3 H13 48.4587(6) 3_565 . 3_565 N C6 N3 C13 150.25670(20) 3_565 . -201_565 N C6 N3 C13 59.4663(12) 3_565 . -202_455 N C6 N3 C13 77.1825(4) 3_565 . -203_555 N C6 N3 C14 26.9916(6) 3_565 . -201_565 N C6 N3 C14 120.4763(13) 3_565 . -203_555 N C6 N3 N4 94.3749(8) 3_565 . -201_565 N C6 N3 N4 72.98830(20) 3_565 . -202_455 N C6 N3 N4 66.20490(10) 3_565 . -203_555 N C6 N3 H26 138.93781(20) 3_565 . -201_565 N C6 N3 H27 65.9763(4) 3_565 . -202_455 N C6 N3 H28 118.73860(20) 3_565 . -203_555 N C7 N3 C7 132.5084(10) 1_555 . 3_565 N C7 N3 C8 113.8710(5) 1_555 . 1_555 N C7 N3 N3 74.66060(10) 1_555 . 2_665 N C7 N3 N3 130.72141(20) 1_555 . 3_565 N C7 N3 H12 102.3887 1_555 . 2_665 N C7 N3 H13 41.9051(11) 1_555 . 3_565 N C7 N3 C13 167.74060(20) 1_555 . -201_565 N C7 N3 C13 61.9025(17) 1_555 . -202_455 N C7 N3 C13 96.7455(5) 1_555 . -203_555 N C7 N3 C14 26.56850(10) 1_555 . -201_565 N C7 N3 C14 106.2710(14) 1_555 . -203_555 N C7 N3 N4 96.5027(13) 1_555 . -201_565 N C7 N3 N4 68.7824(6) 1_555 . -202_455 N C7 N3 N4 72.2755(6) 1_555 . -203_555 N C7 N3 H26 128.87981(30) 1_555 . -201_565 N C7 N3 H27 55.1106(8) 1_555 . -202_455 N C7 N3 H28 99.32440(30) 1_555 . -203_555 N C7 N3 C8 94.3706(11) 3_565 . 1_555 N C7 N3 N3 131.33791(20) 3_565 . 2_665 N C7 N3 N3 75.33120(10) 3_565 . 3_565 N C7 N3 H12 54.16170(30) 3_565 . 2_665 N C7 N3 H13 133.48911(20) 3_565 . 3_565 N C7 N3 C13 59.5788(12) 3_565 . -201_565 N C7 N3 C13 140.7119 3_565 . -202_455 N C7 N3 C13 123.01850(30) 3_565 . -203_555 N C7 N3 C14 121.9753(16) 3_565 . -201_565 N C7 N3 C14 27.32440(30) 3_565 . -203_555 N C7 N3 N4 66.0850(5) 3_565 . -201_565 N C7 N3 N4 78.1703(9) 3_565 . -202_455 N C7 N3 N4 94.4700(12) 3_565 . -203_555 N C7 N3 H26 60.6213(14) 3_565 . -201_565 N C7 N3 H27 114.87480(30) 3_565 . -202_455 N C7 N3 H28 47.35580(10) 3_565 . -203_555 N C8 N3 N3 110.5826(7) 1_555 . 2_665 N C8 N3 N3 99.98880(30) 1_555 . 3_565 N C8 N3 H12 65.9587(6) 1_555 . 2_665 N C8 N3 H13 72.4318(6) 1_555 . 3_565 N C8 N3 C13 58.3585(8) 1_555 . -201_565 N C8 N3 C13 53.5141(12) 1_555 . -202_455 N C8 N3 C13 87.4978(14) 1_555 . -203_555 N C8 N3 C14 138.6459(7) 1_555 . -201_565 N C8 N3 C14 116.9192(16) 1_555 . -203_555 N C8 N3 N4 149.3014(8) 1_555 . -201_565 N C8 N3 N4 170.73640(30) 1_555 . -202_455 N C8 N3 N4 159.6690(4) 1_555 . -203_555 N C8 N3 H26 35.33400(30) 1_555 . -201_565 N C8 N3 H27 64.4832(4) 1_555 . -202_455 N C8 N3 H28 79.5030(10) 1_555 . -203_555 N N3 N3 N3 60.0 2_665 . 3_565 N N3 N3 H12 174.37170(10) 2_665 . 2_665 N N3 N3 H13 94.4539 2_665 . 3_565 N N3 N3 C13 98.58920(10) 2_665 . -201_565 N N3 N3 C13 85.27790(10) 2_665 . -202_455 N N3 N3 C13 27.1007(6) 2_665 . -203_555 N N3 N3 C14 61.3650(4) 2_665 . -201_565 N N3 N3 C14 126.0416(8) 2_665 . -203_555 N N3 N3 N4 72.0543(4) 2_665 . -201_565 N N3 N3 N4 78.6236(4) 2_665 . -202_455 N N3 N3 N4 50.8382(10) 2_665 . -203_555 N N3 N3 H26 140.6530(9) 2_665 . -201_565 N N3 N3 H27 113.52880(10) 2_665 . -202_455 N N3 N3 H28 169.61450(30) 2_665 . -203_555 N N3 N3 H12 124.3071 3_565 . 2_665 N N3 N3 H13 149.69020(30) 3_565 . 3_565 N N3 N3 C13 48.4595(5) 3_565 . -201_565 N N3 N3 C13 126.8115(7) 3_565 . -202_455 N N3 N3 C13 48.51560(30) 3_565 . -203_555 N N3 N3 C14 107.35710(20) 3_565 . -201_565 N N3 N3 C14 87.2676 3_565 . -203_555 N N3 N3 N4 53.5475(10) 3_565 . -201_565 N N3 N3 N4 83.56480(20) 3_565 . -202_455 N N3 N3 N4 64.7897(6) 3_565 . -203_555 N N3 N3 H26 99.52340(10) 3_565 . -201_565 N N3 N3 H27 161.0883(6) 3_565 . -202_455 N N3 N3 H28 122.0398 3_565 . -203_555 N H12 N3 H13 80.3206 2_665 . 3_565 N H12 N3 C13 83.41870(10) 2_665 . -201_565 N H12 N3 C13 89.10220(20) 2_665 . -202_455 N H12 N3 C13 151.8361(8) 2_665 . -203_555 N H12 N3 C14 117.89110(20) 2_665 . -201_565 N H12 N3 C14 59.2087(8) 2_665 . -203_555 N H12 N3 N4 113.2650(4) 2_665 . -201_565 N H12 N3 N4 104.94790(30) 2_665 . -202_455 N H12 N3 N4 133.2625(9) 2_665 . -203_555 N H12 N3 H26 38.1958(7) 2_665 . -201_565 N H12 N3 H27 61.1646 2_665 . -202_455 N H12 N3 H28 13.7090(5) 2_665 . -203_555 N H13 N3 C13 130.6137(14) 3_565 . -201_565 N H13 N3 C13 26.4496(4) 3_565 . -202_455 N H13 N3 C13 101.2730(6) 3_565 . -203_555 N H13 N3 C14 68.2468(12) 3_565 . -201_565 N H13 N3 C14 122.61500(30) 3_565 . -203_555 N H13 N3 N4 138.22610(20) 3_565 . -201_565 N H13 N3 N4 108.6778(5) 3_565 . -202_455 N H13 N3 N4 113.3633(4) 3_565 . -203_555 N H13 N3 H26 90.6512(7) 3_565 . -201_565 N H13 N3 H27 19.24820(10) 3_565 . -202_455 N H13 N3 H28 86.14490(20) 3_565 . -203_555 N C13 N3 C13 107.8728(19) -201_565 . -202_455 N C13 N3 C13 74.2379(6) -201_565 . -203_555 N C13 N3 C14 155.77831(20) -201_565 . -201_565 N C13 N3 C14 85.9843(16) -201_565 . -203_555 N C13 N3 N4 90.9555(16) -201_565 . -201_565 N C13 N3 N4 120.5407(9) -201_565 . -202_455 N C13 N3 N4 111.7008(10) -201_565 . -203_555 N C13 N3 H26 51.3672(6) -201_565 . -201_565 N C13 N3 H27 121.1810(12) -201_565 . -202_455 N C13 N3 H28 88.7860(4) -201_565 . -203_555 N C13 N3 C13 81.8476(9) -202_455 . -203_555 N C13 N3 C14 85.1586(19) -202_455 . -201_565 N C13 N3 C14 144.2778(6) -202_455 . -203_555 N C13 N3 N4 152.5972(5) -202_455 . -201_565 N C13 N3 N4 130.5600(11) -202_455 . -202_455 N C13 N3 N4 123.5848(11) -202_455 . -203_555 N C13 N3 H26 82.2285(14) -202_455 . -201_565 N C13 N3 H27 35.57330(10) -202_455 . -202_455 N C13 N3 H28 99.47580(30) -202_455 . -203_555 N C13 N3 C14 87.9955(10) -203_555 . -201_565 N C13 N3 C14 133.87080(30) -203_555 . -203_555 N C13 N3 N4 84.4901(14) -203_555 . -201_565 N C13 N3 N4 101.1399(11) -203_555 . -202_455 N C13 N3 N4 72.3445(17) -203_555 . -203_555 N C13 N3 H26 113.8088(14) -203_555 . -201_565 N C13 N3 H27 116.9207(8) -203_555 . -202_455 N C13 N3 H28 162.40910(20) -203_555 . -203_555 N C14 N3 C14 95.1393(20) -201_565 . -203_555 N C14 N3 N4 70.6890(14) -201_565 . -201_565 N C14 N3 N4 46.1556(8) -201_565 . -202_455 N C14 N3 N4 45.7429(8) -201_565 . -203_555 N C14 N3 H26 152.7584(4) -201_565 . -201_565 N C14 N3 H27 81.3642(10) -201_565 . -202_455 N C14 N3 H28 109.5924(8) -201_565 . -203_555 N C14 N3 N4 54.0653(12) -203_555 . -201_565 N C14 N3 N4 54.4220(14) -203_555 . -202_455 N C14 N3 N4 77.3843(18) -203_555 . -203_555 N C14 N3 H26 81.5858(20) -203_555 . -201_565 N C14 N3 H27 109.0269(5) -203_555 . -202_455 N C14 N3 H28 46.81650(30) -203_555 . -203_555 N N4 N3 N4 31.0164(8) -201_565 . -202_455 N N4 N3 N4 29.0294(7) -201_565 . -203_555 N N4 N3 H26 125.1110(9) -201_565 . -201_565 N N4 N3 H27 144.3400(4) -201_565 . -202_455 N N4 N3 H28 100.6798(9) -201_565 . -203_555 N N4 N3 N4 28.8034(6) -202_455 . -203_555 N N4 N3 H26 135.8390(6) -202_455 . -201_565 N N4 N3 H27 113.4943(4) -202_455 . -202_455 N N4 N3 H28 91.3480(8) -202_455 . -203_555 N N4 N3 H26 154.11830(30) -203_555 . -201_565 N N4 N3 H27 126.93730(20) -203_555 . -202_455 N N4 N3 H28 119.5560(14) -203_555 . -203_555 N H26 N3 H27 74.3343(5) -201_565 . -202_455 N H26 N3 H28 49.6170(12) -201_565 . -203_555 N H27 N3 H28 67.8785(4) -202_455 . -203_555 N Al2 O1 P1 149.9(21) 1_565 . 1_565 N Al2 O1 Si1 149.9(21) 1_565 . 1_565 N P1 O1 Si1 0.0 1_565 . 1_565 N Al1 O2 P2 143.6(18) 1_555 . 1_655 N Al1 O2 Si2 143.6(18) 1_555 . 1_655 N P2 O2 Si2 0.0 1_655 . 1_655 N Al1 O3 P1 155.5(12) 1_455 . -3_556 N Al1 O3 Si1 155.5(12) 1_455 . -3_556 N P1 O3 Si1 0.0 -3_556 . -3_556 N Al1 O4 P1 138.8(10) 1_555 . -1_656 N Al1 O4 Si1 138.8(10) 1_555 . -1_656 N P1 O4 Si1 0.0 -1_656 . -1_656 N Al3 O5 P1 139.9(16) 101_455 . 1_565 N Al3 O5 Si1 139.9(16) 101_455 . 1_565 N P1 O5 Si1 0.0 1_565 . 1_565 N Al1 O6 P3 152.5(16) 1_555 . 201_554 N Al1 O6 Si3 152.5(16) 1_555 . 201_554 N P3 O6 Si3 0.0 201_554 . 201_554 N Al2 O7 P2 160.4(10) -1_656 . 1_655 N Al2 O7 Si2 160.4(10) -1_656 . 1_655 N P2 O7 Si2 0.0 1_655 . 1_655 N Al2 O8 P2 141.8(10) 201_554 . 1_655 N Al2 O8 Si2 141.8(10) 201_554 . 1_655 N P2 O8 Si2 0.0 1_655 . 1_655 N Al2 O9 P2 149.2(11) -3_556 . 1_555 N Al2 O9 Si2 149.2(11) -3_556 . 1_555 N P2 O9 Si2 0.0 1_555 . 1_555 N Al3 O10 P3 143.0(14) 1_556 . 2_655 N Al3 O10 Si3 143.0(14) 1_556 . 2_655 N P3 O10 Si3 0.0 2_655 . 2_655 N Al3 O11 P3 148.7(14) 1_455 . -3_556 N Al3 O11 Si3 148.7(14) 1_455 . -3_556 N P3 O11 Si3 0.0 -3_556 . -3_556 N Al3 O12 P3 156.9(12) 1_555 . -1_656 N Al3 O12 Si3 156.9(12) 1_555 . -1_656 N P3 O12 Si3 0.0 -1_656 . -1_656 N O1 P1 O3 111.8(17) 1_545 . -2_556 N O1 P1 O4 110.0(14) 1_545 . -1_656 N O1 P1 O5 103.2(14) 1_545 . 1_545 N O3 P1 O4 100.2(6) -2_556 . -1_656 N O3 P1 O5 111.4(10) -2_556 . 1_545 N O4 P1 O5 120.5(14) -1_656 . 1_545 N O2 P2 O7 105.5(12) 1_455 . 1_455 N O2 P2 O8 106.8(17) 1_455 . 1_455 N O2 P2 O9 120.1(18) 1_455 . 1_555 N O7 P2 O8 108.6(11) 1_455 . 1_455 N O7 P2 O9 106.8(9) 1_455 . 1_555 N O8 P2 O9 108.6(17) 1_455 . 1_555 N O6 P3 O10 99.8(12) 101_445 . 3_665 N O6 P3 O11 113.3(11) 101_445 . -2_556 N O6 P3 O12 99.1(12) 101_445 . -1_656 N O10 P3 O11 117.2(16) 3_665 . -2_556 N O10 P3 O12 106.4(15) 3_665 . -1_656 N O11 P3 O12 118.1(8) -2_556 . -1_656 N O1 Si1 O3 111.8(17) 1_545 . -2_556 N O1 Si1 O4 110.0(14) 1_545 . -1_656 N O1 Si1 O5 103.2(14) 1_545 . 1_545 N O3 Si1 O4 100.2(6) -2_556 . -1_656 N O3 Si1 O5 111.4(10) -2_556 . 1_545 N O4 Si1 O5 120.5(14) -1_656 . 1_545 N O2 Si2 O7 105.5(12) 1_455 . 1_455 N O2 Si2 O8 106.8(17) 1_455 . 1_455 N O2 Si2 O9 120.1(18) 1_455 . 1_555 N O7 Si2 O8 108.6(11) 1_455 . 1_455 N O7 Si2 O9 106.8(9) 1_455 . 1_555 N O8 Si2 O9 108.6(17) 1_455 . 1_555 N O6 Si3 O10 99.8(12) 101_445 . 3_665 N O6 Si3 O11 113.3(11) 101_445 . -2_556 N O6 Si3 O12 99.1(12) 101_445 . -1_656 N O10 Si3 O11 117.2(16) 3_665 . -2_556 N O10 Si3 O12 106.4(15) 3_665 . -1_656 N O11 Si3 O12 118.1(8) -2_556 . -1_656 N C8 C9 C8 69.3763(19) 1_555 . 2_665 N C8 C9 C9 92.73010(10) 1_555 . 2_665 N C8 C9 C9 56.7116(8) 1_555 . 3_565 N C8 C9 C10 112.5848(18) 1_555 . 1_555 N C8 C9 C10 149.0102(7) 1_555 . 2_665 N C8 C9 C10 145.3682(8) 1_555 . -203_555 N C8 C9 H17 67.4377(16) 1_555 . 2_665 N C8 C9 H18 109.8177(9) 1_555 . 1_555 N C8 C9 H19 109.5830(4) 1_555 . 1_555 N C8 C9 H19 64.8177(5) 1_555 . 2_665 N C8 C9 H19 55.5893(8) 1_555 . 3_565 N C8 C9 H21 148.8860(7) 1_555 . 2_665 N C8 C9 C11 83.1461(12) 1_555 . -201_565 N C8 C9 C11 91.5623(20) 1_555 . -202_455 N C8 C9 C11 133.6735(5) 1_555 . -203_555 N C8 C9 C12 61.5044(9) 1_555 . -201_565 N C8 C9 C12 17.93140(20) 1_555 . -202_455 N C8 C9 C12 58.1913(16) 1_555 . -203_555 N C8 C9 H22 72.7013(17) 1_555 . -201_565 N C8 C9 H22 164.70660(30) 1_555 . -202_455 N C8 C9 H23 84.8946(12) 1_555 . -202_455 N C8 C9 H24 80.8856(18) 1_555 . -201_565 N C8 C9 H24 9.40990(20) 1_555 . -203_555 N C8 C9 H25 83.5109(18) 1_555 . -203_555 N C8 C9 C9 75.4372(4) 2_665 . 2_665 N C8 C9 C9 104.3106(4) 2_665 . 3_565 N C8 C9 C10 173.97440(20) 2_665 . 1_555 N C8 C9 C10 118.3210(18) 2_665 . 2_665 N C8 C9 C10 144.7742(11) 2_665 . -203_555 N C8 C9 H17 49.9621(12) 2_665 . 2_665 N C8 C9 H18 74.35460(10) 2_665 . 1_555 N C8 C9 H19 65.4212(7) 2_665 . 1_555 N C8 C9 H19 96.81300(20) 2_665 . 2_665 N C8 C9 H19 119.7648(9) 2_665 . 3_565 N C8 C9 H21 140.7576(12) 2_665 . 2_665 N C8 C9 C11 110.7636(6) 2_665 . -201_565 N C8 C9 C11 160.75360(10) 2_665 . -202_455 N C8 C9 C11 91.5518(17) 2_665 . -203_555 N C8 C9 C12 53.4096(8) 2_665 . -201_565 N C8 C9 C12 73.3913(17) 2_665 . -202_455 N C8 C9 C12 11.20050(30) 2_665 . -203_555 N C8 C9 H22 134.19189(20) 2_665 . -201_565 N C8 C9 H22 115.8049(17) 2_665 . -202_455 N C8 C9 H23 135.2031 2_665 . -202_455 N C8 C9 H24 19.94210(20) 2_665 . -201_565 N C8 C9 H24 74.0380(19) 2_665 . -203_555 N C8 C9 H25 43.4479(9) 2_665 . -203_555 N C9 C9 C9 60.0 2_665 . 3_565 N C9 C9 C10 98.65450(30) 2_665 . 1_555 N C9 C9 C10 63.3799(7) 2_665 . 2_665 N C9 C9 C10 92.81910(10) 2_665 . -203_555 N C9 C9 H17 125.2715(8) 2_665 . 2_665 N C9 C9 H18 132.2401 2_665 . 1_555 N C9 C9 H19 26.2483 2_665 . 1_555 N C9 C9 H19 44.0463 2_665 . 2_665 N C9 C9 H19 125.6464 2_665 . 3_565 N C9 C9 H21 101.9762(4) 2_665 . 2_665 N C9 C9 C11 42.93980(20) 2_665 . -201_565 N C9 C9 C11 109.29070(30) 2_665 . -202_455 N C9 C9 C11 40.9798(5) 2_665 . -203_555 N C9 C9 C12 34.2640(9) 2_665 . -201_565 N C9 C9 C12 76.71190(20) 2_665 . -202_455 N C9 C9 C12 77.9318(4) 2_665 . -203_555 N C9 C9 H22 81.7429 2_665 . -201_565 N C9 C9 H22 102.47570(30) 2_665 . -202_455 N C9 C9 H23 144.04359(30) 2_665 . -202_455 N C9 C9 H24 57.4737(6) 2_665 . -201_565 N C9 C9 H24 101.94450(20) 2_665 . -203_555 N C9 C9 H25 115.9076(4) 2_665 . -203_555 N C9 C9 C10 73.1782(5) 3_565 . 1_555 N C9 C9 C10 92.96040(10) 3_565 . 2_665 N C9 C9 C10 97.69150(30) 3_565 . -203_555 N C9 C9 H17 124.1245(8) 3_565 . 2_665 N C9 C9 H18 164.74350(20) 3_565 . 1_555 N C9 C9 H19 86.2483 3_565 . 1_555 N C9 C9 H19 15.9537 3_565 . 2_665 N C9 C9 H19 65.6463 3_565 . 3_565 N C9 C9 H21 107.8649(6) 3_565 . 2_665 N C9 C9 C11 27.7222(4) 3_565 . -201_565 N C9 C9 C11 65.0304(4) 3_565 . -202_455 N C9 C9 C11 90.8138 3_565 . -203_555 N C9 C9 C12 55.5952(4) 3_565 . -201_565 N C9 C9 C12 40.8404(10) 3_565 . -202_455 N C9 C9 C12 96.74220(20) 3_565 . -203_555 N C9 C9 H22 30.9534(5) 3_565 . -201_565 N C9 C9 H22 130.4944(10) 3_565 . -202_455 N C9 C9 H23 89.7752 3_565 . -202_455 N C9 C9 H24 99.18260(20) 3_565 . -201_565 N C9 C9 H24 61.4155(6) 3_565 . -203_555 N C9 C9 H25 138.2711(10) 3_565 . -203_555 N C10 C9 C10 56.9214(17) 1_555 . 2_665 N C10 C9 C10 32.8047(11) 1_555 . -203_555 N C10 C9 H17 136.0076(11) 1_555 . 2_665 N C10 C9 H18 109.5514 1_555 . 1_555 N C10 C9 H19 108.7338(6) 1_555 . 1_555 N C10 C9 H19 79.36410(30) 1_555 . 2_665 N C10 C9 H19 64.5421(8) 1_555 . 3_565 N C10 C9 H21 38.5536(12) 1_555 . 2_665 N C10 C9 C11 64.4275(4) 1_555 . -201_565 N C10 C9 C11 22.71490(20) 1_555 . -202_455 N C10 C9 C11 83.0646(15) 1_555 . -203_555 N C10 C9 C12 121.9458(9) 1_555 . -201_565 N C10 C9 C12 106.6873(17) 1_555 . -202_455 N C10 C9 C12 169.57600(30) 1_555 . -203_555 N C10 C9 H22 44.45240(10) 1_555 . -201_565 N C10 C9 H22 63.8831(17) 1_555 . -202_455 N C10 C9 H23 50.72500(10) 1_555 . -202_455 N C10 C9 H24 154.1464(4) 1_555 . -201_565 N C10 C9 H24 108.7821(19) 1_555 . -203_555 N C10 C9 H25 141.4984(7) 1_555 . -203_555 N C10 C9 C10 32.2392(9) 2_665 . -203_555 N C10 C9 H17 142.0091(9) 2_665 . 2_665 N C10 C9 H18 101.05320(20) 2_665 . 1_555 N C10 C9 H19 57.1354(9) 2_665 . 1_555 N C10 C9 H19 84.21770(10) 2_665 . 2_665 N C10 C9 H19 121.3197(9) 2_665 . 3_565 N C10 C9 H21 39.1901(11) 2_665 . 2_665 N C10 C9 C11 65.9540(5) 2_665 . -201_565 N C10 C9 C11 79.3681(19) 2_665 . -202_455 N C10 C9 C11 28.48260(10) 2_665 . -203_555 N C10 C9 C12 97.6112(16) 2_665 . -201_565 N C10 C9 C12 131.3055(9) 2_665 . -202_455 N C10 C9 C12 127.8159(16) 2_665 . -203_555 N C10 C9 H22 83.9387(12) 2_665 . -201_565 N C10 C9 H22 43.2151(10) 2_665 . -202_455 N C10 C9 H23 102.7673(16) 2_665 . -202_455 N C10 C9 H24 99.9030(20) 2_665 . -201_565 N C10 C9 H24 154.2472(5) 2_665 . -203_555 N C10 C9 H25 123.6685(12) 2_665 . -203_555 N C10 C9 H17 132.7240(12) -203_555 . 2_665 N C10 C9 H18 91.1210(6) -203_555 . 1_555 N C10 C9 H19 89.3309 -203_555 . 1_555 N C10 C9 H19 97.06840(30) -203_555 . 2_665 N C10 C9 H19 94.23500(20) -203_555 . 3_565 N C10 C9 H21 11.2569(4) -203_555 . 2_665 N C10 C9 C11 77.9403(9) -203_555 . -201_565 N C10 C9 C11 54.4711(12) -203_555 . -202_455 N C10 C9 C11 60.6306(8) -203_555 . -203_555 N C10 C9 C12 126.3600(8) -203_555 . -201_565 N C10 C9 C12 136.8906(7) -203_555 . -202_455 N C10 C9 C12 155.9213(8) -203_555 . -203_555 N C10 C9 H22 74.3388(10) -203_555 . -201_565 N C10 C9 H22 33.6310(8) -203_555 . -202_455 N C10 C9 H23 70.9434(7) -203_555 . -202_455 N C10 C9 H24 129.8302(11) -203_555 . -201_565 N C10 C9 H24 141.1798(8) -203_555 . -203_555 N C10 C9 H25 123.8523(13) -203_555 . -203_555 N H17 C9 H18 43.4436(6) 2_665 . 1_555 N H17 C9 H19 112.2635(5) 2_665 . 1_555 N H17 C9 H19 129.3187(10) 2_665 . 2_665 N H17 C9 H19 85.35130(10) 2_665 . 3_565 N H17 C9 H21 121.4707(16) 2_665 . 2_665 N H17 C9 C11 148.75819(30) 2_665 . -201_565 N H17 C9 C11 121.1354(11) 2_665 . -202_455 N H17 C9 C11 130.6599(5) 2_665 . -203_555 N H17 C9 C12 97.4249(19) 2_665 . -201_565 N H17 C9 C12 83.6924(18) 2_665 . -202_455 N H17 C9 C12 47.8634(12) 2_665 . -203_555 N H17 C9 H22 131.75050(30) 2_665 . -201_565 N H17 C9 H22 104.1147(18) 2_665 . -202_455 N H17 C9 H23 86.8019(12) 2_665 . -202_455 N H17 C9 H24 68.9319(15) 2_665 . -201_565 N H17 C9 H24 63.6388(14) 2_665 . -203_555 N H17 C9 H25 19.54940(30) 2_665 . -203_555 N H18 C9 H19 106.373 1_555 . 1_555 N H18 C9 H19 171.06190(30) 1_555 . 2_665 N H18 C9 H19 101.4265 1_555 . 3_565 N H18 C9 H21 80.1283(9) 1_555 . 2_665 N H18 C9 C11 167.00240(30) 1_555 . -201_565 N H18 C9 C11 111.45300(10) 1_555 . -202_455 N H18 C9 C11 104.37810(20) 1_555 . -203_555 N H18 C9 C12 127.2255(9) 1_555 . -201_565 N H18 C9 C12 126.9023(11) 1_555 . -202_455 N H18 C9 C12 79.46580(20) 1_555 . -203_555 N H18 C9 H22 144.35789(10) 1_555 . -201_565 N H18 C9 H22 60.6712(12) 1_555 . -202_455 N H18 C9 H23 81.32840(30) 1_555 . -202_455 N H18 C9 H24 84.43290(30) 1_555 . -201_565 N H18 C9 H24 104.1909(7) 1_555 . -203_555 N H18 C9 H25 33.6519(7) 1_555 . -203_555 N H19 C9 H19 70.2946 1_555 . 2_665 N H19 C9 H19 151.8947 1_555 . 3_565 N H19 C9 H21 94.72820(20) 1_555 . 2_665 N H19 C9 C11 66.95530(10) 1_555 . -201_565 N H19 C9 C11 126.6001(7) 1_555 . -202_455 N H19 C9 C11 28.7036(9) 1_555 . -203_555 N H19 C9 C12 48.4168(5) 1_555 . -201_565 N H19 C9 C12 96.97930(10) 1_555 . -202_455 N H19 C9 C12 72.4909(6) 1_555 . -203_555 N H19 C9 H22 105.81150(10) 1_555 . -201_565 N H19 C9 H22 85.25550(10) 1_555 . -202_455 N H19 C9 H23 159.1778(7) 1_555 . -202_455 N H19 C9 H24 45.4903(9) 1_555 . -201_565 N H19 C9 H24 118.8689(6) 1_555 . -203_555 N H19 C9 H25 97.02550(10) 1_555 . -203_555 N H19 C9 H19 81.6 2_665 . 3_565 N H19 C9 H21 108.1879(6) 2_665 . 2_665 N H19 C9 C11 19.4403(6) 2_665 . -201_565 N H19 C9 C11 76.46500(20) 2_665 . -202_455 N H19 C9 C11 76.80880(10) 2_665 . -203_555 N H19 C9 C12 44.2823(6) 2_665 . -201_565 N H19 C9 C12 47.1337(8) 2_665 . -202_455 N H19 C9 C12 91.59830(10) 2_665 . -203_555 N H19 C9 H22 42.77340(30) 2_665 . -201_565 N H19 C9 H22 126.1481(9) 2_665 . -202_455 N H19 C9 H23 104.70010(10) 2_665 . -202_455 N H19 C9 H24 87.5618 2_665 . -201_565 N H19 C9 H24 71.4330(4) 2_665 . -203_555 N H19 C9 H25 137.5441(10) 2_665 . -203_555 N H19 C9 H21 93.98950(10) 3_565 . 2_665 N H19 C9 C11 86.5297 3_565 . -201_565 N H19 C9 C11 41.9581(10) 3_565 . -202_455 N H19 C9 C11 143.8514(6) 3_565 . -203_555 N H19 C9 C12 109.82750(20) 3_565 . -201_565 N H19 C9 C12 62.0889(4) 3_565 . -202_455 N H19 C9 C12 109.2750(6) 3_565 . -203_555 N H19 C9 H22 49.18380(30) 3_565 . -201_565 N H19 C9 H22 112.4631(5) 3_565 . -202_455 N H19 C9 H23 31.2184(4) 3_565 . -202_455 N H19 C9 H24 135.6729(10) 3_565 . -201_565 N H19 C9 H24 48.1893(9) 3_565 . -203_555 N H19 C9 H25 103.92600(20) 3_565 . -203_555 N H21 C9 C11 89.1503(12) 2_665 . -201_565 N H21 C9 C11 57.7898(13) 2_665 . -202_455 N H21 C9 C11 66.3977(10) 2_665 . -203_555 N H21 C9 C12 136.1134(5) 2_665 . -201_565 N H21 C9 C12 145.1597(5) 2_665 . -202_455 N H21 C9 C12 151.5925(9) 2_665 . -203_555 N H21 C9 H22 82.3721(13) 2_665 . -201_565 N H21 C9 H22 25.3497(5) 2_665 . -202_455 N H21 C9 H23 67.0944(6) 2_665 . -202_455 N H21 C9 H24 130.0937(11) 2_665 . -201_565 N H21 C9 H24 142.1773(8) 2_665 . -203_555 N H21 C9 H25 113.2484(16) 2_665 . -203_555 N C11 C9 C11 67.8453(5) -201_565 . -202_455 N C11 C9 C11 64.2030(4) -201_565 . -203_555 N C11 C9 C12 57.5198(14) -201_565 . -201_565 N C11 C9 C12 65.9066(14) -201_565 . -202_455 N C11 C9 C12 107.8129(7) -201_565 . -203_555 N C11 C9 H22 39.02090(20) -201_565 . -201_565 N C11 C9 H22 106.8714(15) -201_565 . -202_455 N C11 C9 H23 101.3407(6) -201_565 . -202_455 N C11 C9 H24 97.1143(8) -201_565 . -201_565 N C11 C9 H24 88.7816(10) -201_565 . -203_555 N C11 C9 H25 154.06340(30) -201_565 . -203_555 N C11 C9 C11 104.1448(17) -202_455 . -203_555 N C11 C9 C12 120.3557(8) -202_455 . -201_565 N C11 C9 C12 89.3001(17) -202_455 . -202_455 N C11 C9 C12 149.5854(4) -202_455 . -203_555 N C11 C9 H22 34.18140(10) -202_455 . -201_565 N C11 C9 H22 81.9633(18) -202_455 . -202_455 N C11 C9 H23 35.2326 -202_455 . -202_455 N C11 C9 H24 164.01430(30) -202_455 . -201_565 N C11 C9 H24 86.7159(20) -202_455 . -203_555 N C11 C9 H25 134.6898(8) -202_455 . -203_555 N C11 C9 C12 73.1082(14) -203_555 . -201_565 N C11 C9 C12 117.4678(7) -203_555 . -202_455 N C11 C9 C12 100.0449(15) -203_555 . -203_555 N C11 C9 H22 96.5635(9) -203_555 . -201_565 N C11 C9 H22 61.5872(8) -203_555 . -202_455 N C11 C9 H23 131.1907(15) -203_555 . -202_455 N C11 C9 H24 72.2165(19) -203_555 . -201_565 N C11 C9 H24 142.92390(30) -203_555 . -203_555 N C11 C9 H25 111.6135(9) -203_555 . -203_555 N C12 C9 C12 48.8920(6) -201_565 . -202_455 N C12 C9 C12 50.7445(7) -201_565 . -203_555 N C12 C9 H22 86.1955(9) -201_565 . -201_565 N C12 C9 H22 133.5831(6) -201_565 . -202_455 N C12 C9 H23 140.64391(20) -201_565 . -202_455 N C12 C9 H24 43.7018(6) -201_565 . -201_565 N C12 C9 H24 70.9018(11) -201_565 . -203_555 N C12 C9 H25 96.5465(16) -201_565 . -203_555 N C12 C9 C12 63.0141(14) -202_455 . -203_555 N C12 C9 H22 62.8787(17) -202_455 . -201_565 N C12 C9 H22 170.4462 -202_455 . -202_455 N C12 C9 H23 93.2667(9) -202_455 . -202_455 N C12 C9 H24 79.1658(15) -202_455 . -201_565 N C12 C9 H24 25.9697(4) -202_455 . -203_555 N C12 C9 H25 97.7296(20) -202_455 . -203_555 N C12 C9 H22 125.1258(4) -203_555 . -201_565 N C12 C9 H22 126.3561(14) -203_555 . -202_455 N C12 C9 H23 128.31149(10) -203_555 . -202_455 N C12 C9 H24 27.9283(4) -203_555 . -201_565 N C12 C9 H24 62.8977(16) -203_555 . -203_555 N C12 C9 H25 46.4378(10) -203_555 . -203_555 N H22 C9 H22 107.5694(18) -201_565 . -202_455 N H22 C9 H23 63.2588(4) -201_565 . -202_455 N H22 C9 H24 129.8968(4) -201_565 . -201_565 N H22 C9 H24 72.6012(16) -201_565 . -203_555 N H22 C9 H25 151.2997 -201_565 . -203_555 N H22 C9 H23 81.8374(9) -202_455 . -202_455 N H22 C9 H24 108.6034(15) -202_455 . -201_565 N H22 C9 H24 155.3240(5) -202_455 . -203_555 N H22 C9 H25 91.1908(20) -202_455 . -203_555 N H23 C9 H24 155.12860(30) -202_455 . -201_565 N H23 C9 H24 76.3413(14) -202_455 . -203_555 N H23 C9 H25 99.5026(8) -202_455 . -203_555 N H24 C9 H24 87.6047(19) -201_565 . -203_555 N H24 C9 H25 58.7847(11) -201_565 . -203_555 N H24 C9 H25 81.3001(17) -203_555 . -203_555 N C9 C10 C9 43.4419(12) 1_555 . 3_565 N C9 C10 C9 151.0116(9) 1_555 . -202_455 N C9 C10 C10 65.1437(8) 1_555 . 2_665 N C9 C10 C10 85.51660(10) 1_555 . 3_565 N C9 C10 C10 83.4669(9) 1_555 . -201_565 N C9 C10 C10 117.5984(5) 1_555 . -202_455 N C9 C10 C10 84.8416(15) 1_555 . -203_555 N C9 C10 H19 19.7972(6) 1_555 . 3_565 N C9 C10 H20 109.5654(4) 1_555 . 1_555 N C9 C10 H21 109.14600(20) 1_555 . 1_555 N C9 C10 H21 72.2254(10) 1_555 . 2_665 N C9 C10 H21 144.7832(5) 1_555 . -203_555 N C9 C10 C11 114.2124(18) 1_555 . 1_555 N C9 C10 C11 147.5978(9) 1_555 . 3_565 N C9 C10 C11 60.6346(9) 1_555 . -201_565 N C9 C10 C11 21.4421(6) 1_555 . -202_455 N C9 C10 C11 38.28110(10) 1_555 . -203_555 N C9 C10 H22 150.8685(9) 1_555 . 3_565 N C9 C10 H22 70.1229(16) 1_555 . -201_565 N C9 C10 H22 32.75760(20) 1_555 . -202_455 N C9 C10 H23 68.2031(14) 1_555 . -202_455 N C9 C10 C9 139.1252(12) 3_565 . -202_455 N C9 C10 C10 81.82730(20) 3_565 . 2_665 N C9 C10 C10 57.9348(9) 3_565 . 3_565 N C9 C10 C10 77.0630(10) 3_565 . -201_565 N C9 C10 C10 78.7107(16) 3_565 . -202_455 N C9 C10 C10 115.6377(6) 3_565 . -203_555 N C9 C10 H19 40.4689(12) 3_565 . 3_565 N C9 C10 H20 114.2731(5) 3_565 . 1_555 N C9 C10 H21 66.3906(10) 3_565 . 1_555 N C9 C10 H21 111.31280(20) 3_565 . 2_665 N C9 C10 H21 141.3648(6) 3_565 . -203_555 N C9 C10 C11 135.8142(11) 3_565 . 1_555 N C9 C10 C11 114.0512(19) 3_565 . 3_565 N C9 C10 C11 27.9046 3_565 . -201_565 N C9 C10 C11 38.6151(11) 3_565 . -202_455 N C9 C10 C11 56.7756(7) 3_565 . -203_555 N C9 C10 H22 162.4442(4) 3_565 . 3_565 N C9 C10 H22 28.9716(4) 3_565 . -201_565 N C9 C10 H22 74.0769(14) 3_565 . -202_455 N C9 C10 H23 83.3887(18) 3_565 . -202_455 N C9 C10 C10 86.01320(10) -202_455 . 2_665 N C9 C10 C10 82.21940(30) -202_455 . 3_565 N C9 C10 C10 72.34870(10) -202_455 . -201_565 N C9 C10 C10 62.3537(5) -202_455 . -202_455 N C9 C10 C10 69.0502(7) -202_455 . -203_555 N C9 C10 H19 170.77879(30) -202_455 . 3_565 N C9 C10 H20 94.30180(30) -202_455 . 1_555 N C9 C10 H21 78.3812 -202_455 . 1_555 N C9 C10 H21 85.65450(30) -202_455 . 2_665 N C9 C10 H21 57.7607(12) -202_455 . -203_555 N C9 C10 C11 39.4386(10) -202_455 . 1_555 N C9 C10 C11 27.5287(7) -202_455 . 3_565 N C9 C10 C11 112.1789(12) -202_455 . -201_565 N C9 C10 C11 172.30859(30) -202_455 . -202_455 N C9 C10 C11 113.6804(10) -202_455 . -203_555 N C9 C10 H22 24.2180(8) -202_455 . 3_565 N C9 C10 H22 124.0168(12) -202_455 . -201_565 N C9 C10 H22 123.0219(9) -202_455 . -202_455 N C9 C10 H23 133.7932(7) -202_455 . -202_455 N C10 C10 C10 60.0 2_665 . 3_565 N C10 C10 C10 31.73910(10) 2_665 . -201_565 N C10 C10 C10 90.0 2_665 . -202_455 N C10 C10 C10 36.0664(4) 2_665 . -203_555 N C10 C10 H19 84.89090(20) 2_665 . 3_565 N C10 C10 H20 151.6325 2_665 . 1_555 N C10 C10 H21 101.9353 2_665 . 1_555 N C10 C10 H21 45.2121 2_665 . 2_665 N C10 C10 H21 136.3298(8) 2_665 . -203_555 N C10 C10 C11 55.5152(9) 2_665 . 1_555 N C10 C10 C11 92.07320(10) 2_665 . 3_565 N C10 C10 C11 67.29720(20) 2_665 . -201_565 N C10 C10 C11 86.31490(10) 2_665 . -202_455 N C10 C10 C11 28.4262(9) 2_665 . -203_555 N C10 C10 H22 97.39280(20) 2_665 . 3_565 N C10 C10 H22 105.66860(20) 2_665 . -201_565 N C10 C10 H22 47.7561(5) 2_665 . -202_455 N C10 C10 H23 125.4303(5) 2_665 . -202_455 N C10 C10 C10 31.73910(10) 3_565 . -201_565 N C10 C10 C10 36.0664(4) 3_565 . -202_455 N C10 C10 C10 90.0 3_565 . -203_555 N C10 C10 H19 94.50640(20) 3_565 . 3_565 N C10 C10 H20 148.1958 3_565 . 1_555 N C10 C10 H21 42.3429 3_565 . 1_555 N C10 C10 H21 104.7774 3_565 . 2_665 N C10 C10 H21 128.1668(6) 3_565 . -203_555 N C10 C10 C11 87.9483 3_565 . 1_555 N C10 C10 C11 62.5923(7) 3_565 . 3_565 N C10 C10 C11 30.1292(9) 3_565 . -201_565 N C10 C10 C11 93.45730(10) 3_565 . -202_455 N C10 C10 C11 61.00410(30) 3_565 . -203_555 N C10 C10 H22 106.4259(6) 3_565 . 3_565 N C10 C10 H22 60.3427(5) 3_565 . -201_565 N C10 C10 H22 96.00920(10) 3_565 . -202_455 N C10 C10 H23 140.7657(9) 3_565 . -202_455 N C10 C10 C10 58.26100(10) -201_565 . -202_455 N C10 C10 C10 58.26100(10) -201_565 . -203_555 N C10 C10 H19 100.3796(4) -201_565 . 3_565 N C10 C10 H20 166.6268(5) -201_565 . 1_555 N C10 C10 H21 71.25320(10) -201_565 . 1_555 N C10 C10 H21 74.01200(10) -201_565 . 2_665 N C10 C10 H21 129.9922(14) -201_565 . -203_555 N C10 C10 C11 60.8377 -201_565 . 1_555 N C10 C10 C11 66.56590(10) -201_565 . 3_565 N C10 C10 C11 52.0501(10) -201_565 . -201_565 N C10 C10 C11 100.6650(4) -201_565 . -202_455 N C10 C10 C11 46.8339(10) -201_565 . -203_555 N C10 C10 H22 92.9931(9) -201_565 . 3_565 N C10 C10 H22 89.5243(5) -201_565 . -201_565 N C10 C10 H22 77.2713(6) -201_565 . -202_455 N C10 C10 H23 151.5976(5) -201_565 . -202_455 N C10 C10 C10 107.8673(7) -202_455 . -203_555 N C10 C10 H19 119.1084(4) -202_455 . 3_565 N C10 C10 H20 115.26900(20) -202_455 . 1_555 N C10 C10 H21 19.0420(4) -202_455 . 1_555 N C10 C10 H21 127.9759(4) -202_455 . 2_665 N C10 C10 H21 92.9997(10) -202_455 . -203_555 N C10 C10 C11 89.3716(11) -202_455 . 1_555 N C10 C10 C11 35.46370(30) -202_455 . 3_565 N C10 C10 C11 56.9700(14) -202_455 . -201_565 N C10 C10 C11 117.1106(5) -202_455 . -202_455 N C10 C10 C11 96.9659(6) -202_455 . -203_555 N C10 C10 H22 83.7563(12) -202_455 . 3_565 N C10 C10 H22 63.1022(16) -202_455 . -201_565 N C10 C10 H22 131.91451(30) -202_455 . -202_455 N C10 C10 H23 137.30119(20) -202_455 . -202_455 N C10 C10 H19 102.4431(10) -203_555 . 3_565 N C10 C10 H20 118.39010(20) -203_555 . 1_555 N C10 C10 H21 125.7313(4) -203_555 . 1_555 N C10 C10 H21 20.61850(30) -203_555 . 2_665 N C10 C10 H21 102.8668(12) -203_555 . -203_555 N C10 C10 C11 29.72350(30) -203_555 . 1_555 N C10 C10 C11 89.3232(12) -203_555 . 3_565 N C10 C10 C11 103.2510(6) -203_555 . -201_565 N C10 C10 C11 104.7326(9) -203_555 . -202_455 N C10 C10 C11 58.8823(13) -203_555 . -203_555 N C10 C10 H22 69.0291(7) -203_555 . 3_565 N C10 C10 H22 141.64360(10) -203_555 . -201_565 N C10 C10 H22 53.9781(16) -203_555 . -202_455 N C10 C10 H23 114.8292(5) -203_555 . -202_455 N H19 C10 H20 92.98270(10) 3_565 . 1_555 N H19 C10 H21 105.00690(10) 3_565 . 1_555 N H19 C10 H21 86.8648(6) 3_565 . 2_665 N H19 C10 H21 129.5972(10) 3_565 . -203_555 N H19 C10 C11 132.1653(13) 3_565 . 1_555 N H19 C10 C11 154.5188(7) 3_565 . 3_565 N H19 C10 C11 65.4121(11) 3_565 . -201_565 N H19 C10 C11 2.50280(10) 3_565 . -202_455 N H19 C10 C11 57.4933(7) 3_565 . -203_555 N H19 C10 H22 157.0863(8) 3_565 . 3_565 N H19 C10 H22 60.3568(14) 3_565 . -201_565 N H19 C10 H22 48.5383(6) 3_565 . -202_455 N H19 C10 H23 52.2861(9) 3_565 . -202_455 N H20 C10 H21 105.9135 1_555 . 1_555 N H20 C10 H21 106.4656 1_555 . 2_665 N H20 C10 H21 36.6350(9) 1_555 . -203_555 N H20 C10 C11 109.3250(6) 1_555 . 1_555 N H20 C10 C11 101.2468(4) 1_555 . 3_565 N H20 C10 C11 136.6822(4) 1_555 . -201_565 N H20 C10 C11 92.70830(10) 1_555 . -202_455 N H20 C10 C11 144.8945(5) 1_555 . -203_555 N H20 C10 H22 74.1903(4) 1_555 . 3_565 N H20 C10 H22 97.6313 1_555 . -201_565 N H20 C10 H22 111.89820(10) 1_555 . -202_455 N H20 C10 H23 41.3743(10) 1_555 . -202_455 N H21 C10 H21 144.74510(10) 1_555 . 2_665 N H21 C10 H21 94.22210(30) 1_555 . -203_555 N H21 C10 C11 108.3430(8) 1_555 . 1_555 N H21 C10 C11 50.8558(7) 1_555 . 3_565 N H21 C10 C11 51.4465(7) 1_555 . -201_565 N H21 C10 C11 102.711 1_555 . -202_455 N H21 C10 C11 100.39050(10) 1_555 . -203_555 N H21 C10 H22 96.8529(6) 1_555 . 3_565 N H21 C10 H22 45.7353(12) 1_555 . -201_565 N H21 C10 H22 133.62970(30) 1_555 . -202_455 N H21 C10 H23 119.08020(10) 1_555 . -202_455 N H21 C10 H21 103.5252(5) 2_665 . -203_555 N H21 C10 C11 46.8740(7) 2_665 . 1_555 N H21 C10 C11 108.7763(9) 2_665 . 3_565 N H21 C10 C11 109.06980(10) 2_665 . -201_565 N H21 C10 C11 89.3288(5) 2_665 . -202_455 N H21 C10 C11 57.9014(6) 2_665 . -203_555 N H21 C10 H22 78.98710(10) 2_665 . 3_565 N H21 C10 H22 140.2840(6) 2_665 . -201_565 N H21 C10 H22 39.4803(11) 2_665 . -202_455 N H21 C10 H23 94.62390(20) 2_665 . -202_455 N H21 C10 C11 80.9458(17) -203_555 . 1_555 N H21 C10 C11 67.5276(14) -203_555 . 3_565 N H21 C10 C11 145.0983(4) -203_555 . -201_565 N H21 C10 C11 129.3396(10) -203_555 . -202_455 N H21 C10 C11 161.21040(10) -203_555 . -203_555 N H21 C10 H22 39.9988(6) -203_555 . 3_565 N H21 C10 H22 114.4264(11) -203_555 . -201_565 N H21 C10 H22 132.1429(6) -203_555 . -202_455 N H21 C10 H23 77.5545(19) -203_555 . -202_455 N C11 C10 C11 62.2436(16) 1_555 . 3_565 N C11 C10 C11 112.8877(10) 1_555 . -201_565 N C11 C10 C11 134.4543(12) 1_555 . -202_455 N C11 C10 C11 83.2696(17) 1_555 . -203_555 N C11 C10 H22 42.2036(11) 1_555 . 3_565 N C11 C10 H22 148.0458(5) 1_555 . -201_565 N C11 C10 H22 83.6633(19) 1_555 . -202_455 N C11 C10 H23 128.7776(9) 1_555 . -202_455 N C11 C10 C11 90.0561(17) 3_565 . -201_565 N C11 C10 C11 152.5712(7) 3_565 . -202_455 N C11 C10 C11 113.3998(10) 3_565 . -203_555 N C11 C10 H22 48.3930(15) 3_565 . 3_565 N C11 C10 H22 96.5414(19) 3_565 . -201_565 N C11 C10 H22 138.8638(5) 3_565 . -202_455 N C11 C10 H23 141.3860(6) 3_565 . -202_455 N C11 C10 C11 64.0765(10) -201_565 . -202_455 N C11 C10 C11 51.9819(5) -201_565 . -203_555 N C11 C10 H22 136.38620(30) -201_565 . 3_565 N C11 C10 H22 39.2005(4) -201_565 . -201_565 N C11 C10 H22 82.3693(10) -201_565 . -202_455 N C11 C10 H23 111.2507(18) -201_565 . -202_455 N C11 C10 C11 58.6367(8) -202_455 . -203_555 N C11 C10 H22 158.8989(7) -202_455 . 3_565 N C11 C10 H22 57.9230(13) -202_455 . -201_565 N C11 C10 H22 50.8859(7) -202_455 . -202_455 N C11 C10 H23 52.4071(9) -202_455 . -202_455 N C11 C10 H22 125.4565(6) -203_555 . 3_565 N C11 C10 H22 84.3261(11) -203_555 . -201_565 N C11 C10 H22 35.00510(30) -203_555 . -202_455 N C11 C10 H23 104.9938(15) -203_555 . -202_455 N H22 C10 H22 138.9238(7) 3_565 . -201_565 N H22 C10 H22 118.2698(11) 3_565 . -202_455 N H22 C10 H23 110.6206(15) 3_565 . -202_455 N H22 C10 H22 102.2762(17) -201_565 . -202_455 N H22 C10 H23 82.9261(14) -201_565 . -202_455 N H22 C10 H23 77.6742(11) -202_455 . -202_455 N C1 H1 C20 46.2657(15) 1_555 . 1_555 N C1 H1 H40 111.6229(7) 1_555 . 1_555 N C20 H1 H40 65.3572(8) 1_555 . 1_555 N C1 H2 C20 45.3439(15) 1_555 . 1_555 N C1 H2 H41 108.6253(6) 1_555 . 1_555 N C20 H2 H41 63.2814(8) 1_555 . 1_555 N C2 H4 C4 41.9561(6) 1_555 . 3_565 N C2 H4 N2 38.03420(30) 1_555 . 3_565 N C2 H4 H6 63.0641(11) 1_555 . 2_665 N C2 H4 H9 87.3540(17) 1_555 . 3_565 N C2 H4 C15 51.1726(8) 1_555 . -203_555 N C2 H4 C17 40.88570(10) 1_555 . -202_455 N C2 H4 C18 24.12090(10) 1_555 . -201_565 N C2 H4 C19 51.0448(14) 1_555 . -201_565 N C2 H4 N5 68.4890(10) 1_555 . -203_555 N C2 H4 H30 104.0832(18) 1_555 . -203_555 N C2 H4 H31 65.72860(30) 1_555 . -203_555 N C2 H4 H34 90.4875(7) 1_555 . -202_455 N C2 H4 H38 122.3416(10) 1_555 . -201_565 N C4 H4 N2 71.6449(9) 3_565 . 3_565 N C4 H4 H6 21.8718(5) 3_565 . 2_665 N C4 H4 H9 46.5149(12) 3_565 . 3_565 N C4 H4 C15 9.41200(20) 3_565 . -203_555 N C4 H4 C17 46.4681(4) 3_565 . -202_455 N C4 H4 C18 18.2173(4) 3_565 . -201_565 N C4 H4 C19 92.0173(8) 3_565 . -201_565 N C4 H4 N5 109.2113(4) 3_565 . -203_555 N C4 H4 H30 63.3824(13) 3_565 . -203_555 N C4 H4 H31 47.0905(4) 3_565 . -203_555 N C4 H4 H34 79.1028(14) 3_565 . -202_455 N C4 H4 H38 164.2714(4) 3_565 . -201_565 N N2 H4 H6 93.1106(14) 3_565 . 2_665 N N2 H4 H9 105.3855(18) 3_565 . 3_565 N N2 H4 C15 80.6809(11) 3_565 . -203_555 N N2 H4 C17 76.82590(30) 3_565 . -202_455 N N2 H4 C18 54.7005(5) 3_565 . -201_565 N N2 H4 C19 44.9384(10) 3_565 . -201_565 N N2 H4 N5 40.2933(13) 3_565 . -203_555 N N2 H4 H30 117.5966(17) 3_565 . -203_555 N N2 H4 H31 103.7139(5) 3_565 . -203_555 N N2 H4 H34 124.68330(20) 3_565 . -202_455 N N2 H4 H38 94.0691(13) 3_565 . -201_565 N H6 H4 H9 30.4056(7) 2_665 . 3_565 N H6 H4 C15 12.52450(30) 2_665 . -203_555 N H6 H4 C17 54.46590(10) 2_665 . -202_455 N H6 H4 C18 39.9733(9) 2_665 . -201_565 N H6 H4 C19 110.94990(30) 2_665 . -201_565 N H6 H4 N5 131.03720(10) 2_665 . -203_555 N H6 H4 H30 45.9906(8) 2_665 . -203_555 N H6 H4 H31 40.1649(4) 2_665 . -203_555 N H6 H4 H34 68.6878(16) 2_665 . -202_455 N H6 H4 H38 172.40829(10) 2_665 . -201_565 N H9 H4 C15 38.4901(9) 3_565 . -203_555 N H9 H4 C17 84.6950(6) 3_565 . -202_455 N H9 H4 C18 63.3215(16) 3_565 . -201_565 N H9 H4 C19 138.3071(4) 3_565 . -201_565 N H9 H4 N5 144.6230(5) 3_565 . -203_555 N H9 H4 H30 16.88670(10) 3_565 . -203_555 N H9 H4 H31 65.07000(20) 3_565 . -203_555 N H9 H4 H34 84.7940(11) 3_565 . -202_455 N H9 H4 H38 147.9057(8) 3_565 . -201_565 N C15 H4 C17 49.92640(30) -203_555 . -202_455 N C15 H4 C18 27.6180(7) -203_555 . -201_565 N C15 H4 C19 100.5978(6) -203_555 . -201_565 N C15 H4 N5 118.61850(20) -203_555 . -203_555 N C15 H4 H30 55.1712(10) -203_555 . -203_555 N C15 H4 H31 43.9311(5) -203_555 . -203_555 N C15 H4 H34 75.1446(15) -203_555 . -202_455 N C15 H4 H38 173.40990(20) -203_555 . -201_565 N C17 H4 C18 42.6632(4) -202_455 . -201_565 N C17 H4 C19 62.7995(4) -202_455 . -201_565 N C17 H4 N5 92.33240(30) -202_455 . -203_555 N C17 H4 H30 98.8431(7) -202_455 . -203_555 N C17 H4 H31 29.87180(10) -202_455 . -203_555 N C17 H4 H34 49.6020(6) -202_455 . -202_455 N C17 H4 H38 125.12890(10) -202_455 . -201_565 N C18 H4 C19 74.9954(12) -201_565 . -201_565 N C18 H4 N5 91.0639(9) -201_565 . -203_555 N C18 H4 H30 80.1356(17) -201_565 . -203_555 N C18 H4 H31 55.4777 -201_565 . -203_555 N C18 H4 H34 86.3992(11) -201_565 . -202_455 N C18 H4 H38 146.0938(9) -201_565 . -201_565 N C19 H4 N5 30.60330(10) -201_565 . -203_555 N C19 H4 H30 155.1208(4) -201_565 . -203_555 N C19 H4 H31 91.21580(20) -201_565 . -203_555 N C19 H4 H34 92.04430(30) -201_565 . -202_455 N C19 H4 H38 72.8217(4) -201_565 . -201_565 N N5 H4 H30 151.69521(30) -203_555 . -203_555 N N5 H4 H31 121.56820(10) -203_555 . -203_555 N N5 H4 H34 119.4292(6) -203_555 . -202_455 N N5 H4 H38 55.3703 -203_555 . -201_565 N H30 H4 H31 75.0252(4) -203_555 . -203_555 N H30 H4 H34 87.0552(8) -203_555 . -202_455 N H30 H4 H38 131.3257(9) -203_555 . -201_565 N H31 H4 H34 32.0554(10) -203_555 . -202_455 N H31 H4 H38 134.9602(4) -203_555 . -201_565 N H34 H4 H38 105.0245(15) -202_455 . -201_565 N C2 H5 C3 49.01930(10) 1_555 . 2_665 N C2 H5 C4 36.92460(10) 1_555 . 3_565 N C2 H5 N2 44.27840(10) 1_555 . 2_665 N C2 H5 H7 95.5096(15) 1_555 . 2_665 N C2 H5 H8 83.1461(4) 1_555 . 3_565 N C2 H5 C15 34.62680(20) 1_555 . -203_555 N C2 H5 C17 57.95260(20) 1_555 . -202_455 N C2 H5 C18 33.52010(20) 1_555 . -201_565 N C2 H5 C19 43.1850(13) 1_555 . -201_565 N C2 H5 N5 73.6894(8) 1_555 . -202_455 N C2 H5 H31 80.33190(10) 1_555 . -203_555 N C2 H5 H34 74.6423(7) 1_555 . -202_455 N C2 H5 H35 134.7838(7) 1_555 . -202_455 N C2 H5 H37 84.7634(12) 1_555 . -201_565 N C2 H5 H38 107.2036(6) 1_555 . -203_555 N C2 H5 H39 93.9645(13) 1_555 . -201_565 N C3 H5 C4 28.03990(30) 2_665 . 3_565 N C3 H5 N2 72.2643(4) 2_665 . 2_665 N C3 H5 H7 46.5017(14) 2_665 . 2_665 N C3 H5 H8 60.46350(30) 2_665 . 3_565 N C3 H5 C15 46.32010(10) 2_665 . -203_555 N C3 H5 C17 55.03570(10) 2_665 . -202_455 N C3 H5 C18 15.50780(30) 2_665 . -201_565 N C3 H5 C19 92.1813(12) 2_665 . -201_565 N C3 H5 N5 111.6266(8) 2_665 . -202_455 N C3 H5 H31 68.00010(20) 2_665 . -203_555 N C3 H5 H34 90.7621(14) 2_665 . -202_455 N C3 H5 H35 90.9791(6) 2_665 . -202_455 N C3 H5 H37 36.2158(11) 2_665 . -201_565 N C3 H5 H38 138.3263(6) 2_665 . -203_555 N C3 H5 H39 142.4367(12) 2_665 . -201_565 N C4 H5 N2 77.0267(4) 3_565 . 2_665 N C4 H5 H7 66.2454(14) 3_565 . 2_665 N C4 H5 H8 48.64650(20) 3_565 . 3_565 N C4 H5 C15 18.44800(30) 3_565 . -203_555 N C4 H5 C17 30.91980(30) 3_565 . -202_455 N C4 H5 C18 21.34620(20) 3_565 . -201_565 N C4 H5 C19 74.4411(12) 3_565 . -201_565 N C4 H5 N5 110.5809(6) 3_565 . -202_455 N C4 H5 H31 50.21910(30) 3_565 . -203_555 N C4 H5 H34 64.0672(16) 3_565 . -202_455 N C4 H5 H35 97.9172(5) 3_565 . -202_455 N C4 H5 H37 54.2571(11) 3_565 . -201_565 N C4 H5 H38 144.0894(5) 3_565 . -203_555 N C4 H5 H39 118.6680(13) 3_565 . -201_565 N N2 H5 H7 107.4002(14) 2_665 . 2_665 N N2 H5 H8 125.6585(6) 2_665 . 3_565 N N2 H5 C15 78.88530(30) 2_665 . -203_555 N N2 H5 C17 102.20150(30) 2_665 . -202_455 N N2 H5 C18 61.88730(10) 2_665 . -201_565 N N2 H5 C19 49.1919(8) 2_665 . -201_565 N N2 H5 N5 39.4237(11) 2_665 . -202_455 N N2 H5 H31 124.56160(30) 2_665 . -203_555 N N2 H5 H34 111.97760(20) 2_665 . -202_455 N N2 H5 H35 153.5575(7) 2_665 . -202_455 N N2 H5 H37 103.0355(13) 2_665 . -201_565 N N2 H5 H38 69.2167(10) 2_665 . -203_555 N N2 H5 H39 85.1299(11) 2_665 . -201_565 N H7 H5 H8 56.53970(20) 2_665 . 3_565 N H7 H5 C15 82.5074(10) 2_665 . -203_555 N H7 H5 C17 74.8568(5) 2_665 . -202_455 N H7 H5 C18 61.9901(17) 2_665 . -201_565 N H7 H5 C19 138.59190(10) 2_665 . -201_565 N H7 H5 N5 140.1481 2_665 . -202_455 N H7 H5 H31 69.48400(10) 2_665 . -203_555 N H7 H5 H34 104.7003(9) 2_665 . -202_455 N H7 H5 H35 48.5618(6) 2_665 . -202_455 N H7 H5 H37 12.01440(30) 2_665 . -201_565 N H7 H5 H38 135.4400(7) 2_665 . -203_555 N H7 H5 H39 167.45810(30) 2_665 . -201_565 N H8 H5 C15 49.61350(20) 3_565 . -203_555 N H8 H5 C17 27.95570(10) 3_565 . -202_455 N H8 H5 C18 65.8490(5) 3_565 . -201_565 N H8 H5 C19 105.44660(30) 3_565 . -201_565 N H8 H5 N5 151.87160(10) 3_565 . -202_455 N H8 H5 H31 12.95240(30) 3_565 . -203_555 N H8 H5 H34 48.2192(11) 3_565 . -202_455 N H8 H5 H35 55.47030(10) 3_565 . -202_455 N H8 H5 H37 49.6324 3_565 . -201_565 N H8 H5 H38 160.8735(4) 3_565 . -203_555 N H8 H5 H39 116.7435(4) 3_565 . -201_565 N C15 H5 C17 23.3259 -203_555 . -202_455 N C15 H5 C18 36.82020(20) -203_555 . -201_565 N C15 H5 C19 61.4732(8) -203_555 . -201_565 N C15 H5 N5 104.2040(4) -203_555 . -202_455 N C15 H5 H31 45.7054 -203_555 . -203_555 N C15 H5 H34 48.3896(12) -203_555 . -202_455 N C15 H5 H35 104.56000(30) -203_555 . -202_455 N C15 H5 H37 70.5510(7) -203_555 . -201_565 N C15 H5 H38 135.72560(20) -203_555 . -203_555 N C15 H5 H39 100.9084(10) -203_555 . -201_565 N C17 H5 C18 52.18840(10) -202_455 . -201_565 N C17 H5 C19 78.2050(5) -202_455 . -201_565 N C17 H5 N5 124.16850(20) -202_455 . -202_455 N C17 H5 H31 22.3802 -202_455 . -203_555 N C17 H5 H34 36.2813(12) -202_455 . -202_455 N C17 H5 H35 83.35050(10) -202_455 . -202_455 N C17 H5 H37 64.34800(20) -202_455 . -201_565 N C17 H5 H38 149.52499(30) -202_455 . -203_555 N C17 H5 H39 103.5276(5) -202_455 . -201_565 N C18 H5 C19 76.6735(16) -201_565 . -201_565 N C18 H5 N5 100.0721(10) -201_565 . -202_455 N C18 H5 H31 70.0933 -201_565 . -203_555 N C18 H5 H34 84.7702(14) -201_565 . -202_455 N C18 H5 H35 105.0024(9) -201_565 . -202_455 N C18 H5 H37 51.4435(14) -201_565 . -201_565 N C18 H5 H38 130.9748(8) -201_565 . -203_555 N C18 H5 H39 127.1081(15) -201_565 . -201_565 N C19 H5 N5 46.47110(20) -201_565 . -202_455 N C19 H5 H31 95.29360(20) -201_565 . -203_555 N C19 H5 H34 67.1940(4) -201_565 . -202_455 N C19 H5 H35 154.95151(10) -201_565 . -202_455 N C19 H5 H37 127.37300(20) -201_565 . -201_565 N C19 H5 H38 74.4130(6) -201_565 . -203_555 N C19 H5 H39 50.96000(10) -201_565 . -201_565 N N5 H5 H31 141.36290(10) -202_455 . -203_555 N N5 H5 H34 108.8182(8) -202_455 . -202_455 N N5 H5 H35 151.01930(10) -202_455 . -202_455 N N5 H5 H37 140.24339(10) -202_455 . -201_565 N N5 H5 H38 33.51600(10) -202_455 . -203_555 N N5 H5 H39 51.03820(20) -202_455 . -201_565 N H31 H5 H34 35.2698(8) -203_555 . -202_455 N H31 H5 H35 63.08530(10) -203_555 . -202_455 N H31 H5 H37 62.23430(30) -203_555 . -201_565 N H31 H5 H38 150.6086(7) -203_555 . -203_555 N H31 H5 H39 104.16320(10) -203_555 . -201_565 N H34 H5 H35 87.92880(30) -202_455 . -202_455 N H34 H5 H37 96.6496(11) -202_455 . -201_565 N H34 H5 H38 117.9269(16) -202_455 . -203_555 N H34 H5 H39 70.0070(8) -202_455 . -201_565 N H35 H5 H37 55.7096(4) -202_455 . -201_565 N H35 H5 H38 117.7669 -202_455 . -203_555 N H35 H5 H39 119.06810(30) -202_455 . -201_565 N H37 H5 H38 145.1732(4) -201_565 . -203_555 N H37 H5 H39 166.3758(4) -201_565 . -201_565 N H38 H5 H39 47.9412(8) -203_555 . -201_565 N C2 H6 C3 49.9677(10) 3_565 . 1_555 N C2 H6 C4 28.2331(9) 3_565 . 2_665 N C2 H6 C5 78.0932(16) 3_565 . 3_565 N C2 H6 H4 49.19090(10) 3_565 . 3_565 N C2 H6 H8 70.2768(5) 3_565 . 2_665 N C2 H6 H9 118.2696 3_565 . 2_665 N C2 H6 H10 115.3323(5) 3_565 . 3_565 N C2 H6 C14 70.9194(17) 3_565 . -202_455 N C2 H6 C15 30.2394 3_565 . -202_455 N C2 H6 C16 72.6481(16) 3_565 . -201_565 N C2 H6 C17 42.64000(20) 3_565 . -201_565 N C2 H6 C18 34.5607(10) 3_565 . -203_555 N C2 H6 H30 109.3960(5) 3_565 . -202_455 N C2 H6 H31 78.6720(7) 3_565 . -202_455 N C2 H6 H33 115.9837(5) 3_565 . -201_565 N C2 H6 H34 71.0772(7) 3_565 . -201_565 N C2 H6 H36 96.0628(9) 3_565 . -203_555 N C2 H6 H37 67.53590(30) 3_565 . -203_555 N C3 H6 C4 27.94430(10) 1_555 . 2_665 N C3 H6 C5 44.9184 1_555 . 3_565 N C3 H6 H4 99.1521(9) 1_555 . 3_565 N C3 H6 H8 67.0667(11) 1_555 . 2_665 N C3 H6 H9 141.1367(5) 1_555 . 2_665 N C3 H6 H10 92.8578(13) 1_555 . 3_565 N C3 H6 C14 39.21070(10) 1_555 . -202_455 N C3 H6 C15 79.8257(10) 1_555 . -202_455 N C3 H6 C16 35.60260(20) 1_555 . -201_565 N C3 H6 C17 56.1047(16) 1_555 . -201_565 N C3 H6 C18 19.1426 1_555 . -203_555 N C3 H6 H30 148.80240(10) 1_555 . -202_455 N C3 H6 H31 84.4278(11) 1_555 . -202_455 N C3 H6 H33 99.7724(14) 1_555 . -201_565 N C3 H6 H34 104.3818(9) 1_555 . -201_565 N C3 H6 H36 84.8509(10) 1_555 . -203_555 N C3 H6 H37 33.41080(10) 1_555 . -203_555 N C4 H6 C5 50.4712(6) 2_665 . 3_565 N C4 H6 H4 74.9672(8) 2_665 . 3_565 N C4 H6 H8 79.5863(4) 2_665 . 2_665 N C4 H6 H9 121.97340(10) 2_665 . 2_665 N C4 H6 H10 93.3852(6) 2_665 . 3_565 N C4 H6 C14 43.2228(7) 2_665 . -202_455 N C4 H6 C15 54.7177(10) 2_665 . -202_455 N C4 H6 C16 44.4576(7) 2_665 . -201_565 N C4 H6 C17 57.2935(8) 2_665 . -201_565 N C4 H6 C18 8.81830(10) 2_665 . -203_555 N C4 H6 H30 122.68110(10) 2_665 . -202_455 N C4 H6 H31 93.87950(30) 2_665 . -202_455 N C4 H6 H33 96.9989(6) 2_665 . -201_565 N C4 H6 H34 97.44810(30) 2_665 . -201_565 N C4 H6 H36 77.55770(20) 2_665 . -203_555 N C4 H6 H37 57.5042 2_665 . -203_555 N C5 H6 H4 116.3049(17) 3_565 . 3_565 N C5 H6 H8 109.4941(11) 3_565 . 2_665 N C5 H6 H9 99.8092(6) 3_565 . 2_665 N C5 H6 H10 48.0544(14) 3_565 . 3_565 N C5 H6 C14 7.25190(10) 3_565 . -202_455 N C5 H6 C15 97.8071(18) 3_565 . -202_455 N C5 H6 C16 9.49240(20) 3_565 . -201_565 N C5 H6 C17 100.6085(16) 3_565 . -201_565 N C5 H6 C18 46.9875(4) 3_565 . -203_555 N C5 H6 H30 115.29570(20) 3_565 . -202_455 N C5 H6 H31 127.0242(11) 3_565 . -202_455 N C5 H6 H33 54.8730(14) 3_565 . -201_565 N C5 H6 H34 147.2999(10) 3_565 . -201_565 N C5 H6 H36 42.0461(10) 3_565 . -203_555 N C5 H6 H37 70.37050(10) 3_565 . -203_555 N H4 H6 H8 86.3569(15) 3_565 . 2_665 N H4 H6 H9 81.3935(5) 3_565 . 2_665 N H4 H6 H10 120.9998(16) 3_565 . 3_565 N H4 H6 C14 110.6770(17) 3_565 . -202_455 N H4 H6 C15 20.30320(20) 3_565 . -202_455 N H4 H6 C16 115.2480(16) 3_565 . -201_565 N H4 H6 C17 65.9738(11) 3_565 . -201_565 N H4 H6 C18 82.7864(9) 3_565 . -203_555 N H4 H6 H30 65.74300(20) 3_565 . -202_455 N H4 H6 H31 80.1068(18) 3_565 . -202_455 N H4 H6 H33 114.2203(16) 3_565 . -201_565 N H4 H6 H34 47.5870(13) 3_565 . -201_565 N H4 H6 H36 103.8454(19) 3_565 . -203_555 N H4 H6 H37 108.9519 3_565 . -203_555 N H8 H6 H9 150.6829(6) 2_665 . 2_665 N H8 H6 H10 149.2151 2_665 . 3_565 N H8 H6 C14 105.2947(12) 2_665 . -202_455 N H8 H6 C15 84.5223(11) 2_665 . -202_455 N H8 H6 C16 100.1341(13) 2_665 . -201_565 N H8 H6 C17 27.87620(30) 2_665 . -201_565 N H8 H6 C18 75.6979(6) 2_665 . -203_555 N H8 H6 H30 134.1396(13) 2_665 . -202_455 N H8 H6 H31 17.6089 2_665 . -202_455 N H8 H6 H33 157.73840(10) 2_665 . -201_565 N H8 H6 H34 49.7832(5) 2_665 . -201_565 N H8 H6 H36 151.44490(10) 2_665 . -203_555 N H8 H6 H37 39.6074(11) 2_665 . -203_555 N H9 H6 H10 56.2342(7) 2_665 . 3_565 N H9 H6 C14 103.9416(6) 2_665 . -202_455 N H9 H6 C15 92.56660(20) 2_665 . -202_455 N H9 H6 C16 109.1828(7) 2_665 . -201_565 N H9 H6 C17 146.6593(7) 2_665 . -201_565 N H9 H6 C18 128.36430(20) 2_665 . -203_555 N H9 H6 H30 18.7026(7) 2_665 . -202_455 N H9 H6 H31 133.0920(6) 2_665 . -202_455 N H9 H6 H33 47.7390(8) 2_665 . -201_565 N H9 H6 H34 104.11640(20) 2_665 . -201_565 N H9 H6 H36 57.8606(5) 2_665 . -203_555 N H9 H6 H37 167.9622(4) 2_665 . -203_555 N H10 H6 C14 54.3843(14) 3_565 . -202_455 N H10 H6 C15 115.8701(13) 3_565 . -202_455 N H10 H6 C16 57.2599(15) 3_565 . -201_565 N H10 H6 C17 148.58479(30) 3_565 . -201_565 N H10 H6 C18 92.8504(9) 3_565 . -203_555 N H10 H6 H30 74.6259(14) 3_565 . -202_455 N H10 H6 H31 158.84061(30) 3_565 . -202_455 N H10 H6 H33 8.70570(10) 3_565 . -201_565 N H10 H6 H34 160.3228(5) 3_565 . -201_565 N H10 H6 H36 20.4171(4) 3_565 . -203_555 N H10 H6 H37 112.0111(11) 3_565 . -203_555 N C14 H6 C15 91.6008(19) -202_455 . -202_455 N C14 H6 C16 6.81250(20) -202_455 . -201_565 N C14 H6 C17 94.2006(17) -202_455 . -201_565 N C14 H6 C18 39.8398(5) -202_455 . -203_555 N C14 H6 H30 118.08690(20) -202_455 . -202_455 N C14 H6 H31 122.8995(12) -202_455 . -202_455 N C14 H6 H33 60.7235(15) -202_455 . -201_565 N C14 H6 H34 140.1670(11) -202_455 . -201_565 N C14 H6 H36 46.1765(11) -202_455 . -203_555 N C14 H6 H37 67.09000(10) -202_455 . -203_555 N C15 H6 C16 95.5963(18) -202_455 . -201_565 N C15 H6 C17 58.7288(8) -202_455 . -201_565 N C15 H6 C18 62.7009(10) -202_455 . -203_555 N C15 H6 H30 80.3261(5) -202_455 . -202_455 N C15 H6 H31 84.3754(15) -202_455 . -202_455 N C15 H6 H33 111.6508(13) -202_455 . -201_565 N C15 H6 H34 59.4852(12) -202_455 . -201_565 N C15 H6 H36 95.9258(17) -202_455 . -203_555 N C15 H6 H37 95.62660(20) -202_455 . -203_555 N C16 H6 C17 91.5508(18) -201_565 . -201_565 N C16 H6 C18 39.6862(6) -201_565 . -203_555 N C16 H6 H30 124.1664 -201_565 . -202_455 N C16 H6 H31 117.7093(13) -201_565 . -202_455 N C16 H6 H33 64.2790(16) -201_565 . -201_565 N C16 H6 H34 139.1559(11) -201_565 . -201_565 N C16 H6 H36 51.3408(12) -201_565 . -203_555 N C16 H6 H37 61.27760(30) -201_565 . -203_555 N C17 H6 C18 56.3785(11) -201_565 . -203_555 N C17 H6 H30 128.7521(14) -201_565 . -202_455 N C17 H6 H31 37.3353(5) -201_565 . -202_455 N C17 H6 H33 154.01350(20) -201_565 . -201_565 N C17 H6 H34 48.4561(7) -201_565 . -201_565 N C17 H6 H36 134.8422(7) -201_565 . -203_555 N C17 H6 H37 44.9044(11) -201_565 . -203_555 N C18 H6 H30 130.94450(10) -203_555 . -202_455 N C18 H6 H31 91.3189(6) -203_555 . -202_455 N C18 H6 H33 97.6396(9) -203_555 . -201_565 N C18 H6 H34 100.3299(5) -203_555 . -201_565 N C18 H6 H36 79.1898(5) -203_555 . -203_555 N C18 H6 H37 49.7735 -203_555 . -203_555 N H30 H6 H31 117.2003(13) -202_455 . -202_455 N H30 H6 H33 66.0130(15) -202_455 . -201_565 N H30 H6 H34 85.6973(8) -202_455 . -201_565 N H30 H6 H36 73.5397(12) -202_455 . -203_555 N H30 H6 H37 173.31841(20) -202_455 . -203_555 N H31 H6 H33 163.86960(20) -202_455 . -201_565 N H31 H6 H34 36.3345(6) -202_455 . -201_565 N H31 H6 H36 169.04720(10) -202_455 . -203_555 N H31 H6 H37 56.8052(11) -202_455 . -203_555 N H33 H6 H34 151.6862(6) -201_565 . -201_565 N H33 H6 H36 20.0729(4) -201_565 . -203_555 N H33 H6 H37 120.6023(13) -201_565 . -203_555 N H34 H6 H36 150.5929(6) -201_565 . -203_555 N H34 H6 H37 87.6658(6) -201_565 . -203_555 N H36 H6 H37 112.3468(10) -203_555 . -203_555 N C3 H7 C4 21.35550(20) 1_555 . 2_665 N C3 H7 C7 49.7818(10) 1_555 . 2_665 N C3 H7 H5 62.1454(8) 1_555 . 3_565 N C3 H7 H8 62.8661(6) 1_555 . 2_665 N C3 H7 H11 64.3085(7) 1_555 . 3_565 N C3 H7 H14 90.1982 1_555 . 2_665 N C3 H7 C16 21.5090(4) 1_555 . -201_565 N C3 H7 C17 52.6428(10) 1_555 . -201_565 N C3 H7 C18 6.24250(20) 1_555 . -203_555 N C3 H7 H29 63.1368(8) 1_555 . -202_455 N C3 H7 H31 63.7959(5) 1_555 . -202_455 N C3 H7 H32 65.0335(6) 1_555 . -201_565 N C3 H7 H35 103.6186(4) 1_555 . -201_565 N C3 H7 H37 31.2496(8) 1_555 . -203_555 N C4 H7 C7 61.3154(14) 2_665 . 2_665 N C4 H7 H5 58.24630(20) 2_665 . 3_565 N C4 H7 H8 44.1115(4) 2_665 . 2_665 N C4 H7 H11 70.1278(13) 2_665 . 3_565 N C4 H7 H14 100.2208(4) 2_665 . 2_665 N C4 H7 C16 28.0328(9) 2_665 . -201_565 N C4 H7 C17 42.3652(6) 2_665 . -201_565 N C4 H7 C18 19.6459 2_665 . -203_555 N C4 H7 H29 76.2645(11) 2_665 . -202_455 N C4 H7 H31 43.96750(30) 2_665 . -202_455 N C4 H7 H32 69.9728(12) 2_665 . -201_565 N C4 H7 H35 90.0537(8) 2_665 . -201_565 N C4 H7 H37 19.4762(5) 2_665 . -203_555 N C7 H7 H5 111.3634(18) 2_665 . 3_565 N C7 H7 H8 103.5469(19) 2_665 . 2_665 N C7 H7 H11 18.9827(4) 2_665 . 3_565 N C7 H7 H14 40.4914(10) 2_665 . 2_665 N C7 H7 C16 33.2867(4) 2_665 . -201_565 N C7 H7 C17 101.7704(20) 2_665 . -201_565 N C7 H7 C18 56.0204(12) 2_665 . -203_555 N C7 H7 H29 15.09530(20) 2_665 . -202_455 N C7 H7 H31 101.5569(18) 2_665 . -202_455 N C7 H7 H32 20.8802(5) 2_665 . -201_565 N C7 H7 H35 151.3256(6) 2_665 . -201_565 N C7 H7 H37 78.8718(19) 2_665 . -203_555 N H5 H7 H8 42.6158(10) 3_565 . 2_665 N H5 H7 H11 126.2186(15) 3_565 . 3_565 N H5 H7 H14 149.9932(9) 3_565 . 2_665 N H5 H7 C16 82.1138(13) 3_565 . -201_565 N H5 H7 C17 19.6103(5) 3_565 . -201_565 N H5 H7 C18 55.9575(6) 3_565 . -203_555 N H5 H7 H29 122.6356(17) 3_565 . -202_455 N H5 H7 H31 48.0116(10) 3_565 . -202_455 N H5 H7 H32 126.6721(15) 3_565 . -201_565 N H5 H7 H35 46.4790(14) 3_565 . -201_565 N H5 H7 H37 38.94900(30) 3_565 . -203_555 N H8 H7 H11 106.1642(20) 2_665 . 3_565 N H8 H7 H14 136.0193(11) 2_665 . 2_665 N H8 H7 C16 71.2028(14) 2_665 . -201_565 N H8 H7 C17 25.5994(5) 2_665 . -201_565 N H8 H7 C18 58.2383(4) 2_665 . -203_555 N H8 H7 H29 118.5860(16) 2_665 . -202_455 N H8 H7 H31 5.40820(10) 2_665 . -202_455 N H8 H7 H32 105.0070(20) 2_665 . -201_565 N H8 H7 H35 48.2959(13) 2_665 . -201_565 N H8 H7 H37 33.06820(20) 2_665 . -203_555 N H11 H7 H14 30.8443(9) 3_565 . 2_665 N H11 H7 C16 44.17350(20) 3_565 . -201_565 N H11 H7 C17 112.4908(18) 3_565 . -201_565 N H11 H7 C18 70.4082(9) 3_565 . -203_555 N H11 H7 H29 20.7651(6) 3_565 . -202_455 N H11 H7 H31 102.6145(19) 3_565 . -202_455 N H11 H7 H32 2.28160(10) 3_565 . -201_565 N H11 H7 H35 152.0398(8) 3_565 . -201_565 N H11 H7 H37 89.3837(17) 3_565 . -203_555 N H14 H7 C16 72.8374(6) 2_665 . -201_565 N H14 H7 C17 142.0574(10) 2_665 . -201_565 N H14 H7 C18 96.41870(20) 2_665 . -203_555 N H14 H7 H29 27.6287(9) 2_665 . -202_455 N H14 H7 H31 131.7911(11) 2_665 . -202_455 N H14 H7 H32 31.6013(9) 2_665 . -201_565 N H14 H7 H35 163.2758(6) 2_665 . -201_565 N H14 H7 H37 118.8770(9) 2_665 . -203_555 N C16 H7 C17 69.2448(16) -201_565 . -201_565 N C16 H7 C18 27.0534(6) -201_565 . -203_555 N C16 H7 H29 48.24300(20) -201_565 . -202_455 N C16 H7 H31 70.0679(13) -201_565 . -202_455 N C16 H7 H32 44.55850(20) -201_565 . -201_565 N C16 H7 H35 118.08320(20) -201_565 . -201_565 N C16 H7 H37 46.0396(15) -201_565 . -203_555 N C17 H7 C18 46.5780(8) -201_565 . -203_555 N C17 H7 H29 115.7361(18) -201_565 . -202_455 N C17 H7 H31 30.6760(6) -201_565 . -202_455 N C17 H7 H32 112.3182(18) -201_565 . -201_565 N C17 H7 H35 50.9885(15) -201_565 . -201_565 N C17 H7 H37 23.23960(10) -201_565 . -203_555 N C18 H7 H29 69.2782(10) -203_555 . -202_455 N C18 H7 H31 59.63400(30) -203_555 . -202_455 N C18 H7 H32 71.0736(9) -203_555 . -201_565 N C18 H7 H35 97.5656(7) -203_555 . -201_565 N C18 H7 H37 25.8333(6) -203_555 . -203_555 N H29 H7 H31 116.4098(16) -202_455 . -202_455 N H29 H7 H32 23.0175(6) -202_455 . -201_565 N H29 H7 H35 166.3050(4) -202_455 . -201_565 N H29 H7 H37 93.2907(17) -202_455 . -203_555 N H31 H7 H32 101.3184(20) -202_455 . -201_565 N H31 H7 H35 50.9424(12) -202_455 . -201_565 N H31 H7 H37 35.39110(30) -202_455 . -203_555 N H32 H7 H35 150.2216(8) -201_565 . -201_565 N H32 H7 H37 89.3315(17) -201_565 . -203_555 N H35 H7 H37 73.1191(13) -201_565 . -203_555 N C2 H8 C3 46.3536(8) 2_665 . 3_565 N C2 H8 C4 39.9248(5) 2_665 . 1_555 N C2 H8 H5 52.16340(30) 2_665 . 2_665 N C2 H8 H6 62.46740(10) 2_665 . 3_565 N C2 H8 H7 93.13640(30) 2_665 . 3_565 N C2 H8 C15 39.2088 2_665 . -201_565 N C2 H8 C16 54.9235(7) 2_665 . -203_555 N C2 H8 C17 32.8740(5) 2_665 . -203_555 N C2 H8 C18 31.8603(8) 2_665 . -202_455 N C2 H8 H31 101.5465 2_665 . -201_565 N C2 H8 H34 78.3093(5) 2_665 . -203_555 N C2 H8 H35 115.0936 2_665 . -203_555 N C2 H8 H37 80.2326 2_665 . -202_455 N C3 H8 C4 34.6166(4) 3_565 . 1_555 N C3 H8 H5 74.4566(14) 3_565 . 2_665 N C3 H8 H6 57.2911(8) 3_565 . 3_565 N C3 H8 H7 53.9527(12) 3_565 . 3_565 N C3 H8 C15 57.45100(10) 3_565 . -201_565 N C3 H8 C16 20.9142(4) 3_565 . -203_555 N C3 H8 C17 68.2467(16) 3_565 . -203_555 N C3 H8 C18 16.0375 3_565 . -202_455 N C3 H8 H31 125.6046(6) 3_565 . -201_565 N C3 H8 H34 120.3534(14) 3_565 . -203_555 N C3 H8 H35 104.57300(20) 3_565 . -203_555 N C3 H8 H37 41.1217(9) 3_565 . -202_455 N C4 H8 H5 89.6906(7) 1_555 . 2_665 N C4 H8 H6 26.81860(30) 1_555 . 3_565 N C4 H8 H7 86.4678(16) 1_555 . 3_565 N C4 H8 C15 24.4520(5) 1_555 . -201_565 N C4 H8 C16 24.0814 1_555 . -203_555 N C4 H8 C17 72.6403(10) 1_555 . -203_555 N C4 H8 C18 24.22620(30) 1_555 . -202_455 N C4 H8 H31 91.3057(10) 1_555 . -201_565 N C4 H8 H34 90.2941(18) 1_555 . -203_555 N C4 H8 H35 138.72501(20) 1_555 . -203_555 N C4 H8 H37 74.5982(13) 1_555 . -202_455 N H5 H8 H6 114.5009(4) 2_665 . 3_565 N H5 H8 H7 80.8446(12) 2_665 . 3_565 N H5 H8 C15 90.34800(20) 2_665 . -201_565 N H5 H8 C16 93.9074(10) 2_665 . -203_555 N H5 H8 C17 22.11000(10) 2_665 . -203_555 N H5 H8 C18 70.5632(11) 2_665 . -202_455 N H5 H8 H31 124.8532(12) 2_665 . -201_565 N H5 H8 H34 89.5386(10) 2_665 . -203_555 N H5 H8 H35 65.50810(10) 2_665 . -203_555 N H5 H8 H37 75.3117(15) 2_665 . -202_455 N H6 H8 H7 100.0886(18) 3_565 . 3_565 N H6 H8 C15 27.66480(30) 3_565 . -201_565 N H6 H8 C16 38.84910(30) 3_565 . -203_555 N H6 H8 C17 94.7381(6) 3_565 . -203_555 N H6 H8 C18 50.5542(6) 3_565 . -202_455 N H6 H8 H31 69.1745(14) 3_565 . -201_565 N H6 H8 H34 80.9101(19) 3_565 . -203_555 N H6 H8 H35 158.5843(6) 3_565 . -203_555 N H6 H8 H37 91.3289(16) 3_565 . -202_455 N H7 H8 C15 110.6955(11) 3_565 . -201_565 N H7 H8 C16 63.8823(16) 3_565 . -203_555 N H7 H8 C17 93.8483(9) 3_565 . -203_555 N H7 H8 C18 69.4267(12) 3_565 . -202_455 N H7 H8 H31 154.227 3_565 . -201_565 N H7 H8 H34 169.85899(20) 3_565 . -203_555 N H7 H8 H35 58.4971(13) 3_565 . -203_555 N H7 H8 H37 13.26100(30) 3_565 . -202_455 N C15 H8 C16 48.2581(5) -201_565 . -203_555 N C15 H8 C17 68.9604(4) -201_565 . -203_555 N C15 H8 C18 43.57880(20) -201_565 . -202_455 N C15 H8 H31 71.0346(5) -201_565 . -201_565 N C15 H8 H34 65.8577(12) -201_565 . -203_555 N C15 H8 H35 154.1189 -201_565 . -203_555 N C15 H8 H37 98.3979(8) -201_565 . -202_455 N C16 H8 C17 83.6754(13) -203_555 . -203_555 N C16 H8 C18 24.81470(20) -203_555 . -202_455 N C16 H8 H31 107.9619(11) -203_555 . -201_565 N C16 H8 H34 113.9975(17) -203_555 . -203_555 N C16 H8 H35 120.80190(30) -203_555 . -203_555 N C16 H8 H37 53.3019(14) -203_555 . -202_455 N C17 H8 C18 58.8608(14) -203_555 . -202_455 N C17 H8 H31 109.9858(9) -203_555 . -201_565 N C17 H8 H34 76.0115(7) -203_555 . -203_555 N C17 H8 H35 87.55150(20) -203_555 . -203_555 N C17 H8 H37 84.6630(12) -203_555 . -202_455 N C18 H8 H31 114.2391(7) -202_455 . -201_565 N C18 H8 H34 104.4060(14) -202_455 . -203_555 N C18 H8 H35 114.9805 -202_455 . -203_555 N C18 H8 H37 56.3247(10) -202_455 . -202_455 N H31 H8 H34 35.32900(20) -201_565 . -203_555 N H31 H8 H35 129.8151(8) -201_565 . -203_555 N H31 H8 H37 155.99409(20) -201_565 . -202_455 N H34 H8 H35 120.1693(13) -203_555 . -203_555 N H34 H8 H37 158.4064(5) -203_555 . -202_455 N H35 H8 H37 67.6444(11) -203_555 . -202_455 N C4 H9 C5 41.3754(10) 1_555 . 2_665 N C4 H9 H4 60.7331(7) 1_555 . 2_665 N C4 H9 H6 23.1673 1_555 . 3_565 N C4 H9 H10 83.14980(20) 1_555 . 2_665 N C4 H9 C15 26.0333(8) 1_555 . -201_565 N C4 H9 C16 30.7420(9) 1_555 . -203_555 N C4 H9 C18 7.99900(10) 1_555 . -202_455 N C4 H9 H30 126.8544(8) 1_555 . -201_565 N C4 H9 H33 78.3373(4) 1_555 . -203_555 N C4 H9 H36 38.2486(10) 1_555 . -202_455 N C5 H9 H4 95.8493(19) 2_665 . 2_665 N C5 H9 H6 53.8049(9) 2_665 . 3_565 N C5 H9 H10 41.9227(8) 2_665 . 2_665 N C5 H9 C15 65.5761(18) 2_665 . -201_565 N C5 H9 C16 11.71150(10) 2_665 . -203_555 N C5 H9 C18 35.4939(8) 2_665 . -202_455 N C5 H9 H30 153.8964(4) 2_665 . -201_565 N C5 H9 H33 37.0751(6) 2_665 . -203_555 N C5 H9 H36 3.3062 2_665 . -202_455 N H4 H9 H6 68.20090(20) 2_665 . 3_565 N H4 H9 H10 132.8843(13) 2_665 . 2_665 N H4 H9 C15 35.239 2_665 . -201_565 N H4 H9 C16 88.6516(17) 2_665 . -203_555 N H4 H9 C18 63.0818(10) 2_665 . -202_455 N H4 H9 H30 66.2024(16) 2_665 . -201_565 N H4 H9 H33 128.6519(14) 2_665 . -203_555 N H4 H9 H36 92.6191(19) 2_665 . -202_455 N H6 H9 H10 90.74560(30) 3_565 . 2_665 N H6 H9 C15 35.36680(30) 3_565 . -201_565 N H6 H9 C16 42.1494(9) 3_565 . -203_555 N H6 H9 C18 30.44190(10) 3_565 . -202_455 N H6 H9 H30 127.1756(12) 3_565 . -201_565 N H6 H9 H33 86.5316(4) 3_565 . -203_555 N H6 H9 H36 51.5087(9) 3_565 . -202_455 N H10 H9 C15 107.2982(10) 2_665 . -201_565 N H10 H9 C16 52.5095(7) 2_665 . -203_555 N H10 H9 C18 77.3937 2_665 . -202_455 N H10 H9 H30 140.6432(9) 2_665 . -201_565 N H10 H9 H33 4.85940(20) 2_665 . -203_555 N H10 H9 H36 45.1593(8) 2_665 . -202_455 N C15 H9 C16 56.0562(17) -201_565 . -203_555 N C15 H9 C18 30.1912(10) -201_565 . -202_455 N C15 H9 H30 100.9386(16) -201_565 . -201_565 N C15 H9 H33 102.4414(12) -201_565 . -203_555 N C15 H9 H36 62.2893(18) -201_565 . -202_455 N C16 H9 C18 25.9886(7) -203_555 . -202_455 N C16 H9 H30 152.87691(20) -203_555 . -201_565 N C16 H9 H33 47.7401(5) -203_555 . -203_555 N C16 H9 H36 9.4179 -203_555 . -202_455 N C18 H9 H30 128.9948(5) -202_455 . -201_565 N C18 H9 H33 72.53830(20) -202_455 . -203_555 N C18 H9 H36 32.2378(8) -202_455 . -202_455 N H30 H9 H33 143.9931(8) -201_565 . -203_555 N H30 H9 H36 151.9634(4) -201_565 . -202_455 N H33 H9 H36 40.3064(6) -203_555 . -202_455 N C4 H10 C5 47.4030(9) 3_565 . 1_555 N C4 H10 C7 66.5124(16) 3_565 . 3_565 N C4 H10 H6 20.1204(4) 3_565 . 2_665 N C4 H10 H9 47.5374(12) 3_565 . 3_565 N C4 H10 H15 109.4223(19) 3_565 . 3_565 N C4 H10 H12 115.6254(17) 3_565 . 2_665 N C4 H10 C14 51.9158(10) 3_565 . -203_555 N C4 H10 C15 16.32360(20) 3_565 . -203_555 N C4 H10 C16 30.7228(4) 3_565 . -202_455 N C4 H10 H28 106.6344(18) 3_565 . -203_555 N C4 H10 H30 56.2080(15) 3_565 . -203_555 N C4 H10 H33 37.6353(9) 3_565 . -202_455 N C4 H10 H36 12.50500(10) 3_565 . -201_565 N C5 H10 C7 25.0254(5) 1_555 . 3_565 N C5 H10 H6 65.3031(6) 1_555 . 2_665 N C5 H10 H9 94.79290(30) 1_555 . 3_565 N C5 H10 H15 67.7401(7) 1_555 . 3_565 N C5 H10 H12 68.6271(7) 1_555 . 2_665 N C5 H10 C14 6.77700(10) 1_555 . -203_555 N C5 H10 C15 62.5190(8) 1_555 . -203_555 N C5 H10 C16 17.9715(5) 1_555 . -202_455 N C5 H10 H28 59.9892(9) 1_555 . -203_555 N C5 H10 H30 102.6908(6) 1_555 . -203_555 N C5 H10 H33 84.79780(10) 1_555 . -202_455 N C5 H10 H36 59.3104(8) 1_555 . -201_565 N C7 H10 H6 80.0741(14) 3_565 . 2_665 N C7 H10 H9 112.8052(4) 3_565 . 3_565 N C7 H10 H15 44.01490(20) 3_565 . 3_565 N C7 H10 H12 55.90290(10) 3_565 . 2_665 N C7 H10 C14 26.64300(30) 3_565 . -203_555 N C7 H10 C15 82.7770(14) 3_565 . -203_555 N C7 H10 C16 36.3111(12) 3_565 . -202_455 N C7 H10 H28 49.592 3_565 . -203_555 N C7 H10 H30 122.38430(10) 3_565 . -203_555 N C7 H10 H33 103.4620(8) 3_565 . -202_455 N C7 H10 H36 79.0173(15) 3_565 . -201_565 N H6 H10 H9 33.0202(10) 2_665 . 3_565 N H6 H10 H15 118.2367(18) 2_665 . 3_565 N H6 H10 H12 133.8160(14) 2_665 . 2_665 N H6 H10 C14 70.6123(7) 2_665 . -203_555 N H6 H10 C15 17.0345(5) 2_665 . -203_555 N H6 H10 C16 47.49400(10) 2_665 . -202_455 N H6 H10 H28 125.2916(15) 2_665 . -203_555 N H6 H10 H30 43.2023(14) 2_665 . -203_555 N H6 H10 H33 24.7825(7) 2_665 . -202_455 N H6 H10 H36 15.3081(4) 2_665 . -201_565 N H9 H10 H15 149.3315(9) 3_565 . 3_565 N H9 H10 H12 159.7805(6) 3_565 . 2_665 N H9 H10 C14 98.69090(20) 3_565 . -203_555 N H9 H10 C15 32.4465(10) 3_565 . -203_555 N H9 H10 C16 78.1669(8) 3_565 . -202_455 N H9 H10 H28 150.8202(7) 3_565 . -203_555 N H9 H10 H30 10.4391(4) 3_565 . -203_555 N H9 H10 H33 10.0171(4) 3_565 . -202_455 N H9 H10 H36 35.4882(11) 3_565 . -201_565 N H15 H10 H12 35.1878(10) 3_565 . 2_665 N H15 H10 C14 66.8024(5) 3_565 . -203_555 N H15 H10 C15 125.6762(16) 3_565 . -203_555 N H15 H10 C16 80.1851(14) 3_565 . -202_455 N H15 H10 H28 37.9427(10) 3_565 . -203_555 N H15 H10 H30 159.4129(5) 3_565 . -203_555 N H15 H10 H33 142.9639(11) 3_565 . -202_455 N H15 H10 H36 121.7090(17) 3_565 . -201_565 N H12 H10 C14 63.7237(7) 2_665 . -203_555 N H12 H10 C15 128.9284(16) 2_665 . -203_555 N H12 H10 C16 86.3311(12) 2_665 . -202_455 N H12 H10 H28 9.23230(10) 2_665 . -203_555 N H12 H10 H30 160.0264(6) 2_665 . -203_555 N H12 H10 H33 150.6954(9) 2_665 . -202_455 N H12 H10 H36 126.5507(16) 2_665 . -201_565 N C14 H10 C15 66.2445(9) -203_555 . -203_555 N C14 H10 C16 23.9646(5) -203_555 . -202_455 N C14 H10 H28 54.8276(8) -203_555 . -203_555 N C14 H10 H30 105.8475(4) -203_555 . -203_555 N C14 H10 H33 88.67860(20) -203_555 . -202_455 N C14 H10 H36 63.3214(9) -203_555 . -201_565 N C15 H10 C16 46.72230(20) -203_555 . -202_455 N C15 H10 H28 119.7029(17) -203_555 . -203_555 N C15 H10 H30 40.3110(13) -203_555 . -203_555 N C15 H10 H33 22.4373(7) -203_555 . -202_455 N C15 H10 H36 4.03390(10) -203_555 . -201_565 N C16 H10 H28 77.8534(14) -202_455 . -203_555 N C16 H10 H30 86.9137(11) -202_455 . -203_555 N C16 H10 H33 68.3313(5) -202_455 . -202_455 N C16 H10 H36 43.12590(30) -202_455 . -201_565 N H28 H10 H30 152.9415(7) -203_555 . -203_555 N H28 H10 H33 141.5082(11) -203_555 . -202_455 N H28 H10 H36 117.3709(18) -203_555 . -201_565 N H30 H10 H33 18.9396(7) -203_555 . -202_455 N H30 H10 H36 43.7948(14) -203_555 . -201_565 N H33 H10 H36 25.4875(7) -202_455 . -201_565 N C3 H11 C4 22.8671(6) 2_665 . 3_565 N C3 H11 C5 48.16220(30) 2_665 . 1_555 N C3 H11 C6 80.9993(18) 2_665 . 2_665 N C3 H11 C7 79.2560(17) 2_665 . 3_565 N C3 H11 H7 53.2055(14) 2_665 . 2_665 N C3 H11 H14 126.8463(6) 2_665 . 3_565 N C3 H11 H15 112.6355(15) 2_665 . 3_565 N C3 H11 H13 122.2031(17) 2_665 . 2_665 N C3 H11 C14 48.6298(6) 2_665 . -203_555 N C3 H11 C16 32.09830(20) 2_665 . -202_455 N C3 H11 C18 8.30990(10) 2_665 . -201_565 N C3 H11 H29 81.0416(11) 2_665 . -203_555 N C3 H11 H32 130.3859(11) 2_665 . -202_455 N C3 H11 H37 36.9334(10) 2_665 . -201_565 N C4 H11 C5 41.3303(5) 3_565 . 1_555 N C4 H11 C6 83.9716(16) 3_565 . 2_665 N C4 H11 C7 81.1864(16) 3_565 . 3_565 N C4 H11 H7 65.7514(18) 3_565 . 2_665 N C4 H11 H14 148.2797 3_565 . 3_565 N C4 H11 H15 97.6084(19) 3_565 . 3_565 N C4 H11 H13 131.9131(13) 3_565 . 2_665 N C4 H11 C14 48.9513(5) 3_565 . -203_555 N C4 H11 C16 22.139 3_565 . -202_455 N C4 H11 C18 19.1688(4) 3_565 . -201_565 N C4 H11 H29 101.0900(5) 3_565 . -203_555 N C4 H11 H32 111.0083(16) 3_565 . -202_455 N C4 H11 H37 48.1854(14) 3_565 . -201_565 N C5 H11 C6 44.3695(11) 1_555 . 2_665 N C5 H11 C7 41.1833(11) 1_555 . 3_565 N C5 H11 H7 101.3612(11) 1_555 . 2_665 N C5 H11 H14 144.9783 1_555 . 3_565 N C5 H11 H15 65.1610(11) 1_555 . 3_565 N C5 H11 H13 92.6628(8) 1_555 . 2_665 N C5 H11 C14 13.9406 1_555 . -203_555 N C5 H11 C16 19.2540(5) 1_555 . -202_455 N C5 H11 C18 39.9385(4) 1_555 . -201_565 N C5 H11 H29 83.38650(30) 1_555 . -203_555 N C5 H11 H32 85.4342(8) 1_555 . -202_455 N C5 H11 H37 84.6480(7) 1_555 . -201_565 N C6 H11 C7 3.488 2_665 . 3_565 N C6 H11 H7 124.8123(5) 2_665 . 2_665 N C6 H11 H14 103.9215(10) 2_665 . 3_565 N C6 H11 H15 53.5563(5) 2_665 . 3_565 N C6 H11 H13 48.45560(30) 2_665 . 2_665 N C6 H11 C14 35.0705(11) 2_665 . -203_555 N C6 H11 C16 62.3091(16) 2_665 . -202_455 N C6 H11 C18 74.8391(18) 2_665 . -201_565 N C6 H11 H29 54.44770(20) 2_665 . -203_555 N C6 H11 H32 73.7377(9) 2_665 . -202_455 N C6 H11 H37 114.8516(8) 2_665 . -201_565 N C7 H11 H7 124.8409(4) 3_565 . 2_665 N C7 H11 H14 107.3923(10) 3_565 . 3_565 N C7 H11 H15 52.2737(4) 3_565 . 3_565 N C7 H11 H13 51.52080(30) 3_565 . 2_665 N C7 H11 C14 32.4512(10) 3_565 . -203_555 N C7 H11 C16 59.3701(16) 3_565 . -202_455 N C7 H11 C18 72.8114(18) 3_565 . -201_565 N C7 H11 H29 57.33300(20) 3_565 . -203_555 N C7 H11 H32 72.9884(8) 3_565 . -202_455 N C7 H11 H37 113.8984(7) 3_565 . -201_565 N H7 H11 H14 85.2839(18) 2_665 . 3_565 N H7 H11 H15 162.80029(10) 2_665 . 3_565 N H7 H11 H13 131.5054(14) 2_665 . 2_665 N H7 H11 C14 100.2004(8) 2_665 . -203_555 N H7 H11 C16 84.1181(17) 2_665 . -202_455 N H7 H11 C18 61.4269(16) 2_665 . -201_565 N H7 H11 H29 86.2259(9) 2_665 . -203_555 N H7 H11 H32 158.9020(4) 2_665 . -202_455 N H7 H11 H37 17.5947(4) 2_665 . -201_565 N H14 H11 H15 111.9033(19) 3_565 . 3_565 N H14 H11 H13 59.5824(7) 3_565 . 2_665 N H14 H11 C14 131.249 3_565 . -203_555 N H14 H11 C16 151.82120(20) 3_565 . -202_455 N H14 H11 C18 133.2278(5) 3_565 . -201_565 N H14 H11 H29 62.58280(20) 3_565 . -203_555 N H14 H11 H32 100.6674(17) 3_565 . -202_455 N H14 H11 H37 102.1712(14) 3_565 . -201_565 N H15 H11 H13 62.5251(14) 3_565 . 2_665 N H15 H11 C14 69.3770(8) 3_565 . -203_555 N H15 H11 C16 80.7259(17) 3_565 . -202_455 N H15 H11 C18 104.3333(16) 3_565 . -201_565 N H15 H11 H29 101.9779(9) 3_565 . -203_555 N H15 H11 H32 22.0055(4) 3_565 . -202_455 N H15 H11 H37 145.6664(5) 3_565 . -201_565 N H13 H11 C14 83.1170(8) 2_665 . -203_555 N H13 H11 C16 110.7143(13) 2_665 . -202_455 N H13 H11 C18 118.8259(16) 2_665 . -201_565 N H13 H11 H29 49.32530(30) 2_665 . -203_555 N H13 H11 H32 67.2017(17) 2_665 . -202_455 N H13 H11 H37 138.8632(13) 2_665 . -201_565 N C14 H11 C16 27.7879(5) -203_555 . -202_455 N C14 H11 C18 41.3073(7) -203_555 . -201_565 N C14 H11 H29 69.45300(20) -203_555 . -203_555 N C14 H11 H32 91.0832(4) -203_555 . -202_455 N C14 H11 H37 85.3127(4) -203_555 . -201_565 N C16 H11 C18 23.92600(10) -202_455 . -201_565 N C16 H11 H29 90.6886(5) -202_455 . -203_555 N C16 H11 H32 98.5638(13) -202_455 . -202_455 N C16 H11 H37 66.8020(12) -202_455 . -201_565 N C18 H11 H29 82.1142(9) -201_565 . -203_555 N C18 H11 H32 122.4381(12) -201_565 . -202_455 N C18 H11 H37 44.8851(12) -201_565 . -201_565 N H29 H11 H32 114.5519(13) -203_555 . -202_455 N H29 H11 H37 89.6935(10) -203_555 . -201_565 N H32 H11 H37 152.4743(4) -202_455 . -201_565 N C6 H14 C7 16.38480(30) 3_565 . 1_555 N C6 H14 H7 97.5395(4) 3_565 . 3_565 N C6 H14 H11 51.9369(8) 3_565 . 2_665 N C6 H14 H13 42.2959(7) 3_565 . 3_565 N C6 H14 H27 64.10230(10) 3_565 . -202_455 N C6 H14 H29 28.6040(10) 3_565 . -201_565 N C6 H14 H32 49.9873(4) 3_565 . -203_555 N C7 H14 H7 86.66500(10) 1_555 . 3_565 N C7 H14 H11 35.5540(5) 1_555 . 2_665 N C7 H14 H13 56.7514(10) 1_555 . 3_565 N C7 H14 H27 80.1755(4) 1_555 . -202_455 N C7 H14 H29 22.5181(4) 1_555 . -201_565 N C7 H14 H32 34.25430(20) 1_555 . -203_555 N H7 H14 H11 63.8718(9) 3_565 . 2_665 N H7 H14 H13 137.2946(11) 3_565 . 3_565 N H7 H14 H27 140.2778(11) 3_565 . -202_455 N H7 H14 H29 69.0086(6) 3_565 . -201_565 N H7 H14 H32 74.7447(6) 3_565 . -203_555 N H11 H14 H13 89.8815(15) 2_665 . 3_565 N H11 H14 H27 115.2036(9) 2_665 . -202_455 N H11 H14 H29 39.41880(20) 2_665 . -201_565 N H11 H14 H32 11.54340(20) 2_665 . -203_555 N H13 H14 H27 26.8751(6) 3_565 . -202_455 N H13 H14 H29 69.5828(17) 3_565 . -201_565 N H13 H14 H32 83.3586(11) 3_565 . -203_555 N H27 H14 H29 86.6223(12) -202_455 . -201_565 N H27 H14 H32 109.8697(5) -202_455 . -203_555 N H29 H14 H32 44.86350(20) -201_565 . -203_555 N C5 H15 C6 42.5093(4) 2_665 . 3_565 N C5 H15 C7 33.0331(4) 2_665 . 1_555 N C5 H15 H10 48.4854(13) 2_665 . 2_665 N C5 H15 H11 47.2709(9) 2_665 . 2_665 N C5 H15 H12 70.0499(4) 2_665 . 3_565 N C5 H15 H13 80.0709(11) 2_665 . 3_565 N C5 H15 C14 10.76970(10) 2_665 . -201_565 N C5 H15 C16 10.19590(20) 2_665 . -203_555 N C5 H15 H26 99.9921(19) 2_665 . -202_455 N C5 H15 H28 48.7692(5) 2_665 . -201_565 N C5 H15 H29 45.7264(5) 2_665 . -201_565 N C5 H15 H32 49.6346(10) 2_665 . -203_555 N C6 H15 C7 32.78970(10) 3_565 . 1_555 N C6 H15 H10 85.7778(8) 3_565 . 2_665 N C6 H15 H11 61.20170(30) 3_565 . 2_665 N C6 H15 H12 62.1395 3_565 . 3_565 N C6 H15 H13 48.6855(5) 3_565 . 3_565 N C6 H15 C14 31.7395(5) 3_565 . -201_565 N C6 H15 C16 50.89890(20) 3_565 . -203_555 N C6 H15 H26 59.6648(15) 3_565 . -202_455 N C6 H15 H28 57.78490(20) 3_565 . -201_565 N C6 H15 H29 46.69320(10) 3_565 . -201_565 N C6 H15 H32 63.52860(30) 3_565 . -203_555 N C7 H15 H10 80.3707(17) 1_555 . 2_665 N C7 H15 H11 28.5236(4) 1_555 . 2_665 N C7 H15 H12 89.57800(10) 1_555 . 3_565 N C7 H15 H13 48.6509(14) 1_555 . 3_565 N C7 H15 C14 27.72900(30) 1_555 . -201_565 N C7 H15 C16 34.33910(30) 1_555 . -203_555 N C7 H15 H26 88.2123(16) 1_555 . -202_455 N C7 H15 H28 75.4980(8) 1_555 . -201_565 N C7 H15 H29 16.34730(10) 1_555 . -201_565 N C7 H15 H32 30.9333(4) 1_555 . -203_555 N H10 H15 H11 81.2538(19) 2_665 . 2_665 N H10 H15 H12 65.8740(5) 2_665 . 3_565 N H10 H15 H13 128.52710(30) 2_665 . 3_565 N H10 H15 C14 57.5624(14) 2_665 . -201_565 N H10 H15 C16 46.1853(14) 2_665 . -203_555 N H10 H15 H26 124.0607(12) 2_665 . -202_455 N H10 H15 H28 44.38130(30) 2_665 . -201_565 N H10 H15 H29 88.8456(18) 2_665 . -201_565 N H10 H15 H32 82.3980(19) 2_665 . -203_555 N H11 H15 H12 115.2251(6) 2_665 . 3_565 N H11 H15 H13 58.1030(13) 2_665 . 3_565 N H11 H15 C14 48.5881(9) 2_665 . -201_565 N H11 H15 C16 41.3371(8) 2_665 . -203_555 N H11 H15 H26 111.4984(12) 2_665 . -202_455 N H11 H15 H28 95.9905(14) 2_665 . -201_565 N H11 H15 H29 16.60480(10) 2_665 . -201_565 N H11 H15 H32 2.5842 2_665 . -203_555 N H12 H15 H13 102.1601 3_565 . 3_565 N H12 H15 C14 66.74170(30) 3_565 . -201_565 N H12 H15 C16 78.71880(20) 3_565 . -203_555 N H12 H15 H26 59.4223(7) 3_565 . -202_455 N H12 H15 H28 24.6038(7) 3_565 . -201_565 N H12 H15 H29 105.83430(30) 3_565 . -201_565 N H12 H15 H32 117.7955(6) 3_565 . -203_555 N H13 H15 C14 71.5301(11) 3_565 . -201_565 N H13 H15 C16 82.9576(11) 3_565 . -203_555 N H13 H15 H26 58.00770(10) 3_565 . -202_455 N H13 H15 H28 105.83410(30) 3_565 . -201_565 N H13 H15 H29 44.3303(13) 3_565 . -201_565 N H13 H15 H32 58.4514(13) 3_565 . -203_555 N C14 H15 C16 19.83980(30) -201_565 . -203_555 N C14 H15 H26 89.7370(20) -201_565 . -202_455 N C14 H15 H28 48.6579(5) -201_565 . -201_565 N C14 H15 H29 42.8485(5) -201_565 . -201_565 N C14 H15 H32 51.1353(9) -201_565 . -203_555 N C16 H15 H26 109.5747(17) -203_555 . -202_455 N C16 H15 H28 56.0756(6) -203_555 . -201_565 N C16 H15 H29 43.6379(4) -203_555 . -201_565 N C16 H15 H32 43.4439(8) -203_555 . -203_555 N H26 H15 H28 79.7031(15) -202_455 . -201_565 N H26 H15 H29 95.0032(13) -202_455 . -201_565 N H26 H15 H32 112.7976(12) -202_455 . -203_555 N H28 H15 H29 91.3523(10) -201_565 . -201_565 N H28 H15 H32 98.3873(14) -201_565 . -203_555 N H29 H15 H32 18.28970(10) -201_565 . -203_555 N C8 H16 H12 75.5606(4) 1_555 . 2_665 N C8 H16 C12 13.9039(4) 1_555 . -202_455 N C8 H16 H24 23.9120(5) 1_555 . -203_555 N C8 H16 H25 50.5982 1_555 . -202_455 N C8 H16 H26 44.6323(5) 1_555 . -201_565 N C8 H16 H27 81.5587 1_555 . -202_455 N H12 H16 C12 86.9806(9) 2_665 . -202_455 N H12 H16 H24 97.3067(8) 2_665 . -203_555 N H12 H16 H25 76.2394(9) 2_665 . -202_455 N H12 H16 H26 37.86230(30) 2_665 . -201_565 N H12 H16 H27 64.3501(15) 2_665 . -202_455 N C12 H16 H24 20.7742 -202_455 . -203_555 N C12 H16 H25 44.978 -202_455 . -202_455 N C12 H16 H26 52.4077(11) -202_455 . -201_565 N C12 H16 H27 93.6282(5) -202_455 . -202_455 N H24 H16 H25 65.32490(10) -203_555 . -202_455 N H24 H16 H26 68.5431(10) -203_555 . -201_565 N H24 H16 H27 81.9734(9) -203_555 . -202_455 N H25 H16 H26 42.3189(11) -202_455 . -201_565 N H25 H16 H27 124.41080(20) -202_455 . -202_455 N H26 H16 H27 85.0239(13) -201_565 . -202_455 N C8 H17 C8 74.91560(10) 1_555 . 3_565 N C8 H17 C9 70.8173(12) 1_555 . 3_565 N C8 H17 H18 98.1046(6) 1_555 . 3_565 N C8 H17 H19 88.6379(7) 1_555 . 2_665 N C8 H17 H13 95.2015(10) 1_555 . 2_665 N C8 H17 C12 27.2424(4) 1_555 . -202_455 N C8 H17 C13 65.75420(10) 1_555 . -201_565 N C8 H17 H24 79.91370(10) 1_555 . -202_455 N C8 H17 H24 17.4230(6) 1_555 . -203_555 N C8 H17 H25 72.30180(10) 1_555 . -202_455 N C8 H17 H26 47.51640(30) 1_555 . -201_565 N C8 H17 H27 109.1292(12) 1_555 . -201_565 N C8 H17 C9 66.4784(11) 3_565 . 3_565 N C8 H17 H18 124.7764(5) 3_565 . 3_565 N C8 H17 H19 54.4740(14) 3_565 . 2_665 N C8 H17 H13 74.65410(10) 3_565 . 2_665 N C8 H17 C12 57.54510(10) 3_565 . -202_455 N C8 H17 C13 49.3246(6) 3_565 . -201_565 N C8 H17 H24 13.9066(5) 3_565 . -202_455 N C8 H17 H24 75.58480(10) 3_565 . -203_555 N C8 H17 H25 146.01350(30) 3_565 . -202_455 N C8 H17 H26 94.8896(6) 3_565 . -201_565 N C8 H17 H27 65.9798 3_565 . -201_565 N C9 H17 H18 59.8278(16) 3_565 . 3_565 N C9 H17 H19 24.0185(5) 3_565 . 2_665 N C9 H17 H13 140.8456(10) 3_565 . 2_665 N C9 H17 C12 46.4960(7) 3_565 . -202_455 N C9 H17 C13 108.4769(19) 3_565 . -201_565 N C9 H17 H24 55.2749(5) 3_565 . -202_455 N C9 H17 H24 54.6003(6) 3_565 . -203_555 N C9 H17 H25 109.8257 3_565 . -202_455 N C9 H17 H26 118.3204(15) 3_565 . -201_565 N C9 H17 H27 130.3507(11) 3_565 . -201_565 N H18 H17 H19 70.9038(18) 3_565 . 2_665 N H18 H17 H13 158.8397(6) 3_565 . 2_665 N H18 H17 C12 91.6155(4) 3_565 . -202_455 N H18 H17 C13 163.3430(4) 3_565 . -201_565 N H18 H17 H24 111.6048(10) 3_565 . -202_455 N H18 H17 H24 83.62420(10) 3_565 . -203_555 N H18 H17 H25 69.3030(11) 3_565 . -202_455 N H18 H17 H26 120.6218(16) 3_565 . -201_565 N H18 H17 H27 152.7373(6) 3_565 . -201_565 N H19 H17 H13 125.9730(13) 2_665 . 2_665 N H19 H17 C12 61.62610(30) 2_665 . -202_455 N H19 H17 C13 103.2587(20) 2_665 . -201_565 N H19 H17 H24 40.8375(9) 2_665 . -202_455 N H19 H17 H24 74.71990(10) 2_665 . -203_555 N H19 H17 H25 132.3598(5) 2_665 . -202_455 N H19 H17 H26 134.1003(10) 2_665 . -201_565 N H19 H17 H27 110.0555(15) 2_665 . -201_565 N H13 H17 C12 107.50200(20) 2_665 . -202_455 N H13 H17 C13 35.7426(10) 2_665 . -201_565 N H13 H17 H24 86.8524(4) 2_665 . -202_455 N H13 H17 H24 111.7636(4) 2_665 . -203_555 N H13 H17 H25 99.5164(8) 2_665 . -202_455 N H13 H17 H26 59.3380(17) 2_665 . -201_565 N H13 H17 H27 20.34840(30) 2_665 . -201_565 N C12 H17 C13 72.1546(8) -202_455 . -201_565 N C12 H17 H24 57.7498 -202_455 . -202_455 N C12 H17 H24 18.6268 -202_455 . -203_555 N C12 H17 H25 94.4143 -202_455 . -202_455 N C12 H17 H26 73.2699(7) -202_455 . -201_565 N C12 H17 H27 113.16860(20) -202_455 . -201_565 N C13 H17 H24 63.2310(11) -201_565 . -202_455 N C13 H17 H24 79.7609(5) -201_565 . -203_555 N C13 H17 H25 107.3503(9) -201_565 . -202_455 N C13 H17 H26 51.9623(13) -201_565 . -201_565 N C13 H17 H27 43.7139(10) -201_565 . -201_565 N H24 H17 H24 76.3747 -202_455 . -203_555 N H24 H17 H25 151.9061 -202_455 . -202_455 N H24 H17 H26 107.22690(10) -202_455 . -201_565 N H24 H17 H27 75.4646(6) -202_455 . -201_565 N H24 H17 H25 75.857 -203_555 . -202_455 N H24 H17 H26 63.9750(9) -203_555 . -201_565 N H24 H17 H27 123.3996(5) -203_555 . -201_565 N H25 H17 H26 55.7427(4) -202_455 . -201_565 N H25 H17 H27 117.3570(10) -202_455 . -201_565 N H26 H17 H27 79.2467(20) -201_565 . -201_565 N C8 H18 C9 60.7940(10) 2_665 . 1_555 N C8 H18 H17 46.6739(10) 2_665 . 2_665 N C8 H18 H19 73.4798(7) 2_665 . 3_565 N C8 H18 C11 88.1198(13) 2_665 . -202_455 N C8 H18 C12 19.10510(10) 2_665 . -203_555 N C8 H18 H22 96.1103(20) 2_665 . -202_455 N C8 H18 H24 17.55410(20) 2_665 . -201_565 N C8 H18 H25 44.1203(9) 2_665 . -203_555 N C9 H18 H17 76.7286(9) 1_555 . 2_665 N C9 H18 H19 23.4761 1_555 . 3_565 N C9 H18 C11 28.68570(30) 1_555 . -202_455 N C9 H18 C12 43.4387(11) 1_555 . -203_555 N C9 H18 H22 47.5865(6) 1_555 . -202_455 N C9 H18 H24 50.8140(7) 1_555 . -201_565 N C9 H18 H25 100.48350(20) 1_555 . -203_555 N H17 H18 H19 70.1275(11) 2_665 . 3_565 N H17 H18 C11 88.9809(16) 2_665 . -202_455 N H17 H18 C12 45.6204(6) 2_665 . -203_555 N H17 H18 H22 124.3151(15) 2_665 . -202_455 N H17 H18 H24 62.3768(7) 2_665 . -201_565 N H17 H18 H25 36.1885(11) 2_665 . -203_555 N H19 H18 C11 19.0324(6) 3_565 . -202_455 N H19 H18 C12 54.3751(8) 3_565 . -203_555 N H19 H18 H22 58.63150(30) 3_565 . -202_455 N H19 H18 H24 68.9487(4) 3_565 . -201_565 N H19 H18 H25 102.7987 3_565 . -203_555 N C11 H18 C12 69.5091(14) -202_455 . -203_555 N C11 H18 H22 43.03000(30) -202_455 . -202_455 N C11 H18 H24 79.4885(9) -202_455 . -201_565 N C11 H18 H25 121.6415(6) -202_455 . -203_555 N C12 H18 H22 85.0883(19) -203_555 . -202_455 N C12 H18 H24 21.51220(10) -203_555 . -201_565 N C12 H18 H25 57.7077(9) -203_555 . -203_555 N H22 H18 H24 79.3719(18) -202_455 . -201_565 N H22 H18 H25 140.0542(11) -202_455 . -203_555 N H24 H18 H25 60.6847(7) -201_565 . -203_555 N C8 H19 C8 66.0330(16) 2_665 . 3_565 N C8 H19 C9 66.6540(7) 2_665 . 1_555 N C8 H19 C9 105.3297(4) 2_665 . 2_665 N C8 H19 C9 87.44780(10) 2_665 . 3_565 N C8 H19 C10 141.4160(12) 2_665 . 2_665 N C8 H19 H17 73.3710(19) 2_665 . 3_565 N C8 H19 H18 111.9235(11) 2_665 . 2_665 N C8 H19 C11 115.7648(5) 2_665 . -201_565 N C8 H19 C11 137.5138(13) 2_665 . -203_555 N C8 H19 C12 63.4513(16) 2_665 . -201_565 N C8 H19 C12 22.0252(4) 2_665 . -203_555 N C8 H19 H22 89.8893(17) 2_665 . -202_455 N C8 H19 H22 146.63000(30) 2_665 . -203_555 N C8 H19 H23 115.4290(9) 2_665 . -203_555 N C8 H19 H24 7.13970(20) 2_665 . -201_565 N C8 H19 C9 90.793 3_565 . 1_555 N C8 H19 C9 44.3204(10) 3_565 . 2_665 N C8 H19 C9 57.4940(6) 3_565 . 3_565 N C8 H19 C10 139.7681(8) 3_565 . 2_665 N C8 H19 H17 40.7117(8) 3_565 . 3_565 N C8 H19 H18 58.34890(20) 3_565 . 2_665 N C8 H19 C11 66.1366(16) 3_565 . -201_565 N C8 H19 C11 141.8062(8) 3_565 . -203_555 N C8 H19 C12 3.3278 3_565 . -201_565 N C8 H19 C12 65.6198(13) 3_565 . -203_555 N C8 H19 H22 130.2484(6) 3_565 . -202_455 N C8 H19 H22 80.8495(19) 3_565 . -203_555 N C8 H19 H23 145.26010(30) 3_565 . -203_555 N C8 H19 H24 63.9691(16) 3_565 . -201_565 N C9 H19 C9 88.1054 1_555 . 2_665 N C9 H19 C9 49.7054 1_555 . 3_565 N C9 H19 C10 82.39560(30) 1_555 . 2_665 N C9 H19 H17 127.3203(8) 1_555 . 3_565 N C9 H19 H18 142.3423 1_555 . 2_665 N C9 H19 C11 73.81840(10) 1_555 . -201_565 N C9 H19 C11 79.4576(4) 1_555 . -203_555 N C9 H19 C12 87.7837 1_555 . -201_565 N C9 H19 C12 46.0011(10) 1_555 . -203_555 N C9 H19 H22 39.6080(6) 1_555 . -202_455 N C9 H19 H22 111.74240(20) 1_555 . -203_555 N C9 H19 H23 122.52410(30) 1_555 . -203_555 N C9 H19 H24 73.7520(5) 1_555 . -201_565 N C9 H19 C9 38.4 2_665 . 3_565 N C9 H19 C10 95.66070(20) 2_665 . 2_665 N C9 H19 H17 70.6303(4) 2_665 . 3_565 N C9 H19 H18 55.0974 2_665 . 2_665 N C9 H19 C11 24.7989(5) 2_665 . -201_565 N C9 H19 C11 98.09080(30) 2_665 . -203_555 N C9 H19 C12 45.6359(10) 2_665 . -201_565 N C9 H19 C12 94.62340(10) 2_665 . -203_555 N C9 H19 H22 113.20860(20) 2_665 . -202_455 N C9 H19 H22 42.5460(7) 2_665 . -203_555 N C9 H19 H23 135.8748(5) 2_665 . -203_555 N C9 H19 H24 105.5324(5) 2_665 . -201_565 N C9 H19 C10 89.6008 3_565 . 2_665 N C9 H19 H17 97.10470(10) 3_565 . 3_565 N C9 H19 H18 93.1733 3_565 . 2_665 N C9 H19 C11 30.0062(4) 3_565 . -201_565 N C9 H19 C11 89.6389 3_565 . -203_555 N C9 H19 C12 56.1074(7) 3_565 . -201_565 N C9 H19 C12 68.2721(4) 3_565 . -203_555 N C9 H19 H22 79.74280(10) 3_565 . -202_455 N C9 H19 H22 70.60880(20) 3_565 . -203_555 N C9 H19 H23 151.8783(9) 3_565 . -203_555 N C9 H19 H24 91.74600(10) 3_565 . -201_565 N C10 H19 H17 145.0406(7) 2_665 . 3_565 N C10 H19 H18 106.64940(10) 2_665 . 2_665 N C10 H19 C11 73.9128(8) 2_665 . -201_565 N C10 H19 C11 3.91670(10) 2_665 . -203_555 N C10 H19 C12 140.4863(9) 2_665 . -201_565 N C10 H19 C12 126.8098(13) 2_665 . -203_555 N C10 H19 H22 51.8121(5) 2_665 . -202_455 N C10 H19 H22 65.4949(13) 2_665 . -203_555 N C10 H19 H23 62.3685(9) 2_665 . -203_555 N C10 H19 H24 147.1991(11) 2_665 . -201_565 N H17 H19 H18 38.9688(8) 3_565 . 2_665 N H17 H19 C11 95.3588(9) 3_565 . -201_565 N H17 H19 C11 148.8556(6) 3_565 . -203_555 N H17 H19 C12 42.9440(8) 3_565 . -201_565 N H17 H19 C12 87.1307(20) 3_565 . -203_555 N H17 H19 H22 163.13651(20) 3_565 . -202_455 N H17 H19 H22 84.4391(18) 3_565 . -203_555 N H17 H19 H23 104.7895(10) 3_565 . -203_555 N H17 H19 H24 67.1481(18) 3_565 . -201_565 N H18 H19 C11 73.94800(30) 2_665 . -201_565 N H18 H19 C11 110.55760(20) 2_665 . -203_555 N H18 H19 C12 61.67380(20) 2_665 . -201_565 N H18 H19 C12 121.6877(11) 2_665 . -203_555 N H18 H19 H22 156.8780(6) 2_665 . -202_455 N H18 H19 H22 47.5394(10) 2_665 . -203_555 N H18 H19 H23 92.91450(20) 2_665 . -203_555 N H18 H19 H24 105.9932(10) 2_665 . -201_565 N C11 H19 C11 75.6889(8) -201_565 . -203_555 N C11 H19 C12 66.5928(17) -201_565 . -201_565 N C11 H19 C12 98.0451(8) -201_565 . -203_555 N C11 H19 H22 90.0392(7) -201_565 . -202_455 N C11 H19 H22 40.90180(20) -201_565 . -203_555 N C11 H19 H23 128.3940(14) -201_565 . -203_555 N C11 H19 H24 118.7906(4) -201_565 . -201_565 N C11 H19 C12 142.2116(8) -203_555 . -201_565 N C11 H19 C12 123.3441(15) -203_555 . -203_555 N C11 H19 H22 48.0068(4) -203_555 . -202_455 N C11 H19 H22 69.1667(14) -203_555 . -203_555 N C11 H19 H23 62.5619(9) -203_555 . -203_555 N C11 H19 H24 143.2847(12) -203_555 . -201_565 N C12 H19 C12 62.4006(13) -201_565 . -203_555 N C12 H19 H22 127.3222(6) -201_565 . -202_455 N C12 H19 H22 83.2965(18) -201_565 . -203_555 N C12 H19 H23 147.71561(20) -201_565 . -203_555 N C12 H19 H24 61.6908(16) -201_565 . -201_565 N C12 H19 H22 76.2840(18) -203_555 . -202_455 N C12 H19 H22 136.5227(6) -203_555 . -203_555 N C12 H19 H23 129.4223(6) -203_555 . -203_555 N C12 H19 H24 28.6700(5) -203_555 . -201_565 N H22 H19 H22 109.6724(16) -202_455 . -203_555 N H22 H19 H23 83.9712(8) -202_455 . -203_555 N H22 H19 H24 96.2648(16) -202_455 . -201_565 N H22 H19 H23 93.9062(11) -203_555 . -203_555 N H22 H19 H24 144.66820(30) -203_555 . -201_565 N H23 H19 H24 112.8138(10) -203_555 . -201_565 N C10 H20 H21 15.2990(5) 1_555 . -203_555 N C10 H20 C11 37.2712(9) 1_555 . -202_455 N C10 H20 H22 54.7021(11) 1_555 . 3_565 N C10 H20 H23 86.313 1_555 . -202_455 N H21 H20 C11 52.5692(14) -203_555 . -202_455 N H21 H20 H22 40.2988(5) -203_555 . 3_565 N H21 H20 H23 101.3092(5) -203_555 . -202_455 N C11 H20 H22 90.7642(20) -202_455 . 3_565 N C11 H20 H23 50.0573(10) -202_455 . -202_455 N H22 H20 H23 132.5077(13) 3_565 . -202_455 N C9 H21 C10 74.41940(10) 3_565 . 1_555 N C9 H21 C10 69.22110(30) 3_565 . 3_565 N C9 H21 C10 110.9825(16) 3_565 . -202_455 N C9 H21 H20 120.79270(20) 3_565 . -202_455 N C9 H21 H21 83.6346(6) 3_565 . -202_455 N C9 H21 H21 89.4274(4) 3_565 . -203_555 N C9 H21 C11 147.0319(11) 3_565 . 3_565 N C9 H21 C11 31.0045(6) 3_565 . -201_565 N C9 H21 C11 42.3953(7) 3_565 . -202_455 N C9 H21 H22 122.9780(14) 3_565 . 2_665 N C9 H21 H22 23.9033(8) 3_565 . -201_565 N C9 H21 H23 158.3557(4) 3_565 . 3_565 N C10 H21 C10 92.445 1_555 . 3_565 N C10 H21 C10 58.0912(8) 1_555 . -202_455 N C10 H21 H20 131.825 1_555 . -202_455 N C10 H21 H21 106.5507 1_555 . -202_455 N C10 H21 H21 18.04200(30) 1_555 . -203_555 N C10 H21 C11 80.5639(7) 1_555 . 3_565 N C10 H21 C11 88.96610(30) 1_555 . -201_565 N C10 H21 C11 33.2624(8) 1_555 . -202_455 N C10 H21 H22 109.2832 1_555 . 2_665 N C10 H21 H22 73.35300(20) 1_555 . -201_565 N C10 H21 H23 107.70060(10) 1_555 . 3_565 N C10 H21 C10 66.3818(7) 3_565 . -202_455 N C10 H21 H20 135.4736 3_565 . -202_455 N C10 H21 H21 17.57440(30) 3_565 . -202_455 N C10 H21 H21 107.4668 3_565 . -203_555 N C10 H21 C11 91.0789(4) 3_565 . 3_565 N C10 H21 C11 40.0189(8) 3_565 . -201_565 N C10 H21 C11 87.15310(20) 3_565 . -202_455 N C10 H21 H22 53.9176(12) 3_565 . 2_665 N C10 H21 H22 93.0985(5) 3_565 . -201_565 N C10 H21 H23 131.1804(6) 3_565 . 3_565 N C10 H21 H20 128.0659(14) -202_455 . -202_455 N C10 H21 H21 67.73600(10) -202_455 . -202_455 N C10 H21 H21 58.90040(20) -202_455 . -203_555 N C10 H21 C11 36.1674(5) -202_455 . 3_565 N C10 H21 C11 97.8766(16) -202_455 . -201_565 N C10 H21 C11 85.4354(18) -202_455 . -202_455 N C10 H21 H22 51.7113(9) -202_455 . 2_665 N C10 H21 H22 124.7830(11) -202_455 . -201_565 N C10 H21 H23 87.0539(19) -202_455 . 3_565 N H20 H21 H21 119.79960(20) -202_455 . -202_455 N H20 H21 H21 115.45200(20) -202_455 . -203_555 N H20 H21 C11 91.9023(9) -202_455 . 3_565 N H20 H21 C11 128.69501(10) -202_455 . -201_565 N H20 H21 C11 131.1458 -202_455 . -202_455 N H20 H21 H22 98.9550(8) -202_455 . 2_665 N H20 H21 H22 103.0215(4) -202_455 . -201_565 N H20 H21 H23 41.6238(4) -202_455 . 3_565 N H21 H21 H21 119.06070(10) -202_455 . -203_555 N H21 H21 C11 83.28010(20) -202_455 . 3_565 N H21 H21 C11 52.8408(12) -202_455 . -201_565 N H21 H21 C11 104.7013 -202_455 . -202_455 N H21 H21 H22 39.7575(8) -202_455 . 2_665 N H21 H21 H22 106.90260(20) -202_455 . -201_565 N H21 H21 H23 115.2605(9) -202_455 . 3_565 N H21 H21 C11 71.02030(30) -203_555 . 3_565 N H21 H21 C11 106.8737 -203_555 . -201_565 N H21 H21 C11 47.0363(11) -203_555 . -202_455 N H21 H21 H22 109.7169(7) -203_555 . 2_665 N H21 H21 H22 82.9968(6) -203_555 . -201_565 N H21 H21 H23 90.03810(30) -203_555 . 3_565 N C11 H21 C11 129.6760(13) 3_565 . -201_565 N C11 H21 C11 113.4743(16) 3_565 . -202_455 N C11 H21 H22 47.3815(11) 3_565 . 2_665 N C11 H21 H22 153.7264(9) 3_565 . -201_565 N C11 H21 H23 51.3784(14) 3_565 . 3_565 N C11 H21 C11 64.6638(12) -201_565 . -202_455 N C11 H21 H22 92.5287(20) -201_565 . 2_665 N C11 H21 H22 54.0823(14) -201_565 . -201_565 N C11 H21 H23 162.54980(30) -201_565 . 3_565 N C11 H21 H22 129.2255(9) -202_455 . 2_665 N C11 H21 H22 41.0145(7) -202_455 . -201_565 N C11 H21 H23 132.6461(9) -202_455 . 3_565 N H22 H21 H22 146.6053(6) 2_665 . -201_565 N H22 H21 H23 77.3502(18) 2_665 . 3_565 N H22 H21 H23 134.8529(12) -201_565 . 3_565 N C5 H12 C6 44.99380(30) 3_565 . 1_555 N C5 H12 C7 32.31460(10) 3_565 . 2_665 N C5 H12 C8 123.1959(16) 3_565 . 3_565 N C5 H12 N3 70.23830(30) 3_565 . 3_565 N C5 H12 H10 51.1661(15) 3_565 . 3_565 N C5 H12 H15 76.3693(5) 3_565 . 2_665 N C5 H12 H16 164.7058(4) 3_565 . 3_565 N C5 H12 C13 99.3570(8) 3_565 . -201_565 N C5 H12 C13 76.0801(14) 3_565 . -203_555 N C5 H12 C14 12.10810(20) 3_565 . -202_455 N C5 H12 C16 5.95570(10) 3_565 . -201_565 N C5 H12 H26 109.4532(19) 3_565 . -203_555 N C5 H12 H28 27.8889(8) 3_565 . -202_455 N C5 H12 H33 45.2269(13) 3_565 . -201_565 N C6 H12 C7 29.574 1_555 . 2_665 N C6 H12 C8 78.2965(13) 1_555 . 3_565 N C6 H12 N3 39.00070(10) 1_555 . 3_565 N C6 H12 H10 96.0576(12) 1_555 . 3_565 N C6 H12 H15 79.52600(10) 1_555 . 2_665 N C6 H12 H16 119.72540(10) 1_555 . 3_565 N C6 H12 C13 68.3403(5) 1_555 . -201_565 N C6 H12 C13 31.5050(11) 1_555 . -203_555 N C6 H12 C14 34.5253(5) 1_555 . -202_455 N C6 H12 C16 50.35290(20) 1_555 . -201_565 N C6 H12 H26 67.4988(15) 1_555 . -203_555 N C6 H12 H28 72.2962(4) 1_555 . -202_455 N C6 H12 H33 90.2199(10) 1_555 . -201_565 N C7 H12 C8 99.4682(13) 2_665 . 3_565 N C7 H12 N3 68.0935 2_665 . 3_565 N C7 H12 H10 75.2643(11) 2_665 . 3_565 N C7 H12 H15 55.3935(4) 2_665 . 2_665 N C7 H12 H16 135.91901(20) 2_665 . 3_565 N C7 H12 C13 97.9094(5) 2_665 . -201_565 N C7 H12 C13 52.2250(11) 2_665 . -203_555 N C7 H12 C14 30.3048 2_665 . -202_455 N C7 H12 C16 34.65820(10) 2_665 . -201_565 N C7 H12 H26 79.2836(18) 2_665 . -203_555 N C7 H12 H28 57.9662(6) 2_665 . -202_455 N C7 H12 H33 71.0966(11) 2_665 . -201_565 N C8 H12 N3 61.0451(11) 3_565 . 3_565 N C8 H12 H10 174.35400(10) 3_565 . 3_565 N C8 H12 H15 99.8546(4) 3_565 . 2_665 N C8 H12 H16 41.5171(12) 3_565 . 3_565 N C8 H12 C13 45.23190(20) 3_565 . -201_565 N C8 H12 C13 48.12310(20) 3_565 . -203_555 N C8 H12 C14 111.9125(18) 3_565 . -202_455 N C8 H12 C16 128.6493(15) 3_565 . -201_565 N C8 H12 H26 27.0952(6) 3_565 . -203_555 N C8 H12 H28 148.8452(9) 3_565 . -202_455 N C8 H12 H33 168.05260(30) 3_565 . -201_565 N N3 H12 H10 114.4216(10) 3_565 . 3_565 N N3 H12 H15 116.2328 3_565 . 2_665 N N3 H12 H16 96.825 3_565 . 3_565 N N3 H12 C13 30.7453(4) 3_565 . -201_565 N N3 H12 C13 40.58570(30) 3_565 . -203_555 N N3 H12 C14 58.3045(5) 3_565 . -202_455 N N3 H12 C16 76.12390(20) 3_565 . -201_565 N N3 H12 H26 69.0599(7) 3_565 . -203_555 N N3 H12 H28 89.08970(20) 3_565 . -202_455 N N3 H12 H33 107.7534(8) 3_565 . -201_565 N H10 H12 H15 78.9382(5) 3_565 . 2_665 N H10 H12 H16 144.1165(11) 3_565 . 3_565 N H10 H12 C13 132.68370(20) 3_565 . -201_565 N H10 H12 C13 126.318 3_565 . -203_555 N H10 H12 C14 62.4976(17) 3_565 . -202_455 N H10 H12 C16 45.7048(13) 3_565 . -201_565 N H10 H12 H26 149.9641(7) 3_565 . -203_555 N H10 H12 H28 25.8878(8) 3_565 . -202_455 N H10 H12 H33 6.70660(20) 3_565 . -201_565 N H15 H12 H16 103.5085(6) 2_665 . 3_565 N H15 H12 C13 135.56020(30) 2_665 . -201_565 N H15 H12 C13 79.8398 2_665 . -203_555 N H15 H12 C14 81.79710(30) 2_665 . -202_455 N H15 H12 C16 73.8392(6) 2_665 . -201_565 N H15 H12 H26 73.55510(20) 2_665 . -203_555 N H15 H12 H28 84.8979(4) 2_665 . -202_455 N H15 H12 H33 81.0379(5) 2_665 . -201_565 N H16 H12 C13 69.7610(5) 3_565 . -201_565 N H16 H12 C13 88.7943(10) 3_565 . -203_555 N H16 H12 C14 153.2041(6) 3_565 . -202_455 N H16 H12 C16 169.83260(30) 3_565 . -201_565 N H16 H12 H26 56.8176(16) 3_565 . -203_555 N H16 H12 H28 166.1147(4) 3_565 . -202_455 N H16 H12 H33 150.0506(10) 3_565 . -201_565 N C13 H12 C13 56.67910(20) -201_565 . -203_555 N C13 H12 C14 87.9163(10) -201_565 . -202_455 N C13 H12 C16 104.9828(6) -201_565 . -201_565 N C13 H12 H26 66.2921(4) -201_565 . -203_555 N C13 H12 H28 111.9820(4) -201_565 . -202_455 N C13 H12 H33 127.17030(10) -201_565 . -201_565 N C13 H12 C14 66.0225(16) -203_555 . -202_455 N C13 H12 C16 81.0877(13) -203_555 . -201_565 N C13 H12 H26 36.8817(4) -203_555 . -203_555 N C13 H12 H28 103.7128(6) -203_555 . -202_455 N C13 H12 H33 121.01550(10) -203_555 . -201_565 N C14 H12 C16 18.0637(4) -202_455 . -201_565 N C14 H12 H26 101.2553(20) -202_455 . -203_555 N C14 H12 H28 37.8307(9) -202_455 . -202_455 N C14 H12 H33 56.2763(15) -202_455 . -201_565 N C16 H12 H26 113.2864(19) -201_565 . -203_555 N C16 H12 H28 23.6973(7) -201_565 . -202_455 N C16 H12 H33 39.9759(12) -201_565 . -201_565 N H26 H12 H28 136.9789(12) -203_555 . -202_455 N H26 H12 H33 148.5898(8) -203_555 . -201_565 N H28 H12 H33 19.2366(6) -202_455 . -201_565 N C6 H13 C7 35.4801(4) 1_555 . 2_665 N C6 H13 N3 44.30620(10) 1_555 . 2_665 N C6 H13 H11 64.3619(12) 1_555 . 3_565 N C6 H13 H14 92.0847(19) 1_555 . 2_665 N C6 H13 H15 56.15350(10) 1_555 . 2_665 N C6 H13 H17 105.5489(16) 1_555 . 3_565 N C6 H13 C13 55.9598(9) 1_555 . -203_555 N C6 H13 C14 21.29600(10) 1_555 . -202_455 N C6 H13 H25 95.1259(17) 1_555 . -201_565 N C6 H13 H26 57.2330(14) 1_555 . -203_555 N C6 H13 H27 136.65630(30) 1_555 . -203_555 N C6 H13 H29 61.0397(12) 1_555 . -202_455 N C6 H13 H32 64.3131(12) 1_555 . -201_565 N C7 H13 N3 72.3625(6) 2_665 . 2_665 N C7 H13 H11 28.9128(8) 2_665 . 3_565 N C7 H13 H14 57.9573(15) 2_665 . 2_665 N C7 H13 H15 50.1689(4) 2_665 . 2_665 N C7 H13 H17 130.0932(16) 2_665 . 3_565 N C7 H13 C13 90.5090(5) 2_665 . -203_555 N C7 H13 C14 15.4469(4) 2_665 . -202_455 N C7 H13 H25 112.2454(19) 2_665 . -201_565 N C7 H13 H26 78.8468(14) 2_665 . -203_555 N C7 H13 H27 127.3719(6) 2_665 . -203_555 N C7 H13 H29 29.8632(9) 2_665 . -202_455 N C7 H13 H32 29.0580(8) 2_665 . -201_565 N N3 H13 H11 96.3303(13) 2_665 . 3_565 N N3 H13 H14 111.1064(15) 2_665 . 2_665 N N3 H13 H15 98.26210(30) 2_665 . 2_665 N N3 H13 H17 98.8625(8) 2_665 . 3_565 N N3 H13 C13 26.5641(8) 2_665 . -203_555 N N3 H13 C14 57.41430(20) 2_665 . -202_455 N N3 H13 H25 103.7276(6) 2_665 . -201_565 N N3 H13 H26 76.9296(4) 2_665 . -203_555 N N3 H13 H27 99.28790(10) 2_665 . -203_555 N N3 H13 H29 83.3965(10) 2_665 . -202_455 N N3 H13 H32 99.2871(13) 2_665 . -201_565 N H11 H13 H14 30.5362(7) 3_565 . 2_665 N H11 H13 H15 59.37200(10) 3_565 . 2_665 N H11 H13 H17 142.6312(12) 3_565 . 3_565 N H11 H13 C13 118.24090(30) 3_565 . -203_555 N H11 H13 C14 43.6116(12) 3_565 . -202_455 N H11 H13 H25 122.5149(16) 3_565 . -201_565 N H11 H13 H26 99.8108(8) 3_565 . -203_555 N H11 H13 H27 108.546 3_565 . -203_555 N H11 H13 H29 17.6748(5) 3_565 . -202_455 N H11 H13 H32 6.03610(10) 3_565 . -201_565 N H14 H13 H15 84.7124(6) 2_665 . 2_665 N H14 H13 H17 149.3300(7) 2_665 . 3_565 N H14 H13 C13 137.5379(7) 2_665 . -203_555 N H14 H13 C14 70.7991(18) 2_665 . -202_455 N H14 H13 H25 136.4203(10) 2_665 . -201_565 N H14 H13 H26 128.23241(10) 2_665 . -203_555 N H14 H13 H27 79.6458(7) 2_665 . -203_555 N H14 H13 H29 31.6330(7) 2_665 . -202_455 N H14 H13 H32 33.8079(8) 2_665 . -201_565 N H15 H13 H17 84.6909(10) 2_665 . 3_565 N H15 H13 C13 96.29290(10) 2_665 . -203_555 N H15 H13 C14 55.32290(10) 2_665 . -202_455 N H15 H13 H25 64.6889(14) 2_665 . -201_565 N H15 H13 H26 44.0155(7) 2_665 . -203_555 N H15 H13 H27 159.7717 2_665 . -203_555 N H15 H13 H29 73.25680(30) 2_665 . -202_455 N H15 H13 H32 53.88330(20) 2_665 . -201_565 N H17 H13 C13 72.3097 3_565 . -203_555 N H17 H13 C14 124.1344(17) 3_565 . -202_455 N H17 H13 H25 20.2249(4) 3_565 . -201_565 N H17 H13 H26 51.66720(10) 3_565 . -203_555 N H17 H13 H27 102.4028(10) 3_565 . -203_555 N H17 H13 H29 157.9111(7) 3_565 . -202_455 N H17 H13 H32 136.6247(13) 3_565 . -201_565 N C13 H13 C14 75.1464(9) -203_555 . -202_455 N C13 H13 H25 78.96760(20) -203_555 . -201_565 N C13 H13 H26 60.70610(10) -203_555 . -203_555 N C13 H13 H27 103.90140(10) -203_555 . -203_555 N C13 H13 H29 108.25450(10) -203_555 . -202_455 N C13 H13 H32 119.51600(30) -203_555 . -201_565 N C14 H13 H25 109.8765(19) -202_455 . -201_565 N C14 H13 H26 72.9508(15) -202_455 . -203_555 N C14 H13 H27 129.0038(5) -202_455 . -203_555 N C14 H13 H29 40.0265(12) -202_455 . -202_455 N C14 H13 H32 44.3700(12) -202_455 . -201_565 N H25 H13 H26 37.91950(30) -201_565 . -203_555 N H25 H13 H27 120.0894(13) -201_565 . -203_555 N H25 H13 H29 137.9076(11) -201_565 . -202_455 N H25 H13 H32 116.5478(17) -201_565 . -201_565 N H26 H13 H27 151.6426(8) -203_555 . -203_555 N H26 H13 H29 108.4353(5) -203_555 . -202_455 N H26 H13 H32 95.2969(9) -203_555 . -201_565 N H27 H13 H29 98.86930(30) -203_555 . -202_455 N H27 H13 H32 113.00020(10) -203_555 . -201_565 N H29 H13 H32 23.5077(6) -202_455 . -201_565 N C8 C11 C9 71.5361(6) -203_555 . -201_565 N C8 C11 C9 49.1770(4) -203_555 . -202_455 N C8 C11 C9 61.1853(14) -203_555 . -203_555 N C8 C11 C10 124.9600(15) -203_555 . 1_555 N C8 C11 C10 158.0879(6) -203_555 . 2_665 N C8 C11 C10 125.6371(7) -203_555 . -201_565 N C8 C11 C10 107.7877(12) -203_555 . -202_455 N C8 C11 C10 155.9659(8) -203_555 . -203_555 N C8 C11 H18 80.8333(14) -203_555 . -203_555 N C8 C11 H19 59.33360(30) -203_555 . -201_565 N C8 C11 H19 30.4262(10) -203_555 . -202_455 N C8 C11 H20 125.7578(11) -203_555 . -203_555 N C8 C11 H21 151.9357(10) -203_555 . 2_665 N C8 C11 H21 151.8611(5) -203_555 . -201_565 N C8 C11 H21 112.7445(16) -203_555 . -203_555 N C8 C11 C11 96.06140(20) -203_555 . 2_665 N C8 C11 C11 79.5433(4) -203_555 . 3_565 N C8 C11 C12 15.5539(4) -203_555 . 1_555 N C8 C11 C12 45.3776(14) -203_555 . 2_665 N C8 C11 H22 110.22450(30) -203_555 . 1_555 N C8 C11 H22 78.7370(8) -203_555 . 3_565 N C8 C11 H23 95.0148 -203_555 . 1_555 N C8 C11 H24 8.14260(30) -203_555 . 2_665 N C9 C11 C9 46.24640(20) -201_565 . -202_455 N C9 C11 C9 42.98720(10) -201_565 . -203_555 N C9 C11 C10 89.0051(11) -201_565 . 1_555 N C9 C11 C10 88.6414(12) -201_565 . 2_665 N C9 C11 C10 54.9379(13) -201_565 . -201_565 N C9 C11 C10 57.2704(12) -201_565 . -202_455 N C9 C11 C10 108.8912(6) -201_565 . -203_555 N C9 C11 H18 80.3879(5) -201_565 . -203_555 N C9 C11 H19 39.22640(20) -201_565 . -201_565 N C9 C11 H19 70.9207(6) -201_565 . -202_455 N C9 C11 H20 158.6883(4) -201_565 . -203_555 N C9 C11 H21 123.34160(10) -201_565 . 2_665 N C9 C11 H21 92.4191(9) -201_565 . -201_565 N C9 C11 H21 90.1100(8) -201_565 . -203_555 N C9 C11 C11 29.2784(4) -201_565 . 2_665 N C9 C11 C11 41.08560(20) -201_565 . 3_565 N C9 C11 C12 58.60090(30) -201_565 . 1_555 N C9 C11 C12 47.634 -201_565 . 2_665 N C9 C11 H22 68.13120(20) -201_565 . 1_555 N C9 C11 H22 84.03060(20) -201_565 . 3_565 N C9 C11 H23 161.1944(5) -201_565 . 1_555 N C9 C11 H24 73.4007(7) -201_565 . 2_665 N C9 C11 C9 73.9898(10) -202_455 . -203_555 N C9 C11 C10 79.9307(18) -202_455 . 1_555 N C9 C11 C10 121.8411(7) -202_455 . 2_665 N C9 C11 C10 92.9548(9) -202_455 . -201_565 N C9 C11 C10 58.6543(17) -202_455 . -202_455 N C9 C11 C10 112.9023(11) -202_455 . -203_555 N C9 C11 H18 112.3339(13) -202_455 . -203_555 N C9 C11 H19 11.34970(10) -202_455 . -201_565 N C9 C11 H19 71.8387(12) -202_455 . -202_455 N C9 C11 H20 132.3543(5) -202_455 . -203_555 N C9 C11 H21 120.8834(8) -202_455 . 2_665 N C9 C11 H21 132.2279(5) -202_455 . -201_565 N C9 C11 H21 71.2070(18) -202_455 . -203_555 N C9 C11 C11 74.71140(10) -202_455 . 2_665 N C9 C11 C11 30.7991(8) -202_455 . 3_565 N C9 C11 C12 34.3914 -202_455 . 1_555 N C9 C11 C12 65.9960(9) -202_455 . 2_665 N C9 C11 H22 114.008 -202_455 . 1_555 N C9 C11 H22 45.7834(7) -202_455 . 3_565 N C9 C11 H23 132.96060(30) -202_455 . 1_555 N C9 C11 H24 56.3044(7) -202_455 . 2_665 N C9 C11 C10 130.2673(10) -203_555 . 1_555 N C9 C11 C10 98.0002(20) -203_555 . 2_665 N C9 C11 C10 72.7274(19) -203_555 . -201_565 N C9 C11 C10 99.2784(11) -203_555 . -202_455 N C9 C11 C10 135.8431(9) -203_555 . -203_555 N C9 C11 H18 39.86130(30) -203_555 . -203_555 N C9 C11 H19 73.5288(6) -203_555 . -201_565 N C9 C11 H19 39.9509(7) -203_555 . -202_455 N C9 C11 H20 152.4025(4) -203_555 . -203_555 N C9 C11 H21 146.5681(5) -203_555 . 2_665 N C9 C11 H21 91.2058(19) -203_555 . -201_565 N C9 C11 H21 133.0845(7) -203_555 . -203_555 N C9 C11 C11 45.0562(9) -203_555 . 2_665 N C9 C11 C11 82.87640(10) -203_555 . 3_565 N C9 C11 C12 59.0627(13) -203_555 . 1_555 N C9 C11 C12 15.90300(10) -203_555 . 2_665 N C9 C11 H22 50.2505(11) -203_555 . 1_555 N C9 C11 H22 119.65040(20) -203_555 . 3_565 N C9 C11 H23 119.1813(4) -203_555 . 1_555 N C9 C11 H24 56.8849(13) -203_555 . 2_665 N C10 C11 C10 61.8925(16) 1_555 . 2_665 N C10 C11 C10 67.1123(10) 1_555 . -201_565 N C10 C11 C10 31.74610(10) 1_555 . -202_455 N C10 C11 C10 33.1659(8) 1_555 . -203_555 N C10 C11 H18 147.31190(10) 1_555 . -203_555 N C10 C11 H19 72.9710(16) 1_555 . -201_565 N C10 C11 H19 151.7535(6) 1_555 . -202_455 N C10 C11 H20 70.9476(14) 1_555 . -203_555 N C10 C11 H21 42.0471(11) 1_555 . 2_665 N C10 C11 H21 76.0660(18) 1_555 . -201_565 N C10 C11 H21 13.61880(10) 1_555 . -203_555 N C10 C11 C11 87.67000(10) 1_555 . 2_665 N C10 C11 C11 55.3640(9) 1_555 . 3_565 N C10 C11 C12 113.0782(19) 1_555 . 1_555 N C10 C11 C12 136.2248(11) 1_555 . 2_665 N C10 C11 H22 108.6872(7) 1_555 . 1_555 N C10 C11 H22 47.6522(7) 1_555 . 3_565 N C10 C11 H23 109.6778(6) 1_555 . 1_555 N C10 C11 H24 133.0912(13) 1_555 . 2_665 N C10 C11 C10 33.70690(20) 2_665 . -201_565 N C10 C11 C10 66.6002(10) 2_665 . -202_455 N C10 C11 C10 39.8037(12) 2_665 . -203_555 N C10 C11 H18 86.8547(16) 2_665 . -203_555 N C10 C11 H19 110.5109(6) 2_665 . -201_565 N C10 C11 H19 134.2679(14) 2_665 . -202_455 N C10 C11 H20 75.7550(17) 2_665 . -203_555 N C10 C11 H21 48.5802(15) 2_665 . 2_665 N C10 C11 H21 14.59590(20) 2_665 . -201_565 N C10 C11 H21 75.4875(17) 2_665 . -203_555 N C10 C11 C11 62.3923(8) 2_665 . 2_665 N C10 C11 C11 91.7519 2_665 . 3_565 N C10 C11 C12 147.2423(9) 2_665 . 1_555 N C10 C11 C12 113.8967(19) 2_665 . 2_665 N C10 C11 H22 51.6164(7) 2_665 . 1_555 N C10 C11 H22 109.1415(9) 2_665 . 3_565 N C10 C11 H23 101.8286(4) 2_665 . 1_555 N C10 C11 H24 154.8743(7) 2_665 . 2_665 N C10 C11 C10 51.6987(5) -201_565 . -202_455 N C10 C11 C10 63.5560(10) -201_565 . -203_555 N C10 C11 H18 81.6750(11) -201_565 . -203_555 N C10 C11 H19 81.9894(8) -201_565 . -201_565 N C10 C11 H19 112.6726(11) -201_565 . -202_455 N C10 C11 H20 108.5071(18) -201_565 . -203_555 N C10 C11 H21 76.5275(15) -201_565 . 2_665 N C10 C11 H21 39.5874(4) -201_565 . -201_565 N C10 C11 H21 78.6362(11) -201_565 . -203_555 N C10 C11 C11 30.1092(9) -201_565 . 2_665 N C10 C11 C11 67.13590(20) -201_565 . 3_565 N C10 C11 C12 113.5375(11) -201_565 . 1_555 N C10 C11 C12 87.3175(18) -201_565 . 2_665 N C10 C11 H22 43.92880(30) -201_565 . 1_555 N C10 C11 H22 102.56710(30) -201_565 . 3_565 N C10 C11 H23 133.7339(6) -201_565 . 1_555 N C10 C11 H24 125.4895(7) -201_565 . 2_665 N C10 C11 C10 58.1166(7) -202_455 . -203_555 N C10 C11 H18 128.8222(4) -202_455 . -203_555 N C10 C11 H19 48.5939(15) -202_455 . -201_565 N C10 C11 H19 124.3879(7) -202_455 . -202_455 N C10 C11 H20 102.5379(16) -202_455 . -203_555 N C10 C11 H21 70.6850(12) -202_455 . 2_665 N C10 C11 H21 80.3546(12) -202_455 . -201_565 N C10 C11 H21 34.94560(30) -202_455 . -203_555 N C10 C11 C11 60.88220(30) -202_455 . 2_665 N C10 C11 C11 28.4423(9) -202_455 . 3_565 N C10 C11 C12 92.6202(16) -202_455 . 1_555 N C10 C11 C12 104.5842(12) -202_455 . 2_665 N C10 C11 H22 94.88040(20) -202_455 . 1_555 N C10 C11 H22 50.86840(20) -202_455 . 3_565 N C10 C11 H23 141.3327(7) -202_455 . 1_555 N C10 C11 H24 114.5575(10) -202_455 . 2_665 N C10 C11 H18 123.1837(6) -203_555 . -203_555 N C10 C11 H19 105.0195(8) -203_555 . -201_565 N C10 C11 H19 173.58051(20) -203_555 . -202_455 N C10 C11 H20 50.0205(10) -203_555 . -203_555 N C10 C11 H21 14.4929(5) -203_555 . 2_665 N C10 C11 H21 50.6523(13) -203_555 . -201_565 N C10 C11 H21 44.0266(8) -203_555 . -203_555 N C10 C11 C11 92.92110(10) -203_555 . 2_665 N C10 C11 C11 85.81440(10) -203_555 . 3_565 N C10 C11 C12 146.1638(11) -203_555 . 1_555 N C10 C11 C12 150.8735(8) -203_555 . 2_665 N C10 C11 H22 91.3046(4) -203_555 . 1_555 N C10 C11 H22 77.44170(10) -203_555 . 3_565 N C10 C11 H23 88.79520(10) -203_555 . 1_555 N C10 C11 H24 163.5841(6) -203_555 . 2_665 N H18 C11 H19 113.2796(9) -203_555 . -201_565 N H18 C11 H19 50.41000(30) -203_555 . -202_455 N H18 C11 H20 112.5427(7) -203_555 . -203_555 N H18 C11 H21 122.8443(6) -203_555 . 2_665 N H18 C11 H21 73.6211(18) -203_555 . -201_565 N H18 C11 H21 160.1779 -203_555 . -203_555 N H18 C11 C11 68.13040(20) -203_555 . 2_665 N H18 C11 C11 121.46290(20) -203_555 . 3_565 N H18 C11 C12 87.5605(15) -203_555 . 1_555 N H18 C11 C12 46.46460(30) -203_555 . 2_665 N H18 C11 H22 38.7319(8) -203_555 . 1_555 N H18 C11 H22 157.3883(6) -203_555 . 3_565 N H18 C11 H23 84.59370(10) -203_555 . 1_555 N H18 C11 H24 73.1524(11) -203_555 . 2_665 N H19 C11 H19 78.9965(10) -201_565 . -202_455 N H19 C11 H20 133.99910(20) -201_565 . -203_555 N H19 C11 H21 114.9410(5) -201_565 . 2_665 N H19 C11 H21 121.0081(4) -201_565 . -201_565 N H19 C11 H21 66.2151(14) -201_565 . -203_555 N H19 C11 C11 66.06080(10) -201_565 . 2_665 N H19 C11 C11 20.2138(6) -201_565 . 3_565 N H19 C11 C12 44.03350(10) -201_565 . 1_555 N H19 C11 C12 68.5591(6) -201_565 . 2_665 N H19 C11 H22 107.18960(10) -201_565 . 1_555 N H19 C11 H22 46.8182(4) -201_565 . 3_565 N H19 C11 H23 143.36110(20) -201_565 . 1_555 N H19 C11 H24 65.9650(5) -201_565 . 2_665 N H19 C11 H20 130.3887(10) -202_455 . -203_555 N H19 C11 H21 164.9025(5) -202_455 . 2_665 N H19 C11 H21 123.0196(15) -202_455 . -201_565 N H19 C11 H21 141.8000(6) -202_455 . -203_555 N H19 C11 C11 84.09720(20) -202_455 . 2_665 N H19 C11 C11 97.53940(30) -202_455 . 3_565 N H19 C11 C12 39.4422(13) -202_455 . 1_555 N H19 C11 C12 25.9699(7) -202_455 . 2_665 N H19 C11 H22 82.6626(6) -202_455 . 1_555 N H19 C11 H22 108.79060(30) -202_455 . 3_565 N H19 C11 H23 90.77970(10) -202_455 . 1_555 N H19 C11 H24 22.8307(8) -202_455 . 2_665 N H20 C11 H21 35.5285(5) -203_555 . 2_665 N H20 C11 H21 76.1406(15) -203_555 . -201_565 N H20 C11 H21 72.1551(12) -203_555 . -203_555 N H20 C11 C11 138.1334(9) -203_555 . 2_665 N H20 C11 C11 123.6731(6) -203_555 . 3_565 N H20 C11 C12 135.5679(8) -203_555 . 1_555 N H20 C11 C12 152.8268(4) -203_555 . 2_665 N H20 C11 H22 110.7209(6) -203_555 . 1_555 N H20 C11 H22 87.44800(20) -203_555 . 3_565 N H20 C11 H23 39.8470(8) -203_555 . 1_555 N H20 C11 H24 125.6445(11) -203_555 . 2_665 N H21 C11 H21 56.1389(15) 2_665 . -201_565 N H21 C11 H21 49.6836(10) 2_665 . -203_555 N H21 C11 C11 106.4254(6) 2_665 . 2_665 N H21 C11 C11 97.13340(20) 2_665 . 3_565 N H21 C11 C12 149.5246(9) 2_665 . 1_555 N H21 C11 C12 162.4709(4) 2_665 . 2_665 N H21 C11 H22 97.7621(6) 2_665 . 1_555 N H21 C11 H22 79.5221 2_665 . 3_565 N H21 C11 H23 74.5594(4) 2_665 . 1_555 N H21 C11 H24 156.4985(8) 2_665 . 2_665 N H21 C11 H21 89.5781(19) -201_565 . -203_555 N H21 C11 C11 63.7160(5) -201_565 . 2_665 N H21 C11 C11 103.78680(30) -201_565 . 3_565 N H21 C11 C12 148.1385(7) -201_565 . 1_555 N H21 C11 C12 106.7859(19) -201_565 . 2_665 N H21 C11 H22 41.6401(8) -201_565 . 1_555 N H21 C11 H22 123.5703(11) -201_565 . 3_565 N H21 C11 H23 94.14650(20) -201_565 . 1_555 N H21 C11 H24 145.5718(7) -201_565 . 2_665 N H21 C11 C11 95.25000(10) -203_555 . 2_665 N H21 C11 C11 51.6203(7) -203_555 . 3_565 N H21 C11 C12 102.3596(18) -203_555 . 1_555 N H21 C11 C12 133.9914(8) -203_555 . 2_665 N H21 C11 H22 121.4905(8) -203_555 . 1_555 N H21 C11 H22 34.4051(8) -203_555 . 3_565 N H21 C11 H23 107.5257(4) -203_555 . 1_555 N H21 C11 H24 120.8654(13) -203_555 . 2_665 N C11 C11 C11 60.0 2_665 . 3_565 N C11 C11 C12 85.62800(10) 2_665 . 1_555 N C11 C11 C12 58.1830(9) 2_665 . 2_665 N C11 C11 H22 42.2048 2_665 . 1_555 N C11 C11 H22 104.4934 2_665 . 3_565 N C11 C11 H23 148.368 2_665 . 1_555 N C11 C11 H24 95.39800(20) 2_665 . 2_665 N C11 C11 C12 64.2344(8) 3_565 . 1_555 N C11 C11 C12 82.50390(20) 3_565 . 2_665 N C11 C11 H22 101.8881 3_565 . 1_555 N C11 C11 H22 44.8294 3_565 . 3_565 N C11 C11 H23 151.4928 3_565 . 1_555 N C11 C11 H24 86.13280(10) 3_565 . 2_665 N C12 C11 C12 44.7658(13) 1_555 . 2_665 N C12 C11 H22 109.22160(20) 1_555 . 1_555 N C12 C11 H22 70.2956(10) 1_555 . 3_565 N C12 C11 H23 109.7302(4) 1_555 . 1_555 N C12 C11 H24 21.9756(7) 1_555 . 2_665 N C12 C11 H22 65.3865(10) 2_665 . 1_555 N C12 C11 H22 111.11210(20) 2_665 . 3_565 N C12 C11 H23 113.5606(5) 2_665 . 1_555 N C12 C11 H24 40.9993(12) 2_665 . 2_665 N H22 C11 H22 144.86700(10) 1_555 . 3_565 N H22 C11 H23 106.2076 1_555 . 1_555 N H22 C11 H24 104.34850(10) 1_555 . 2_665 N H22 C11 H23 106.6972 3_565 . 1_555 N H22 C11 H24 86.7733(5) 3_565 . 2_665 N H23 C11 H24 91.48790(10) 1_555 . 2_665 N C8 C12 C8 68.48310(10) -201_565 . -202_455 N C8 C12 C8 88.1868(5) -201_565 . -203_555 N C8 C12 C9 58.8615(9) -201_565 . -201_565 N C8 C12 C9 103.74430(30) -201_565 . -202_455 N C8 C12 C9 53.7103(13) -201_565 . -203_555 N C8 C12 H16 108.00770(20) -201_565 . -203_555 N C8 C12 H17 152.9334(4) -201_565 . -203_555 N C8 C12 H18 159.3676(5) -201_565 . -202_455 N C8 C12 H19 102.3671(4) -201_565 . -201_565 N C8 C12 H19 72.1526(10) -201_565 . -202_455 N C8 C12 C11 85.0783(9) -201_565 . 1_555 N C8 C12 C11 99.3019(5) -201_565 . 3_565 N C8 C12 C12 13.5712(4) -201_565 . 2_665 N C8 C12 C12 54.07710(10) -201_565 . 3_565 N C8 C12 C13 49.84960(30) -201_565 . 1_555 N C8 C12 C13 87.3191(7) -201_565 . 3_565 N C8 C12 H22 119.44710(20) -201_565 . 3_565 N C8 C12 H24 82.2122 -201_565 . 1_555 N C8 C12 H24 70.63860(10) -201_565 . 2_665 N C8 C12 H24 16.59050(30) -201_565 . 3_565 N C8 C12 H25 159.0447(6) -201_565 . 1_555 N C8 C12 H26 112.1278(13) -201_565 . 3_565 N C8 C12 C8 124.2544(15) -202_455 . -203_555 N C8 C12 C9 54.5769(12) -202_455 . -201_565 N C8 C12 C9 87.0086(11) -202_455 . -202_455 N C8 C12 C9 98.1133(5) -202_455 . -203_555 N C8 C12 H16 154.2767(9) -202_455 . -203_555 N C8 C12 H17 87.04930(10) -202_455 . -203_555 N C8 C12 H18 114.11540(30) -202_455 . -202_455 N C8 C12 H19 64.0605(14) -202_455 . -201_565 N C8 C12 H19 120.65200(10) -202_455 . -202_455 N C8 C12 C11 118.26600(10) -202_455 . 1_555 N C8 C12 C11 72.5995(14) -202_455 . 3_565 N C8 C12 C12 77.7215 -202_455 . 2_665 N C8 C12 C12 22.28660(30) -202_455 . 3_565 N C8 C12 C13 90.4115(8) -202_455 . 1_555 N C8 C12 C13 54.37920(10) -202_455 . 3_565 N C8 C12 H22 111.79460(20) -202_455 . 3_565 N C8 C12 H24 19.0688(4) -202_455 . 1_555 N C8 C12 H24 138.91750(10) -202_455 . 2_665 N C8 C12 H24 60.88030(10) -202_455 . 3_565 N C8 C12 H25 114.14980(20) -202_455 . 1_555 N C8 C12 H26 103.5825(12) -202_455 . 3_565 N C8 C12 C9 145.9940(4) -203_555 . -201_565 N C8 C12 C9 148.6819(4) -203_555 . -202_455 N C8 C12 C9 107.4595(12) -203_555 . -203_555 N C8 C12 H16 31.3965(5) -203_555 . -203_555 N C8 C12 H17 96.79330(30) -203_555 . -203_555 N C8 C12 H18 104.9298(11) -203_555 . -202_455 N C8 C12 H19 168.87230(10) -203_555 . -201_565 N C8 C12 H19 96.2911(17) -203_555 . -202_455 N C8 C12 C11 108.5811(17) -203_555 . 1_555 N C8 C12 C11 163.14470(10) -203_555 . 3_565 N C8 C12 C12 90.7132 -203_555 . 2_665 N C8 C12 C12 131.7091(8) -203_555 . 3_565 N C8 C12 C13 41.7118(8) -203_555 . 1_555 N C8 C12 C13 75.5576(18) -203_555 . 3_565 N C8 C12 H22 123.6354(12) -203_555 . 3_565 N C8 C12 H24 140.7830(10) -203_555 . 1_555 N C8 C12 H24 49.7893(9) -203_555 . 2_665 N C8 C12 H24 104.62960(20) -203_555 . 3_565 N C8 C12 H25 73.13890(10) -203_555 . 1_555 N C8 C12 H26 39.1310(7) -203_555 . 3_565 N C9 C12 C9 48.9938(7) -201_565 . -202_455 N C9 C12 C9 47.6930(6) -201_565 . -203_555 N C9 C12 H16 146.94299(20) -201_565 . -203_555 N C9 C12 H17 116.28600(10) -201_565 . -203_555 N C9 C12 H18 104.8143(15) -201_565 . -202_455 N C9 C12 H19 43.7995(6) -201_565 . -201_565 N C9 C12 H19 67.4455(10) -201_565 . -202_455 N C9 C12 C11 63.8793(11) -201_565 . 1_555 N C9 C12 C11 40.8958(5) -201_565 . 3_565 N C9 C12 C12 55.2813(4) -201_565 . 2_665 N C9 C12 C12 34.3946(9) -201_565 . 3_565 N C9 C12 C13 108.1938(12) -201_565 . 1_555 N C9 C12 C13 108.2286(13) -201_565 . 3_565 N C9 C12 H22 73.0657(15) -201_565 . 3_565 N C9 C12 H24 49.5428(4) -201_565 . 1_555 N C9 C12 H24 105.92110(30) -201_565 . 2_665 N C9 C12 H24 42.2760(6) -201_565 . 3_565 N C9 C12 H25 140.75130(30) -201_565 . 1_555 N C9 C12 H26 157.71 -201_565 . 3_565 N C9 C12 C9 61.2279(13) -202_455 . -203_555 N C9 C12 H16 117.98930(10) -202_455 . -203_555 N C9 C12 H17 85.6405(5) -202_455 . -203_555 N C9 C12 H18 57.0956(9) -202_455 . -202_455 N C9 C12 H19 25.0891(4) -202_455 . -201_565 N C9 C12 H19 61.5080(16) -202_455 . -202_455 N C9 C12 C11 45.5638(14) -202_455 . 1_555 N C9 C12 C11 14.51150(30) -202_455 . 3_565 N C9 C12 C12 94.86100(20) -202_455 . 2_665 N C9 C12 C12 76.4378(4) -202_455 . 3_565 N C9 C12 C13 151.8356(6) -202_455 . 1_555 N C9 C12 C13 132.9267(15) -202_455 . 3_565 N C9 C12 H22 26.0685(9) -202_455 . 3_565 N C9 C12 H24 70.2758(6) -202_455 . 1_555 N C9 C12 H24 106.6020(7) -202_455 . 2_665 N C9 C12 H24 88.2817 -202_455 . 3_565 N C9 C12 H25 97.18910(30) -202_455 . 1_555 N C9 C12 H26 144.0490(9) -202_455 . 3_565 N C9 C12 H16 99.4357(4) -203_555 . -203_555 N C9 C12 H17 145.9400(8) -203_555 . -203_555 N C9 C12 H18 106.4007(19) -203_555 . -202_455 N C9 C12 H19 76.7589(15) -203_555 . -201_565 N C9 C12 H19 23.2876(4) -203_555 . -202_455 N C9 C12 C11 31.6371(4) -203_555 . 1_555 N C9 C12 C11 66.4594(14) -203_555 . 3_565 N C9 C12 C12 40.5481(10) -203_555 . 2_665 N C9 C12 C12 75.82680(20) -203_555 . 3_565 N C9 C12 C13 91.4893(20) -203_555 . 1_555 N C9 C12 C13 140.1489(7) -203_555 . 3_565 N C9 C12 H22 67.2119(16) -203_555 . 3_565 N C9 C12 H24 97.12340(20) -203_555 . 1_555 N C9 C12 H24 59.3493(4) -203_555 . 2_665 N C9 C12 H24 46.7351(7) -203_555 . 3_565 N C9 C12 H25 140.6491(5) -203_555 . 1_555 N C9 C12 H26 146.5889(5) -203_555 . 3_565 N H16 C12 H17 88.85600(10) -203_555 . -203_555 N H16 C12 H18 78.5160(6) -203_555 . -202_455 N H16 C12 H19 138.7453(4) -203_555 . -201_565 N H16 C12 H19 79.7534(8) -203_555 . -202_455 N H16 C12 C11 85.9330(8) -203_555 . 1_555 N H16 C12 C11 132.0581(5) -203_555 . 3_565 N H16 C12 C12 104.2464 -203_555 . 2_665 N H16 C12 C12 160.86411(20) -203_555 . 3_565 N H16 C12 C13 70.51130(20) -203_555 . 1_555 N H16 C12 C13 100.6705(11) -203_555 . 3_565 N H16 C12 H22 92.3525(7) -203_555 . 3_565 N H16 C12 H24 163.43761(20) -203_555 . 1_555 N H16 C12 H24 43.62760(10) -203_555 . 2_665 N H16 C12 H24 121.7206 -203_555 . 3_565 N H16 C12 H25 59.92220(10) -203_555 . 1_555 N H16 C12 H26 52.88680(20) -203_555 . 3_565 N H17 C12 H18 42.7640(10) -203_555 . -202_455 N H17 C12 H19 75.4299(6) -203_555 . -201_565 N H17 C12 H19 133.1060(6) -203_555 . -202_455 N H17 C12 C11 117.9043(5) -203_555 . 1_555 N H17 C12 C11 83.4237(5) -203_555 . 3_565 N H17 C12 C12 164.70570(10) -203_555 . 2_665 N H17 C12 C12 105.5202 -203_555 . 3_565 N H17 C12 C13 122.2537(11) -203_555 . 1_555 N H17 C12 C13 68.43550(30) -203_555 . 3_565 N H17 C12 H22 79.5628(7) -203_555 . 3_565 N H17 C12 H24 77.1494 -203_555 . 1_555 N H17 C12 H24 131.57 -203_555 . 2_665 N H17 C12 H24 147.6383 -203_555 . 3_565 N H17 C12 H25 29.0501 -203_555 . 1_555 N H17 C12 H26 61.2122(4) -203_555 . 3_565 N H18 C12 H19 63.9511(10) -202_455 . -201_565 N H18 C12 H19 90.3433(16) -202_455 . -202_455 N H18 C12 C11 75.7411(15) -202_455 . 1_555 N H18 C12 C11 64.0263(11) -202_455 . 3_565 N H18 C12 C12 146.9223(9) -202_455 . 2_665 N H18 C12 C12 120.6153(4) -202_455 . 3_565 N H18 C12 C13 146.40820(30) -202_455 . 1_555 N H18 C12 C13 111.1134(12) -202_455 . 3_565 N H18 C12 H22 39.93950(30) -202_455 . 3_565 N H18 C12 H24 96.50290(10) -202_455 . 1_555 N H18 C12 H24 105.54230(30) -202_455 . 2_665 N H18 C12 H24 145.3072(9) -202_455 . 3_565 N H18 C12 H25 40.7122(12) -202_455 . 1_555 N H18 C12 H26 87.5951(18) -202_455 . 3_565 N H19 C12 H19 83.8014(19) -201_565 . -202_455 N H19 C12 C11 69.3736(18) -201_565 . 1_555 N H19 C12 C11 11.81850(10) -201_565 . 3_565 N H19 C12 C12 98.74660(20) -201_565 . 2_665 N H19 C12 C12 58.9915(6) -201_565 . 3_565 N H19 C12 C13 149.4008(6) -201_565 . 1_555 N H19 C12 C13 108.0912(19) -201_565 . 3_565 N H19 C12 H22 47.7864(11) -201_565 . 3_565 N H19 C12 H24 46.0713(9) -201_565 . 1_555 N H19 C12 H24 130.4058(11) -201_565 . 2_665 N H19 C12 H24 85.816 -201_565 . 3_565 N H19 C12 H25 96.97550(30) -201_565 . 1_555 N H19 C12 H26 135.8162(9) -201_565 . 3_565 N H19 C12 C11 17.21370(20) -202_455 . 1_555 N H19 C12 C11 72.0492(18) -202_455 . 3_565 N H19 C12 C12 58.6079(6) -202_455 . 2_665 N H19 C12 C12 98.48470(20) -202_455 . 3_565 N H19 C12 C13 96.5187(20) -202_455 . 1_555 N H19 C12 C13 158.28740(30) -202_455 . 3_565 N H19 C12 H22 55.9590(14) -202_455 . 3_565 N H19 C12 H24 116.3006(6) -202_455 . 1_555 N H19 C12 H24 46.8157(8) -202_455 . 2_665 N H19 C12 H24 68.7114(4) -202_455 . 3_565 N H19 C12 H25 118.40140(10) -202_455 . 1_555 N H19 C12 H26 132.0182(10) -202_455 . 3_565 N C11 C12 C11 57.5826(17) 1_555 . 3_565 N C11 C12 C12 71.6519(5) 1_555 . 2_665 N C11 C12 C12 97.93720(20) 1_555 . 3_565 N C11 C12 C13 113.7273(18) 1_555 . 1_555 N C11 C12 C13 171.19370(20) 1_555 . 3_565 N C11 C12 H22 39.0812(12) 1_555 . 3_565 N C11 C12 H24 108.3345(6) 1_555 . 1_555 N C11 C12 H24 61.1995(7) 1_555 . 2_665 N C11 C12 H24 77.95160(30) 1_555 . 3_565 N C11 C12 H25 109.51080(10) 1_555 . 1_555 N C11 C12 H26 138.1507(11) 1_555 . 3_565 N C11 C12 C12 93.23000(10) 3_565 . 2_665 N C11 C12 C12 63.5823(7) 3_565 . 3_565 N C11 C12 C13 149.0413(7) 3_565 . 1_555 N C11 C12 C13 119.5971(18) 3_565 . 3_565 N C11 C12 H22 39.7089(12) 3_565 . 3_565 N C11 C12 H24 55.7820(9) 3_565 . 1_555 N C11 C12 H24 118.5893(9) 3_565 . 2_665 N C11 C12 H24 82.85450(10) 3_565 . 3_565 N C11 C12 H25 101.24450(20) 3_565 . 1_555 N C11 C12 H26 144.6359(9) 3_565 . 3_565 N C12 C12 C12 60.0 2_665 . 3_565 N C12 C12 C13 57.2773(8) 2_665 . 1_555 N C12 C12 C13 100.86090(30) 2_665 . 3_565 N C12 C12 H22 107.2653(6) 2_665 . 3_565 N C12 C12 H24 88.6052 2_665 . 1_555 N C12 C12 H24 62.8938 2_665 . 2_665 N C12 C12 H24 17.7245 2_665 . 3_565 N C12 C12 H25 163.44611(10) 2_665 . 1_555 N C12 C12 H26 120.8328(8) 2_665 . 3_565 N C12 C12 C13 90.908 3_565 . 1_555 N C12 C12 C13 73.9310(5) 3_565 . 3_565 N C12 C12 H22 102.4879(4) 3_565 . 3_565 N C12 C12 H24 28.6285 3_565 . 1_555 N C12 C12 H24 122.8422 3_565 . 2_665 N C12 C12 H24 42.3002 3_565 . 3_565 N C12 C12 H25 134.2117 3_565 . 1_555 N C12 C12 H26 123.3179(8) 3_565 . 3_565 N C13 C12 C13 63.8745(18) 1_555 . 3_565 N C13 C12 H22 150.5648(7) 1_555 . 3_565 N C13 C12 H24 109.4802(4) 1_555 . 1_555 N C13 C12 H24 59.3606(9) 1_555 . 2_665 N C13 C12 H24 66.2099(6) 1_555 . 3_565 N C13 C12 H25 109.3770(9) 1_555 . 1_555 N C13 C12 H26 63.5555(16) 1_555 . 3_565 N C13 C12 H22 144.9541(11) 3_565 . 3_565 N C13 C12 H24 66.1186(8) 3_565 . 1_555 N C13 C12 H24 120.1099(8) 3_565 . 2_665 N C13 C12 H24 93.5444 3_565 . 3_565 N C13 C12 H25 79.01010(20) 3_565 . 1_555 N C13 C12 H26 49.5295(13) 3_565 . 3_565 N H22 C12 H24 93.74540(20) 3_565 . 1_555 N H22 C12 H24 91.60820(20) 3_565 . 2_665 N H22 C12 H24 107.0338(6) 3_565 . 3_565 N H22 C12 H25 79.7893(9) 3_565 . 1_555 N H22 C12 H26 124.9229(16) 3_565 . 3_565 N H24 C12 H24 151.2706 1_555 . 2_665 N H24 C12 H24 70.8868 1_555 . 3_565 N H24 C12 H25 106.1287 1_555 . 1_555 N H24 C12 H26 111.5547(4) 1_555 . 3_565 N H24 C12 H24 80.5528 2_665 . 3_565 N H24 C12 H25 102.5987 2_665 . 1_555 N H24 C12 H26 87.92250(20) 2_665 . 3_565 N H24 C12 H25 172.53259(20) 3_565 . 1_555 N H24 C12 H26 127.0398(9) 3_565 . 3_565 N H25 C12 H26 47.0199(6) 1_555 . 3_565 N C6 C13 C6 91.4955(16) -201_565 . -202_455 N C6 C13 C7 100.2103(19) -201_565 . -203_555 N C6 C13 C8 123.5443(7) -201_565 . -201_565 N C6 C13 C8 75.5638(19) -201_565 . -203_555 N C6 C13 N3 67.5126(7) -201_565 . -201_565 N C6 C13 N3 39.44630(20) -201_565 . -202_455 N C6 C13 N3 22.79130(10) -201_565 . -203_555 N C6 C13 H17 150.82100(10) -201_565 . -201_565 N C6 C13 H12 40.17510(10) -201_565 . -201_565 N C6 C13 H12 120.1775(10) -201_565 . -202_455 N C6 C13 H13 125.3599(7) -201_565 . -202_455 N C6 C13 C12 79.4761(19) -201_565 . 1_555 N C6 C13 C12 120.4439(8) -201_565 . 2_665 N C6 C13 C13 81.73890(10) -201_565 . 2_665 N C6 C13 C13 34.6794(7) -201_565 . 3_565 N C6 C13 C14 84.1084(16) -201_565 . 3_565 N C6 C13 N4 44.05560(30) -201_565 . 1_555 N C6 C13 N4 55.2182(7) -201_565 . 2_665 N C6 C13 H24 95.4255(16) -201_565 . 2_665 N C6 C13 H25 163.14169(10) -201_565 . 2_665 N C6 C13 H26 144.59380(10) -201_565 . 1_555 N C6 C13 H26 42.7155(10) -201_565 . 3_565 N C6 C13 H27 105.85400(20) -201_565 . 1_555 N C6 C13 H29 94.2735(17) -201_565 . 3_565 N C6 C13 C7 26.2068(6) -202_455 . -203_555 N C6 C13 C8 98.8164(19) -202_455 . -201_565 N C6 C13 C8 163.68320(30) -202_455 . -203_555 N C6 C13 N3 50.5229(6) -202_455 . -201_565 N C6 C13 N3 77.2052(9) -202_455 . -202_455 N C6 C13 N3 71.2408(16) -202_455 . -203_555 N C6 C13 H17 116.6026(17) -202_455 . -201_565 N C6 C13 H12 109.4350(16) -202_455 . -201_565 N C6 C13 H12 37.7332(4) -202_455 . -202_455 N C6 C13 H13 77.45730(20) -202_455 . -202_455 N C6 C13 C12 152.8967(6) -202_455 . 1_555 N C6 C13 C12 120.1204(17) -202_455 . 2_665 N C6 C13 C13 73.7295(4) -202_455 . 2_665 N C6 C13 C13 108.1319(4) -202_455 . 3_565 N C6 C13 C14 10.01080(20) -202_455 . 3_565 N C6 C13 N4 47.4412(13) -202_455 . 1_555 N C6 C13 N4 40.6646(10) -202_455 . 2_665 N C6 C13 H24 167.13480(30) -202_455 . 2_665 N C6 C13 H25 98.5847(19) -202_455 . 2_665 N C6 C13 H26 66.6001(14) -202_455 . 1_555 N C6 C13 H26 133.4962(6) -202_455 . 3_565 N C6 C13 H27 99.39790(30) -202_455 . 1_555 N C6 C13 H29 44.7174(11) -202_455 . 3_565 N C7 C13 C8 112.9395(14) -203_555 . -201_565 N C7 C13 C8 164.92900(30) -203_555 . -203_555 N C7 C13 N3 76.3774(12) -203_555 . -201_565 N C7 C13 N3 99.4565(15) -203_555 . -202_455 N C7 C13 N3 85.8127(20) -203_555 . -203_555 N C7 C13 H17 108.5460(20) -203_555 . -201_565 N C7 C13 H12 100.4458(12) -203_555 . -201_565 N C7 C13 H12 51.1119 -203_555 . -202_455 N C7 C13 H13 52.4030(4) -203_555 . -202_455 N C7 C13 C12 179.1023 -203_555 . 1_555 N C7 C13 C12 131.0210(13) -203_555 . 2_665 N C7 C13 C13 99.45500(20) -203_555 . 2_665 N C7 C13 C13 127.3900(10) -203_555 . 3_565 N C7 C13 C14 24.1754(6) -203_555 . 3_565 N C7 C13 N4 60.5644(17) -203_555 . 1_555 N C7 C13 N4 61.6022(16) -203_555 . 2_665 N C7 C13 H24 159.0406(5) -203_555 . 2_665 N C7 C13 H25 94.6995(20) -203_555 . 2_665 N C7 C13 H26 72.6772(12) -203_555 . 1_555 N C7 C13 H26 133.0251(5) -203_555 . 3_565 N C7 C13 H27 73.25640(30) -203_555 . 1_555 N C7 C13 H29 20.5315(4) -203_555 . 3_565 N C8 C13 C8 80.7769(17) -201_565 . -203_555 N C8 C13 N3 77.3128(17) -201_565 . -201_565 N C8 C13 N3 89.2866(11) -201_565 . -202_455 N C8 C13 N3 115.1413(12) -201_565 . -203_555 N C8 C13 H17 48.3179(10) -201_565 . -201_565 N C8 C13 H12 146.13060(20) -201_565 . -201_565 N C8 C13 H12 62.9407(14) -201_565 . -202_455 N C8 C13 H13 111.0482 -201_565 . -202_455 N C8 C13 C12 66.6671(14) -201_565 . 1_555 N C8 C13 C12 21.44860(20) -201_565 . 2_665 N C8 C13 C13 49.6915(8) -201_565 . 2_665 N C8 C13 C13 90.3473 -201_565 . 3_565 N C8 C13 C14 108.5478(17) -201_565 . 3_565 N C8 C13 N4 120.6491(13) -201_565 . 1_555 N C8 C13 N4 102.7062(18) -201_565 . 2_665 N C8 C13 H24 68.3242(16) -201_565 . 2_665 N C8 C13 H25 41.6432(7) -201_565 . 2_665 N C8 C13 H26 41.65390(20) -201_565 . 1_555 N C8 C13 H26 112.5579(9) -201_565 . 3_565 N C8 C13 H27 126.3960(6) -201_565 . 1_555 N C8 C13 H29 130.5676(9) -201_565 . 3_565 N C8 C13 N3 114.1339(9) -203_555 . -201_565 N C8 C13 N3 86.4780(12) -203_555 . -202_455 N C8 C13 N3 94.0329(18) -203_555 . -203_555 N C8 C13 H17 75.3646(19) -203_555 . -201_565 N C8 C13 H12 66.8319(15) -203_555 . -201_565 N C8 C13 H12 143.46100(30) -203_555 . -202_455 N C8 C13 H13 118.07640(10) -203_555 . -202_455 N C8 C13 C12 15.78490(30) -203_555 . 1_555 N C8 C13 C12 61.1920(15) -203_555 . 2_665 N C8 C13 C13 94.28180(10) -203_555 . 2_665 N C8 C13 C13 55.6530(7) -203_555 . 3_565 N C8 C13 C14 159.41161(30) -203_555 . 3_565 N C8 C13 N4 118.8845(16) -203_555 . 1_555 N C8 C13 N4 123.2919(13) -203_555 . 2_665 N C8 C13 H24 19.87750(30) -203_555 . 2_665 N C8 C13 H25 91.9013(21) -203_555 . 2_665 N C8 C13 H26 119.1553(14) -203_555 . 1_555 N C8 C13 H26 36.6010(7) -203_555 . 3_565 N C8 C13 H27 93.7657 -203_555 . 1_555 N C8 C13 H29 144.4054(7) -203_555 . 3_565 N N3 C13 N3 32.89530(20) -201_565 . -202_455 N N3 C13 N3 46.2625(5) -201_565 . -203_555 N N3 C13 H17 123.6572(8) -201_565 . -201_565 N N3 C13 H12 106.4145(8) -201_565 . -201_565 N N3 C13 H12 55.99550(20) -201_565 . -202_455 N N3 C13 H13 127.7869(8) -201_565 . -202_455 N N3 C13 C12 102.7297(13) -201_565 . 1_555 N N3 C13 C12 94.0119(17) -201_565 . 2_665 N N3 C13 C13 30.1521(9) -201_565 . 2_665 N N3 C13 C13 63.20730(30) -201_565 . 3_565 N N3 C13 C14 53.1356(7) -201_565 . 3_565 N N3 C13 N4 43.3422(4) -201_565 . 1_555 N N3 C13 N4 25.8316 -201_565 . 2_665 N N3 C13 H24 122.9454(8) -201_565 . 2_665 N N3 C13 H25 108.9971(10) -201_565 . 2_665 N N3 C13 H26 77.1538(6) -201_565 . 1_555 N N3 C13 H26 102.95080(20) -201_565 . 3_565 N N3 C13 H27 147.1456(9) -201_565 . 1_555 N N3 C13 H29 91.9447(17) -201_565 . 3_565 N N3 C13 N3 26.08780(10) -202_455 . -203_555 N N3 C13 H17 135.51711(10) -202_455 . -201_565 N N3 C13 H12 79.4605(4) -202_455 . -201_565 N N3 C13 H12 88.7803(4) -202_455 . -202_455 N N3 C13 H13 149.5738(10) -202_455 . -202_455 N N3 C13 C12 79.7621(15) -202_455 . 1_555 N N3 C13 C12 96.2947(12) -202_455 . 2_665 N N3 C13 C13 42.55490(30) -202_455 . 2_665 N N3 C13 C13 31.4957(5) -202_455 . 3_565 N N3 C13 C14 75.5728(10) -202_455 . 3_565 N N3 C13 N4 43.4566 -202_455 . 1_555 N N3 C13 N4 37.86230(10) -202_455 . 2_665 N N3 C13 H24 101.4860(10) -202_455 . 2_665 N N3 C13 H25 130.16360(30) -202_455 . 2_665 N N3 C13 H26 106.23230(20) -202_455 . 1_555 N N3 C13 H26 70.0690(4) -202_455 . 3_565 N N3 C13 H27 143.9452(5) -202_455 . 1_555 N N3 C13 H29 107.3575(17) -202_455 . 3_565 N N3 C13 H17 161.00430(20) -203_555 . -201_565 N N3 C13 H12 60.15250(30) -203_555 . -201_565 N N3 C13 H12 97.3888(9) -203_555 . -202_455 N N3 C13 H13 126.9863(12) -203_555 . -202_455 N N3 C13 C12 93.6312(20) -203_555 . 1_555 N N3 C13 C12 121.6381(13) -203_555 . 2_665 N N3 C13 C13 66.6567(4) -203_555 . 2_665 N N3 C13 C13 41.9750(10) -203_555 . 3_565 N N3 C13 C14 65.4358(15) -203_555 . 3_565 N N3 C13 N4 25.33350(30) -203_555 . 1_555 N N3 C13 N4 32.6931(6) -203_555 . 2_665 N N3 C13 H24 113.1085(16) -203_555 . 2_665 N N3 C13 H25 154.4343(4) -203_555 . 2_665 N N3 C13 H26 122.98590(10) -203_555 . 1_555 N N3 C13 H26 64.7424(10) -203_555 . 3_565 N N3 C13 H27 118.4344(6) -203_555 . 1_555 N N3 C13 H29 86.9095(20) -203_555 . 3_565 N H17 C13 H12 126.2556 -201_565 . -201_565 N H17 C13 H12 83.0820(12) -201_565 . -202_455 N H17 C13 H13 71.9476(10) -201_565 . -202_455 N H17 C13 C12 71.8429(20) -201_565 . 1_555 N H17 C13 C12 39.4099(11) -201_565 . 2_665 N H17 C13 C13 97.98340(20) -201_565 . 2_665 N H17 C13 C13 121.2944(9) -201_565 . 3_565 N H17 C13 C14 124.7144(16) -201_565 . 3_565 N H17 C13 N4 162.5876(5) -201_565 . 1_555 N H17 C13 N4 145.8225(9) -201_565 . 2_665 N H17 C13 H24 55.4872(17) -201_565 . 2_665 N H17 C13 H25 18.73100(20) -201_565 . 2_665 N H17 C13 H26 53.80390(20) -201_565 . 1_555 N H17 C13 H26 109.8992(12) -201_565 . 3_565 N H17 C13 H27 78.5410(4) -201_565 . 1_555 N H17 C13 H29 110.9542(18) -201_565 . 3_565 N H12 C13 H12 147.1534(11) -201_565 . -202_455 N H12 C13 H13 93.42200(20) -201_565 . -202_455 N H12 C13 C12 79.8673(12) -201_565 . 1_555 N H12 C13 C12 128.01820(10) -201_565 . 2_665 N H12 C13 C13 120.92440(10) -201_565 . 2_665 N H12 C13 C13 63.71730(10) -201_565 . 3_565 N H12 C13 C14 99.4704(14) -201_565 . 3_565 N H12 C13 N4 70.8047(5) -201_565 . 1_555 N H12 C13 N4 87.8073(9) -201_565 . 2_665 N H12 C13 H24 82.6528(13) -201_565 . 2_665 N H12 C13 H25 143.84840(20) -201_565 . 2_665 N H12 C13 H26 171.5318 -201_565 . 1_555 N H12 C13 H26 33.5959(7) -201_565 . 3_565 N H12 C13 H27 67.7456 -201_565 . 1_555 N H12 C13 H29 83.2843(8) -201_565 . 3_565 N H12 C13 H13 81.34780(10) -202_455 . -202_455 N H12 C13 C12 128.3229 -202_455 . 1_555 N H12 C13 C12 83.4344(12) -202_455 . 2_665 N H12 C13 C13 59.60350(10) -202_455 . 2_665 N H12 C13 C13 117.02450(10) -202_455 . 3_565 N H12 C13 C14 47.71990(30) -202_455 . 3_565 N H12 C13 N4 79.5391(7) -202_455 . 1_555 N H12 C13 N4 65.22430(30) -202_455 . 2_665 N H12 C13 H24 129.97600(20) -202_455 . 2_665 N H12 C13 H25 64.3542(14) -202_455 . 2_665 N H12 C13 H26 29.7318(10) -202_455 . 1_555 N H12 C13 H26 158.6862 -202_455 . 3_565 N H12 C13 H27 110.61410(10) -202_455 . 1_555 N H12 C13 H29 71.0541(5) -202_455 . 3_565 N H13 C13 C12 128.4567(4) -202_455 . 1_555 N H13 C13 C12 110.91930(10) -202_455 . 2_665 N H13 C13 C13 140.7812 -202_455 . 2_665 N H13 C13 C13 157.12219(10) -202_455 . 3_565 N H13 C13 C14 76.53480(10) -202_455 . 3_565 N H13 C13 N4 106.2126(11) -202_455 . 1_555 N H13 C13 N4 113.0501(11) -202_455 . 2_665 N H13 C13 H24 106.9222 -202_455 . 2_665 N H13 C13 H25 70.3982(8) -202_455 . 2_665 N H13 C13 H26 78.49620(20) -202_455 . 1_555 N H13 C13 H26 118.26120(10) -202_455 . 3_565 N H13 C13 H27 29.3503 -202_455 . 1_555 N H13 C13 H29 42.2206(7) -202_455 . 3_565 N C12 C13 C12 48.7917(13) 1_555 . 2_665 N C12 C13 C13 79.67320(20) 1_555 . 2_665 N C12 C13 C13 51.9842(10) 1_555 . 3_565 N C12 C13 C14 154.9819(6) 1_555 . 3_565 N C12 C13 N4 118.8510(17) 1_555 . 1_555 N C12 C13 N4 117.6090(16) 1_555 . 2_665 N C12 C13 H24 21.7620(5) 1_555 . 2_665 N C12 C13 H25 85.4972(20) 1_555 . 2_665 N C12 C13 H26 107.0848(12) 1_555 . 1_555 N C12 C13 H26 47.1512(5) 1_555 . 3_565 N C12 C13 H27 107.63450(30) 1_555 . 1_555 N C12 C13 H29 160.1889(4) 1_555 . 3_565 N C12 C13 C13 64.1413(8) 2_665 . 2_665 N C12 C13 C13 85.92280(10) 2_665 . 3_565 N C12 C13 C14 129.9370(15) 2_665 . 3_565 N C12 C13 N4 135.9738(13) 2_665 . 1_555 N C12 C13 N4 119.8092(17) 2_665 . 2_665 N C12 C13 H24 47.0575(14) 2_665 . 2_665 N C12 C13 H25 42.6980(9) 2_665 . 2_665 N C12 C13 H26 58.40230(10) 2_665 . 1_555 N C12 C13 H26 95.9429(8) 2_665 . 3_565 N C12 C13 H27 115.3511(6) 2_665 . 1_555 N C12 C13 H29 144.3205(9) 2_665 . 3_565 N C13 C13 C13 60.0 2_665 . 3_565 N C13 C13 C14 79.38530(30) 2_665 . 3_565 N C13 C13 N4 72.2192(6) 2_665 . 1_555 N C13 C13 N4 55.7341(9) 2_665 . 2_665 N C13 C13 H24 96.51670(20) 2_665 . 2_665 N C13 C13 H25 88.1256 2_665 . 2_665 N C13 C13 H26 65.9497 2_665 . 1_555 N C13 C13 H26 100.8906 2_665 . 3_565 N C13 C13 H27 170.1194 2_665 . 1_555 N C13 C13 H29 118.3120(7) 2_665 . 3_565 N C13 C13 C14 105.0269(4) 3_565 . 3_565 N C13 C13 N4 66.9307(7) 3_565 . 1_555 N C13 C13 N4 67.6765(6) 3_565 . 2_665 N C13 C13 H24 72.6959(5) 3_565 . 2_665 N C13 C13 H25 128.5357(7) 3_565 . 2_665 N C13 C13 H26 124.29340(10) 3_565 . 1_555 N C13 C13 H26 41.90130(10) 3_565 . 3_565 N C13 C13 H27 129.7017 3_565 . 1_555 N C13 C13 H29 127.6009(9) 3_565 . 3_565 N C14 C13 N4 40.5318(12) 3_565 . 1_555 N C14 C13 N4 37.7686(10) 3_565 . 2_665 N C14 C13 H24 175.90140(10) 3_565 . 2_665 N C14 C13 H25 107.3121(18) 3_565 . 2_665 N C14 C13 H26 76.3440(13) 3_565 . 1_555 N C14 C13 H26 124.9502(5) 3_565 . 3_565 N C14 C13 H27 94.90410(30) 3_565 . 1_555 N C14 C13 H29 39.2154(10) 3_565 . 3_565 N N4 C13 N4 18.3256(4) 1_555 . 2_665 N N4 C13 H24 138.3197(13) 1_555 . 2_665 N N4 C13 H25 143.8865(7) 1_555 . 2_665 N N4 C13 H26 108.79350(30) 1_555 . 1_555 N N4 C13 H26 86.4421(7) 1_555 . 3_565 N N4 C13 H27 108.6321(7) 1_555 . 1_555 N N4 C13 H29 64.1550(18) 1_555 . 3_565 N N4 C13 H24 139.3475(11) 2_665 . 2_665 N N4 C13 H25 128.0903(11) 2_665 . 2_665 N N4 C13 H26 93.0116(7) 2_665 . 1_555 N N4 C13 H26 97.4177(4) 2_665 . 3_565 N N4 C13 H27 123.2791(10) 2_665 . 1_555 N N4 C13 H29 71.7840(19) 2_665 . 3_565 N H24 C13 H25 72.2796(18) 2_665 . 2_665 N H24 C13 H26 101.9988(12) 2_665 . 1_555 N H24 C13 H26 55.6455(5) 2_665 . 3_565 N H24 C13 H27 89.14260(10) 2_665 . 1_555 N H24 C13 H29 144.8410(9) 2_665 . 3_565 N H25 C13 H26 35.2480(4) 2_665 . 1_555 N H25 C13 H26 127.7347(13) 2_665 . 3_565 N H25 C13 H27 85.88660(20) 2_665 . 1_555 N H25 C13 H29 102.4045(17) 2_665 . 3_565 N H26 C13 H26 154.0367(7) 1_555 . 3_565 N H26 C13 H27 104.9952 1_555 . 1_555 N H26 C13 H29 88.9616(7) 1_555 . 3_565 N H26 C13 H27 88.9889 3_565 . 1_555 N H26 C13 H29 116.87290(10) 3_565 . 3_565 N H27 C13 H29 55.6998(7) 1_555 . 3_565 N C2 C14 C3 34.9843(10) -202_344 . -203_444 N C2 C14 C4 31.2574(10) -202_455 . -201_565 N C2 C14 C5 83.4723(8) -202_455 . -202_455 N C2 C14 C6 157.0006(8) -202_455 . -203_555 N C2 C14 C7 132.0636(9) -202_455 . -201_565 N C2 C14 N3 119.7123(13) -202_455 . -201_565 N C2 C14 N3 127.1786(13) -202_455 . -202_455 N C2 C14 H6 47.4087(13) -202_455 . -203_555 N C2 C14 H10 95.57570(30) -202_455 . -202_455 N C2 C14 H11 103.46670(10) -202_455 . -202_455 N C2 C14 H15 145.8739(7) -202_455 . -201_565 N C2 C14 H12 144.7762(8) -202_455 . -203_555 N C2 C14 H13 144.5376(10) -202_455 . -203_555 N C2 C14 C13 146.1243(11) -202_455 . 2_665 N C2 C14 C15 30.5461(10) -202_455 . 1_555 N C2 C14 C16 51.6109(13) -202_455 . 3_565 N C2 C14 C18 14.6862(5) -202_455 . 2_665 N C2 C14 N4 85.1349(4) -202_455 . 1_555 N C2 C14 N4 86.4070(5) -202_455 . 2_665 N C2 C14 N4 87.2977(5) -202_455 . 3_565 N C2 C14 H28 134.6363(8) -202_455 . 1_555 N C2 C14 H29 106.6362(5) -202_455 . 1_555 N C2 C14 H32 109.21990(30) -202_455 . 3_565 N C2 C14 H33 80.2126(9) -202_455 . 3_565 N C3 C14 C4 34.0268(10) -203_555 . -201_565 N C3 C14 C5 75.0290(5) -203_555 . -202_455 N C3 C14 C6 142.0117(11) -203_555 . -203_555 N C3 C14 C7 97.1512(19) -203_555 . -201_565 N C3 C14 N3 122.3394(11) -203_555 . -201_565 N C3 C14 N3 148.6421(6) -203_555 . -202_455 N C3 C14 H6 44.5756(11) -203_555 . -203_555 N C3 C14 H10 98.74480(30) -203_555 . -202_455 N C3 C14 H11 68.7997(12) -203_555 . -202_455 N C3 C14 H15 123.6805(14) -203_555 . -201_565 N C3 C14 H12 148.8209(7) -203_555 . -203_555 N C3 C14 H13 113.4321(19) -203_555 . -203_555 N C3 C14 C13 131.4429(14) -203_555 . 2_665 N C3 C14 C15 41.8215(12) -203_555 . 1_555 N C3 C14 C16 38.2113(9) -203_555 . 3_565 N C3 C14 C18 20.7277(5) -203_555 . 2_665 N C3 C14 N4 105.54430(20) -203_555 . 1_555 N C3 C14 N4 98.99850(10) -203_555 . 2_665 N C3 C14 N4 113.48050(30) -203_555 . 3_565 N C3 C14 H28 140.2165(7) -203_555 . 1_555 N C3 C14 H29 72.8243(15) -203_555 . 1_555 N C3 C14 H32 74.9866(13) -203_555 . 3_565 N C3 C14 H33 84.7942(9) -203_555 . 3_565 N C4 C14 C5 52.64460(20) -201_565 . -202_455 N C4 C14 C6 168.79190(30) -201_565 . -203_555 N C4 C14 C7 115.6897(14) -201_565 . -201_565 N C4 C14 N3 150.07899(30) -201_565 . -201_565 N C4 C14 N3 152.5656(5) -201_565 . -202_455 N C4 C14 H6 16.30650(30) -201_565 . -203_555 N C4 C14 H10 69.4671(5) -201_565 . -202_455 N C4 C14 H11 85.5006(7) -201_565 . -202_455 N C4 C14 H15 114.6408(18) -201_565 . -201_565 N C4 C14 H12 123.2296(15) -201_565 . -203_555 N C4 C14 H13 138.5856(12) -201_565 . -203_555 N C4 C14 C13 164.3727(5) -201_565 . 2_665 N C4 C14 C15 9.11760(30) -201_565 . 1_555 N C4 C14 C16 21.88080(30) -201_565 . 3_565 N C4 C14 C18 25.1600(8) -201_565 . 2_665 N C4 C14 N4 115.8251(6) -201_565 . 1_555 N C4 C14 N4 117.5711(5) -201_565 . 2_665 N C4 C14 N4 115.6293(5) -201_565 . 3_565 N C4 C14 H28 112.4823(15) -201_565 . 1_555 N C4 C14 H29 98.9847(7) -201_565 . 1_555 N C4 C14 H32 88.8514(9) -201_565 . 3_565 N C4 C14 H33 54.1324 -201_565 . 3_565 N C5 C14 C6 119.27 -202_455 . -203_555 N C5 C14 C7 85.2294(8) -202_455 . -201_565 N C5 C14 N3 156.7491(5) -202_455 . -201_565 N C5 C14 N3 135.87840(10) -202_455 . -202_455 N C5 C14 H6 36.3447(5) -202_455 . -203_555 N C5 C14 H10 26.97170(20) -202_455 . -202_455 N C5 C14 H11 67.87800(30) -202_455 . -202_455 N C5 C14 H15 62.5829(15) -202_455 . -201_565 N C5 C14 H12 74.5327(12) -202_455 . -203_555 N C5 C14 H13 106.2647(5) -202_455 . -203_555 N C5 C14 C13 127.89890(20) -202_455 . 2_665 N C5 C14 C15 53.37550(20) -202_455 . 1_555 N C5 C14 C16 37.18430(30) -202_455 . 3_565 N C5 C14 C18 76.8607(6) -202_455 . 2_665 N C5 C14 N4 157.57401(20) -202_455 . 1_555 N C5 C14 N4 168.95461(30) -202_455 . 2_665 N C5 C14 N4 145.89680(10) -202_455 . 3_565 N C5 C14 H28 65.1974(12) -202_455 . 1_555 N C5 C14 H29 90.38800(30) -202_455 . 1_555 N C5 C14 H32 65.0940(4) -202_455 . 3_565 N C5 C14 H33 21.80500(10) -202_455 . 3_565 N C6 C14 C7 53.5036(11) -203_555 . -201_565 N C6 C14 N3 37.4802(5) -203_555 . -201_565 N C6 C14 N3 38.3932(8) -203_555 . -202_455 N C6 C14 H6 154.5511(6) -203_555 . -203_555 N C6 C14 H10 106.5202(4) -203_555 . -202_455 N C6 C14 H11 83.8951(4) -203_555 . -202_455 N C6 C14 H15 56.6870(15) -203_555 . -201_565 N C6 C14 H12 54.0453(15) -203_555 . -203_555 N C6 C14 H13 31.4508(9) -203_555 . -203_555 N C6 C14 C13 12.23970(30) -203_555 . 2_665 N C6 C14 C15 172.44260(20) -203_555 . 1_555 N C6 C14 C16 146.9969(7) -203_555 . 3_565 N C6 C14 C18 157.4746(8) -203_555 . 2_665 N C6 C14 N4 74.49700(30) -203_555 . 1_555 N C6 C14 N4 71.16040(30) -203_555 . 2_665 N C6 C14 N4 75.46060(10) -203_555 . 3_565 N C6 C14 H28 64.8823(15) -203_555 . 1_555 N C6 C14 H29 72.1524(4) -203_555 . 1_555 N C6 C14 H32 80.2076(6) -203_555 . 3_565 N C6 C14 H33 122.04910(10) -203_555 . 3_565 N C7 C14 N3 77.6839(13) -201_565 . -201_565 N C7 C14 N3 91.7440(19) -201_565 . -202_455 N C7 C14 H6 106.7591(15) -201_565 . -203_555 N C7 C14 H10 94.8428 -201_565 . -202_455 N C7 C14 H11 30.4856(7) -201_565 . -202_455 N C7 C14 H15 46.7743(8) -201_565 . -201_565 N C7 C14 H12 73.7524(15) -201_565 . -203_555 N C7 C14 H13 24.06320(30) -201_565 . -203_555 N C7 C14 C13 52.3020(10) -201_565 . 2_665 N C7 C14 C15 123.6688(12) -201_565 . 1_555 N C7 C14 C16 95.3654(17) -201_565 . 3_565 N C7 C14 C18 117.8083(14) -201_565 . 2_665 N C7 C14 N4 116.5451(6) -201_565 . 1_555 N C7 C14 N4 104.9190(5) -201_565 . 2_665 N C7 C14 N4 124.0035(8) -201_565 . 3_565 N C7 C14 H28 79.2688(13) -201_565 . 1_555 N C7 C14 H29 27.0964(4) -201_565 . 1_555 N C7 C14 H32 26.9129(5) -201_565 . 3_565 N C7 C14 H33 103.4300(6) -201_565 . 3_565 N N3 C14 N3 31.3674(5) -201_565 . -202_455 N N3 C14 H6 165.9598 -201_565 . -203_555 N N3 C14 H10 138.7361(8) -201_565 . -202_455 N N3 C14 H11 102.2275(6) -201_565 . -202_455 N N3 C14 H15 94.1669(20) -201_565 . -201_565 N N3 C14 H12 85.5226(18) -201_565 . -203_555 N N3 C14 H13 54.3389(10) -201_565 . -203_555 N N3 C14 C13 29.40560(30) -201_565 . 2_665 N N3 C14 C15 149.86099(30) -201_565 . 1_555 N N3 C14 C16 159.10190(30) -201_565 . 3_565 N N3 C14 C18 125.1454(11) -201_565 . 2_665 N N3 C14 N4 40.1175(7) -201_565 . 1_555 N N3 C14 N4 33.8465(8) -201_565 . 2_665 N N3 C14 N4 46.4106(4) -201_565 . 3_565 N N3 C14 H28 95.8707(18) -201_565 . 1_555 N N3 C14 H29 81.5812(5) -201_565 . 1_555 N N3 C14 H32 102.3711(8) -201_565 . 3_565 N N3 C14 H33 152.73660(20) -201_565 . 3_565 N N3 C14 H6 156.6279(4) -202_455 . -203_555 N N3 C14 H10 110.42770(30) -202_455 . -202_455 N N3 C14 H11 121.8254(12) -202_455 . -202_455 N N3 C14 H15 83.6916(19) -202_455 . -201_565 N N3 C14 H12 62.4867(13) -202_455 . -203_555 N N3 C14 H13 68.5705(16) -202_455 . -203_555 N N3 C14 C13 40.8802(9) -202_455 . 2_665 N N3 C14 C15 144.2885(7) -202_455 . 1_555 N N3 C14 C16 169.09810(20) -202_455 . 3_565 N N3 C14 C18 139.8196(9) -202_455 . 2_665 N N3 C14 N4 44.4755(8) -202_455 . 1_555 N N3 C14 N4 49.6502(5) -202_455 . 2_665 N N3 C14 N4 39.9252(8) -202_455 . 3_565 N N3 C14 H28 70.9842(13) -202_455 . 1_555 N N3 C14 H29 106.2988(11) -202_455 . 1_555 N N3 C14 H32 118.5706(14) -202_455 . 3_565 N N3 C14 H33 122.26720(30) -202_455 . 3_565 N H6 C14 H10 55.0034(8) -203_555 . -202_455 N H6 C14 H11 78.5950(8) -203_555 . -202_455 N H6 C14 H15 98.4667(20) -203_555 . -201_565 N H6 C14 H12 108.4742(18) -203_555 . -203_555 N H6 C14 H13 130.8193(12) -203_555 . -203_555 N H6 C14 C13 158.9106(5) -203_555 . 2_665 N H6 C14 C15 18.9753(4) -203_555 . 1_555 N H6 C14 C16 12.90930(20) -203_555 . 3_565 N H6 C14 C18 40.8913(11) -203_555 . 2_665 N H6 C14 N4 130.8125(8) -203_555 . 1_555 N H6 C14 N4 133.8117(8) -203_555 . 2_665 N H6 C14 N4 128.2212(6) -203_555 . 3_565 N H6 C14 H28 98.0425(18) -203_555 . 1_555 N H6 C14 H29 96.4319(7) -203_555 . 1_555 N H6 C14 H32 80.2360(10) -203_555 . 3_565 N H6 C14 H33 40.35050(20) -203_555 . 3_565 N H10 C14 H11 88.214 -202_455 . -202_455 N H10 C14 H15 55.6352(9) -202_455 . -201_565 N H10 C14 H12 53.7787(10) -202_455 . -203_555 N H10 C14 H13 108.3986(4) -202_455 . -203_555 N H10 C14 C13 118.2122(8) -202_455 . 2_665 N H10 C14 C15 66.1295(7) -202_455 . 1_555 N H10 C14 C16 60.7880(5) -202_455 . 3_565 N H10 C14 C18 94.47710(30) -202_455 . 2_665 N H10 C14 N4 136.6839 -202_455 . 1_555 N H10 C14 N4 151.4454 -202_455 . 2_665 N H10 C14 N4 123.0614 -202_455 . 3_565 N H10 C14 H28 43.1278(10) -202_455 . 1_555 N H10 C14 H29 109.7928 -202_455 . 1_555 N H10 C14 H32 83.355 -202_455 . 3_565 N H10 C14 H33 15.5425(5) -202_455 . 3_565 N H11 C14 H15 62.03490(10) -202_455 . -201_565 N H11 C14 H12 93.4326(5) -202_455 . -203_555 N H11 C14 H13 53.2714(4) -202_455 . -203_555 N H11 C14 C13 81.32810(30) -202_455 . 2_665 N H11 C14 C15 93.8730(5) -202_455 . 1_555 N H11 C14 C16 66.2821(10) -202_455 . 3_565 N H11 C14 C18 88.8014(6) -202_455 . 2_665 N H11 C14 N4 133.86360(10) -202_455 . 1_555 N H11 C14 N4 119.10570(10) -202_455 . 2_665 N H11 C14 N4 146.16409(20) -202_455 . 3_565 N H11 C14 H28 94.4542(5) -202_455 . 1_555 N H11 C14 H29 22.5212 -202_455 . 1_555 N H11 C14 H32 7.25350(10) -202_455 . 3_565 N H11 C14 H33 89.52000(20) -202_455 . 3_565 N H15 C14 H12 31.4612(6) -201_565 . -203_555 N H15 C14 H13 53.1470(12) -201_565 . -203_555 N H15 C14 C13 66.0465(17) -201_565 . 2_665 N H15 C14 C15 115.9286(17) -201_565 . 1_555 N H15 C14 C16 95.1745(20) -201_565 . 3_565 N H15 C14 C18 136.2375(11) -201_565 . 2_665 N H15 C14 N4 127.8454(11) -201_565 . 1_555 N H15 C14 N4 127.7084(12) -201_565 . 2_665 N H15 C14 N4 122.5309(11) -201_565 . 3_565 N H15 C14 H28 33.5033(5) -201_565 . 1_555 N H15 C14 H29 72.2214(4) -201_565 . 1_555 N H15 C14 H32 54.7976 -201_565 . 3_565 N H15 C14 H33 69.5439(14) -201_565 . 3_565 N H12 C14 H13 69.4706(18) -203_555 . -203_555 N H12 C14 C13 66.2576(18) -203_555 . 2_665 N H12 C14 C15 119.0791(17) -203_555 . 1_555 N H12 C14 C16 111.7168(16) -203_555 . 3_565 N H12 C14 C18 148.0182(7) -203_555 . 2_665 N H12 C14 N4 105.1436(5) -203_555 . 1_555 N H12 C14 N4 112.1281(8) -203_555 . 2_665 N H12 C14 N4 95.6539(4) -203_555 . 3_565 N H12 C14 H28 10.8645 -203_555 . 1_555 N H12 C14 H29 100.7707(11) -203_555 . 1_555 N H12 C14 H32 86.2158(7) -203_555 . 3_565 N H12 C14 H33 69.1115(15) -203_555 . 3_565 N H13 C14 C13 28.3188(7) -203_555 . 2_665 N H13 C14 C15 147.1399(9) -203_555 . 1_555 N H13 C14 C16 119.2293(14) -203_555 . 3_565 N H13 C14 C18 133.4012(14) -203_555 . 2_665 N H13 C14 N4 94.17520(30) -203_555 . 1_555 N H13 C14 N4 84.58190(20) -203_555 . 2_665 N H13 C14 N4 100.2334(6) -203_555 . 3_565 N H13 C14 H28 78.3998(17) -203_555 . 1_555 N H13 C14 H29 41.0833(4) -203_555 . 1_555 N H13 C14 H32 50.73010(20) -203_555 . 3_565 N H13 C14 H33 120.78300(20) -203_555 . 3_565 N C13 C14 C15 173.21930(20) 2_665 . 1_555 N C13 C14 C16 147.5245(7) 2_665 . 3_565 N C13 C14 C18 145.2710(11) 2_665 . 2_665 N C13 C14 N4 69.0147(4) 2_665 . 1_555 N C13 C14 N4 63.0091(5) 2_665 . 2_665 N C13 C14 N4 72.80320(20) 2_665 . 3_565 N C13 C14 H28 77.0791(18) 2_665 . 1_555 N C13 C14 H29 65.91890(20) 2_665 . 1_555 N C13 C14 H32 79.0487(6) 2_665 . 3_565 N C13 C14 H33 133.64540(20) 2_665 . 3_565 N C15 C14 C16 28.4772(6) 1_555 . 3_565 N C15 C14 C18 29.0203(10) 1_555 . 2_665 N C15 C14 N4 111.8663(4) 1_555 . 1_555 N C15 C14 N4 116.0592(5) 1_555 . 2_665 N C15 C14 N4 109.69990(30) 1_555 . 3_565 N C15 C14 H28 108.2151(17) 1_555 . 1_555 N C15 C14 H29 108.0622(4) 1_555 . 1_555 N C15 C14 H32 96.7568(7) 1_555 . 3_565 N C15 C14 H33 50.58750(10) 1_555 . 3_565 N C16 C14 C18 41.3596(10) 3_565 . 2_665 N C16 C14 N4 136.7123(9) 3_565 . 1_555 N C16 C14 N4 135.2466(7) 3_565 . 2_665 N C16 C14 N4 137.5101(8) 3_565 . 3_565 N C16 C14 H28 102.2196(15) 3_565 . 1_555 N C16 C14 H29 83.5417(9) 3_565 . 1_555 N C16 C14 H32 68.5165(13) 3_565 . 3_565 N C16 C14 H33 47.87710(10) 3_565 . 3_565 N C18 C14 N4 95.91570(10) 2_665 . 1_555 N C18 C14 N4 94.25560(20) 2_665 . 2_665 N C18 C14 N4 100.0866 2_665 . 3_565 N C18 C14 H28 137.1617(7) 2_665 . 1_555 N C18 C14 H29 93.3833(9) 2_665 . 1_555 N C18 C14 H32 94.5384(8) 2_665 . 3_565 N C18 C14 H33 79.0195(8) 2_665 . 3_565 N N4 C14 N4 14.9327 1_555 . 2_665 N N4 C14 N4 13.6761 1_555 . 3_565 N N4 C14 H28 111.4576(5) 1_555 . 1_555 N N4 C14 H29 111.40070(10) 1_555 . 1_555 N N4 C14 H32 137.20560(20) 1_555 . 3_565 N N4 C14 H33 136.47620(10) 1_555 . 3_565 N N4 C14 N4 28.4239 2_665 . 3_565 N N4 C14 H28 120.3534(8) 2_665 . 1_555 N N4 C14 H29 96.75420(10) 2_665 . 1_555 N N4 C14 H32 122.91620(20) 2_665 . 3_565 N N4 C14 H33 150.65410(10) 2_665 . 3_565 N N4 C14 H28 100.4607(4) 3_565 . 1_555 N N4 C14 H29 123.69140(20) 3_565 . 1_555 N N4 C14 H32 148.1524(4) 3_565 . 3_565 N N4 C14 H33 124.139 3_565 . 3_565 N H28 C14 H29 105.5600(10) 1_555 . 1_555 N H28 C14 H32 87.2290(6) 1_555 . 3_565 N H28 C14 H33 58.3506(15) 1_555 . 3_565 N H29 C14 H32 26.46270(10) 1_555 . 3_565 N H29 C14 H33 112.03870(20) 1_555 . 3_565 N H32 C14 H33 86.26780(30) 3_565 . 3_565 N C2 C15 C3 59.9434(9) -202_344 . -203_444 N C2 C15 C4 75.2996(8) -202_455 . -201_565 N C2 C15 C5 83.8586(7) -202_455 . -202_455 N C2 C15 N2 29.822 -202_455 . -201_565 N C2 C15 N2 1.5988 -202_455 . -203_555 N C2 C15 H4 78.69930(20) -202_455 . -202_455 N C2 C15 H5 45.3486 -202_455 . -202_455 N C2 C15 H6 131.69710(30) -202_455 . -203_555 N C2 C15 H8 84.23240(10) -202_455 . -201_565 N C2 C15 H9 156.64110(30) -202_455 . -201_565 N C2 C15 H10 120.9502(5) -202_455 . -202_455 N C2 C15 C14 75.3059(10) -202_455 . 1_555 N C2 C15 C16 82.4973(8) -202_455 . 3_565 N C2 C15 C17 55.3361 -202_455 . 3_565 N C2 C15 C18 48.5089(11) -202_455 . 2_665 N C2 C15 C19 36.4795(7) -202_455 . 2_665 N C2 C15 N5 47.93740(30) -202_455 . 1_555 N C2 C15 H30 153.965 -202_455 . 1_555 N C2 C15 H31 96.62450(20) -202_455 . 1_555 N C2 C15 H33 126.7722(6) -202_455 . 3_565 N C2 C15 H34 95.7996(6) -202_455 . 3_565 N C2 C15 H36 119.0842(4) -202_455 . 2_665 N C2 C15 H37 70.14350(30) -202_455 . 2_665 N C2 C15 H38 75.65140(10) -202_455 . 2_665 N C3 C15 C4 17.94600(10) -203_555 . -201_565 N C3 C15 C5 39.3052(6) -203_555 . -202_455 N C3 C15 N2 81.3855(5) -203_555 . -201_565 N C3 C15 N2 58.5047(9) -203_555 . -203_555 N C3 C15 H4 138.3503(7) -203_555 . -202_455 N C3 C15 H5 58.0036(17) -203_555 . -202_455 N C3 C15 H6 72.2374(11) -203_555 . -203_555 N C3 C15 H8 63.2096(9) -203_555 . -201_565 N C3 C15 H9 113.6542(16) -203_555 . -201_565 N C3 C15 H10 76.7543(18) -203_555 . -202_455 N C3 C15 C14 35.5294(5) -203_555 . 1_555 N C3 C15 C16 32.20160(30) -203_555 . 3_565 N C3 C15 C17 60.6301(17) -203_555 . 3_565 N C3 C15 C18 16.23080(20) -203_555 . 2_665 N C3 C15 C19 94.4188(16) -203_555 . 2_665 N C3 C15 N5 107.7919(12) -203_555 . 1_555 N C3 C15 H30 135.8304(10) -203_555 . 1_555 N C3 C15 H31 78.8247(11) -203_555 . 1_555 N C3 C15 H33 82.3416(19) -203_555 . 3_565 N C3 C15 H34 114.7667(14) -203_555 . 3_565 N C3 C15 H36 73.1719(17) -203_555 . 2_665 N C3 C15 H37 28.49170(10) -203_555 . 2_665 N C3 C15 H38 135.2554(8) -203_555 . 2_665 N C4 C15 C5 24.2469(6) -201_565 . -202_455 N C4 C15 N2 91.7147(5) -201_565 . -201_565 N C4 C15 N2 74.0040(8) -201_565 . -203_555 N C4 C15 H4 153.5358(7) -201_565 . -202_455 N C4 C15 H5 75.0118(16) -201_565 . -202_455 N C4 C15 H6 59.1005(11) -201_565 . -203_555 N C4 C15 H8 71.5335(11) -201_565 . -201_565 N C4 C15 H9 95.8713(16) -201_565 . -201_565 N C4 C15 H10 59.0200(17) -201_565 . -202_455 N C4 C15 C14 23.9708(6) -201_565 . 1_555 N C4 C15 C16 15.86620(30) -201_565 . 3_565 N C4 C15 C17 76.2867(17) -201_565 . 3_565 N C4 C15 C18 27.03470(30) -201_565 . 2_665 N C4 C15 C19 111.1159(15) -201_565 . 2_665 N C4 C15 N5 121.7921(12) -201_565 . 1_555 N C4 C15 H30 117.9815(10) -201_565 . 1_555 N C4 C15 H31 85.0342(13) -201_565 . 1_555 N C4 C15 H33 64.4936(18) -201_565 . 3_565 N C4 C15 H34 125.6823(15) -201_565 . 3_565 N C4 C15 H36 55.3796(16) -201_565 . 2_665 N C4 C15 H37 38.03830(30) -201_565 . 2_665 N C4 C15 H38 150.6292(8) -201_565 . 2_665 N C5 C15 N2 88.7372(6) -202_455 . -201_565 N C5 C15 N2 83.0330(7) -202_455 . -203_555 N C5 C15 H4 147.0703(10) -202_455 . -202_455 N C5 C15 H5 97.1501(11) -202_455 . -202_455 N C5 C15 H6 61.4089(13) -202_455 . -203_555 N C5 C15 H8 94.8017(6) -202_455 . -201_565 N C5 C15 H9 80.1702(13) -202_455 . -201_565 N C5 C15 H10 40.0674(13) -202_455 . -202_455 N C5 C15 C14 8.71410(30) -202_455 . 1_555 N C5 C15 C16 8.71940(30) -202_455 . 3_565 N C5 C15 C17 99.7921(11) -202_455 . 3_565 N C5 C15 C18 39.1570(5) -202_455 . 2_665 N C5 C15 C19 119.4860(15) -202_455 . 2_665 N C5 C15 N5 121.1495(13) -202_455 . 1_555 N C5 C15 H30 100.5608(6) -202_455 . 1_555 N C5 C15 H31 106.7023(7) -202_455 . 1_555 N C5 C15 H33 46.1531(14) -202_455 . 3_565 N C5 C15 H34 148.6832(9) -202_455 . 3_565 N C5 C15 H36 37.0746(12) -202_455 . 2_665 N C5 C15 H37 62.23040(30) -202_455 . 2_665 N C5 C15 H38 145.9001(10) -202_455 . 2_665 N N2 C15 N2 31.2999 -201_565 . -203_555 N N2 C15 H4 62.69620(20) -201_565 . -202_455 N N2 C15 H5 73.25470(10) -201_565 . -202_455 N N2 C15 H6 149.7065(6) -201_565 . -203_555 N N2 C15 H8 113.17300(20) -201_565 . -201_565 N N2 C15 H9 132.3021 -201_565 . -201_565 N N2 C15 H10 112.93540(10) -201_565 . -202_455 N N2 C15 C14 80.4821(9) -201_565 . 1_555 N N2 C15 C16 91.7237(5) -201_565 . 3_565 N N2 C15 C17 83.01400(20) -201_565 . 3_565 N N2 C15 C18 66.1204(7) -201_565 . 2_665 N N2 C15 C19 36.8921(6) -201_565 . 2_665 N N2 C15 N5 32.4702(7) -201_565 . 1_555 N N2 C15 H30 124.168 -201_565 . 1_555 N N2 C15 H31 123.3635(4) -201_565 . 1_555 N N2 C15 H33 116.78850(20) -201_565 . 3_565 N N2 C15 H34 106.4426(10) -201_565 . 3_565 N N2 C15 H36 113.14320(20) -201_565 . 2_665 N N2 C15 H37 98.46810(20) -201_565 . 2_665 N N2 C15 H38 60.25060(30) -201_565 . 2_665 N N2 C15 H4 80.07420(20) -203_555 . -202_455 N N2 C15 H5 44.2821 -203_555 . -202_455 N N2 C15 H6 130.16341(30) -203_555 . -203_555 N N2 C15 H8 82.95060(10) -203_555 . -201_565 N N2 C15 H9 157.0282(4) -203_555 . -201_565 N N2 C15 H10 120.5153(5) -203_555 . -202_455 N N2 C15 C14 74.5240(10) -203_555 . 1_555 N N2 C15 C16 81.4749(7) -203_555 . 3_565 N N2 C15 C17 54.266 -203_555 . 3_565 N N2 C15 C18 47.2911(11) -203_555 . 2_665 N N2 C15 C19 37.5886(7) -203_555 . 2_665 N N2 C15 N5 49.42490(30) -203_555 . 1_555 N N2 C15 H30 155.4652 -203_555 . 1_555 N N2 C15 H31 95.53980(20) -203_555 . 1_555 N N2 C15 H33 126.3965(6) -203_555 . 3_565 N N2 C15 H34 95.7883(6) -203_555 . 3_565 N N2 C15 H36 118.5488(5) -203_555 . 2_665 N N2 C15 H37 68.54830(30) -203_555 . 2_665 N N2 C15 H38 77.01810(10) -203_555 . 2_665 N H4 C15 H5 90.1968(12) -202_455 . -202_455 N H4 C15 H6 147.1723(4) -202_455 . -203_555 N H4 C15 H8 110.7992(13) -202_455 . -201_565 N H4 C15 H9 106.2708(10) -202_455 . -201_565 N H4 C15 H10 134.9621(13) -202_455 . -202_455 N H4 C15 C14 140.6838(11) -202_455 . 1_555 N H4 C15 C16 153.0567(8) -202_455 . 3_565 N H4 C15 C17 92.9613(14) -202_455 . 3_565 N H4 C15 C18 126.5381(10) -202_455 . 2_665 N H4 C15 C19 44.1304(9) -202_455 . 2_665 N H4 C15 N5 31.7524(5) -202_455 . 1_555 N H4 C15 H30 84.3633(4) -202_455 . 1_555 N H4 C15 H31 102.9113(16) -202_455 . 1_555 N H4 C15 H33 131.3561(13) -202_455 . 3_565 N H4 C15 H34 61.6752(18) -202_455 . 3_565 N H4 C15 H36 138.6692(12) -202_455 . 2_665 N H4 C15 H37 133.85020(10) -202_455 . 2_665 N H4 C15 H38 3.10190(10) -202_455 . 2_665 N H5 C15 H6 103.6528(6) -202_455 . -203_555 N H5 C15 H8 40.0385 -202_455 . -201_565 N H5 C15 H9 153.81200(10) -202_455 . -201_565 N H5 C15 H10 133.38429(10) -202_455 . -202_455 N H5 C15 C14 92.0321(12) -202_455 . 1_555 N H5 C15 C16 90.1720(13) -202_455 . 3_565 N H5 C15 C17 9.9875 -202_455 . 3_565 N H5 C15 C18 60.7235(15) -202_455 . 2_665 N H5 C15 C19 53.30160(30) -202_455 . 2_665 N H5 C15 N5 73.4808(6) -202_455 . 1_555 N H5 C15 H30 155.14690(30) -202_455 . 1_555 N H5 C15 H31 51.27630(20) -202_455 . 1_555 N H5 C15 H33 138.06430(10) -202_455 . 3_565 N H5 C15 H34 62.9990(5) -202_455 . 3_565 N H5 C15 H36 129.5999 -202_455 . 2_665 N H5 C15 H37 43.7710(11) -202_455 . 2_665 N H5 C15 H38 87.6111(11) -202_455 . 2_665 N H6 C15 H8 67.8130(8) -203_555 . -201_565 N H6 C15 H9 52.0665(4) -203_555 . -201_565 N H6 C15 H10 47.0953(8) -203_555 . -202_455 N H6 C15 C14 69.4239(15) -203_555 . 1_555 N H6 C15 C16 57.9899(11) -203_555 . 3_565 N H6 C15 C17 96.3609(8) -203_555 . 3_565 N H6 C15 C18 85.8168(14) -203_555 . 2_665 N H6 C15 C19 156.68950(30) -203_555 . 2_665 N H6 C15 N5 176.1453 -203_555 . 1_555 N H6 C15 H30 70.52450(10) -203_555 . 1_555 N H6 C15 H31 66.2632(13) -203_555 . 1_555 N H6 C15 H33 46.0692(8) -203_555 . 3_565 N H6 C15 H34 98.1086(18) -203_555 . 3_565 N H6 C15 H36 45.1992(7) -203_555 . 2_665 N H6 C15 H37 64.3939(4) -203_555 . 2_665 N H6 C15 H38 149.81351(30) -203_555 . 2_665 N H8 C15 H9 113.89520(20) -201_565 . -201_565 N H8 C15 H10 111.2185 -201_565 . -202_455 N H8 C15 C14 95.4379(5) -201_565 . 1_555 N H8 C15 C16 86.0953(8) -201_565 . 3_565 N H8 C15 C17 30.6081 -201_565 . 3_565 N H8 C15 C18 76.1285(7) -201_565 . 2_665 N H8 C15 C19 89.2119(5) -201_565 . 2_665 N H8 C15 N5 108.6421(8) -201_565 . 1_555 N H8 C15 H30 120.525 -201_565 . 1_555 N H8 C15 H31 16.35300(10) -201_565 . 1_555 N H8 C15 H33 112.3126 -201_565 . 3_565 N H8 C15 H34 54.1879(4) -201_565 . 3_565 N H8 C15 H36 108.07300(10) -201_565 . 2_665 N H8 C15 H37 34.8656(8) -201_565 . 2_665 N H8 C15 H38 109.6438(12) -201_565 . 2_665 N H9 C15 H10 40.2553 -201_565 . -202_455 N H9 C15 C14 87.8812(15) -201_565 . 1_555 N H9 C15 C16 84.1522(14) -201_565 . 3_565 N H9 C15 C17 144.45940(20) -201_565 . 3_565 N H9 C15 C18 119.1388(18) -201_565 . 2_665 N H9 C15 C19 149.28030(10) -201_565 . 2_665 N H9 C15 N5 130.2040(4) -201_565 . 1_555 N H9 C15 H30 22.2030(6) -201_565 . 1_555 N H9 C15 H31 104.2108(4) -201_565 . 1_555 N H9 C15 H33 34.12600(20) -201_565 . 3_565 N H9 C15 H34 106.6999(10) -201_565 . 3_565 N H9 C15 H36 43.0972 -201_565 . 2_665 N H9 C15 H37 115.9222(9) -201_565 . 2_665 N H9 C15 H38 109.2934(9) -201_565 . 2_665 N H10 C15 C14 47.6260(15) -202_455 . 1_555 N H10 C15 C16 45.0520(15) -202_455 . 3_565 N H10 C15 C17 131.97830(10) -202_455 . 3_565 N H10 C15 C18 79.2185(18) -202_455 . 2_665 N H10 C15 C19 149.8185(5) -202_455 . 2_665 N H10 C15 N5 136.7590(8) -202_455 . 1_555 N H10 C15 H30 60.6284(7) -202_455 . 1_555 N H10 C15 H31 113.0952(5) -202_455 . 1_555 N H10 C15 H33 6.13010(10) -202_455 . 3_565 N H10 C15 H34 140.3207(12) -202_455 . 3_565 N H10 C15 H36 3.80210(10) -202_455 . 2_665 N H10 C15 H37 90.7910(12) -202_455 . 2_665 N H10 C15 H38 137.0484(12) -202_455 . 2_665 N C14 C15 C16 12.4567(4) 1_555 . 3_565 N C14 C15 C17 95.9071(12) 1_555 . 3_565 N C14 C15 C18 32.19740(30) 1_555 . 2_665 N C14 C15 C19 110.7813(17) 1_555 . 2_665 N C14 C15 N5 112.9513(16) 1_555 . 1_555 N C14 C15 H30 107.4778(8) 1_555 . 1_555 N C14 C15 H31 108.9111(7) 1_555 . 1_555 N C14 C15 H33 53.7552(16) 1_555 . 3_565 N C14 C15 H34 149.4057(9) 1_555 . 3_565 N C14 C15 H36 44.8986(15) 1_555 . 2_665 N C14 C15 H37 61.31830(30) 1_555 . 2_665 N C14 C15 H38 139.0558(12) 1_555 . 2_665 N C16 C15 C17 92.0279(13) 3_565 . 3_565 N C16 C15 C18 35.1826(4) 3_565 . 2_665 N C16 C15 C19 118.9123(15) 3_565 . 2_665 N C16 C15 N5 124.0558(12) 3_565 . 1_555 N C16 C15 H30 105.5180(8) 3_565 . 1_555 N C16 C15 H31 98.2535(10) 3_565 . 1_555 N C16 C15 H33 50.9120(16) 3_565 . 3_565 N C16 C15 H34 140.0826(12) 3_565 . 3_565 N C16 C15 H36 41.6622(14) 3_565 . 2_665 N C16 C15 H37 53.6491 3_565 . 2_665 N C16 C15 H38 151.2688(8) 3_565 . 2_665 N C17 C15 C18 66.1826(14) 3_565 . 2_665 N C17 C15 C19 60.3328(5) 3_565 . 2_665 N C17 C15 N5 80.4750(8) 3_565 . 1_555 N C17 C15 H30 146.10210(20) 3_565 . 1_555 N C17 C15 H31 41.28900(20) 3_565 . 1_555 N C17 C15 H33 135.5769 3_565 . 3_565 N C17 C15 H34 56.6600(4) 3_565 . 3_565 N C17 C15 H36 128.20920(20) 3_565 . 2_665 N C17 C15 H37 41.2338(13) 3_565 . 2_665 N C17 C15 H38 90.6957(13) 3_565 . 2_665 N C18 C15 C19 84.8014(18) 2_665 . 2_665 N C18 C15 N5 94.8517(15) 2_665 . 1_555 N C18 C15 H30 139.6251(11) 2_665 . 1_555 N C18 C15 H31 92.3386(8) 2_665 . 1_555 N C18 C15 H33 85.2877(19) 2_665 . 3_565 N C18 C15 H34 122.8141(11) 2_665 . 3_565 N C18 C15 H36 76.1443(17) 2_665 . 2_665 N C18 C15 H37 42.77290(10) 2_665 . 2_665 N C18 C15 H38 123.6019(10) 2_665 . 2_665 N C19 C15 N5 20.20940(30) 2_665 . 1_555 N C19 C15 H30 128.1987(5) 2_665 . 1_555 N C19 C15 H31 92.8476(10) 2_665 . 1_555 N C19 C15 H33 153.2759(4) 2_665 . 3_565 N C19 C15 H34 69.6374(16) 2_665 . 3_565 N C19 C15 H36 149.9390(5) 2_665 . 2_665 N C19 C15 H37 94.6645(8) 2_665 . 2_665 N C19 C15 H38 41.0331(8) 2_665 . 2_665 N N5 C15 H30 110.95010(20) 1_555 . 1_555 N N5 C15 H31 109.9009(13) 1_555 . 1_555 N N5 C15 H33 137.7490(8) 1_555 . 3_565 N N5 C15 H34 78.3319(18) 1_555 . 3_565 N N5 C15 H36 138.6379(7) 1_555 . 2_665 N N5 C15 H37 113.7204(5) 1_555 . 2_665 N N5 C15 H38 28.9291(4) 1_555 . 2_665 N H30 C15 H31 106.4034 1_555 . 1_555 N H30 C15 H33 54.6540(8) 1_555 . 3_565 N H30 C15 H34 93.34480(10) 1_555 . 3_565 N H30 C15 H36 63.8907(6) 1_555 . 2_665 N H30 C15 H37 134.61780(30) 1_555 . 2_665 N H30 C15 H38 87.42530(30) 1_555 . 2_665 N H31 C15 H33 112.3101(5) 1_555 . 3_565 N H31 C15 H34 42.08610(20) 1_555 . 3_565 N H31 C15 H36 110.7289(6) 1_555 . 2_665 N H31 C15 H37 50.3338(9) 1_555 . 2_665 N H31 C15 H38 102.5496(16) 1_555 . 2_665 N H33 C15 H34 135.6385(12) 3_565 . 3_565 N H33 C15 H36 9.25010(20) 3_565 . 2_665 N H33 C15 H37 94.7606(13) 3_565 . 2_665 N H33 C15 H38 133.7087(13) 3_565 . 2_665 N H34 C15 H36 140.4052(12) 3_565 . 2_665 N H34 C15 H37 88.0921(12) 3_565 . 2_665 N H34 C15 H38 61.8473(18) 3_565 . 2_665 N H36 C15 H37 87.0071(11) 2_665 . 2_665 N H36 C15 H38 140.6976(11) 2_665 . 2_665 N H37 C15 H38 131.3489 2_665 . 2_665 N C2 C16 C3 43.7308(9) -203_444 . -201_454 N C2 C16 C4 34.7122(11) -203_555 . -202_455 N C2 C16 C5 131.7415(15) -203_555 . -203_555 N C2 C16 C6 128.4303(16) -203_555 . -201_565 N C2 C16 C7 141.6124(12) -203_555 . -202_455 N C2 C16 H6 62.6674(18) -203_555 . -201_565 N C2 C16 H7 79.7682(8) -203_555 . -201_565 N C2 C16 H8 53.9563(16) -203_555 . -202_455 N C2 C16 H9 76.9796(15) -203_555 . -202_455 N C2 C16 H10 120.89610(20) -203_555 . -203_555 N C2 C16 H11 130.7815(7) -203_555 . -203_555 N C2 C16 H15 170.87920(30) -203_555 . -202_455 N C2 C16 H12 143.5817(11) -203_555 . -201_565 N C2 C16 C14 110.5343(19) -203_555 . 2_665 N C2 C16 C15 38.4893(12) -203_555 . 2_665 N C2 C16 C17 34.3329(11) -203_555 . 1_555 N C2 C16 C18 14.1059(4) -203_555 . 3_565 N C2 C16 N4 83.0879(14) -203_555 . 1_555 N C2 C16 N4 82.5107(14) -203_555 . 3_565 N C2 C16 H28 140.4803(11) -203_555 . 2_665 N C2 C16 H29 121.7510(11) -203_555 . 2_665 N C2 C16 H32 138.3304(7) -203_555 . 1_555 N C2 C16 H33 104.4933(5) -203_555 . 1_555 N C2 C16 H36 80.5815(13) -203_555 . 3_565 N C3 C16 C4 58.2726(14) -201_565 . -202_455 N C3 C16 C5 138.2778(8) -201_565 . -203_555 N C3 C16 C6 116.8375(15) -201_565 . -201_565 N C3 C16 C7 106.8690(18) -201_565 . -202_455 N C3 C16 H6 77.9131(18) -201_565 . -201_565 N C3 C16 H7 37.76260(10) -201_565 . -201_565 N C3 C16 H8 41.0153(8) -201_565 . -202_455 N C3 C16 H9 104.6342(19) -201_565 . -202_455 N C3 C16 H10 153.1387(4) -201_565 . -203_555 N C3 C16 H11 87.1272(16) -201_565 . -203_555 N C3 C16 H15 144.5768(6) -201_565 . -202_455 N C3 C16 H12 158.80910(20) -201_565 . -201_565 N C3 C16 C14 110.6370(14) -201_565 . 2_665 N C3 C16 C15 67.6859(17) -201_565 . 2_665 N C3 C16 C17 28.1394(4) -201_565 . 1_555 N C3 C16 C18 30.6213(5) -201_565 . 3_565 N C3 C16 N4 96.6064(8) -201_565 . 1_555 N C3 C16 N4 82.3535(11) -201_565 . 3_565 N C3 C16 H28 164.15800(20) -201_565 . 2_665 N C3 C16 H29 80.4494(19) -201_565 . 2_665 N C3 C16 H32 94.7448(16) -201_565 . 1_555 N C3 C16 H33 135.3732(10) -201_565 . 1_555 N C3 C16 H36 111.3699(18) -201_565 . 3_565 N C4 C16 C5 150.2682(9) -202_455 . -203_555 N C4 C16 C6 161.7988(6) -202_455 . -201_565 N C4 C16 C7 161.8610(5) -202_455 . -202_455 N C4 C16 H6 27.9773(7) -202_455 . -201_565 N C4 C16 H7 79.7453(8) -202_455 . -201_565 N C4 C16 H8 36.5693(11) -202_455 . -202_455 N C4 C16 H9 47.5836(5) -202_455 . -202_455 N C4 C16 H10 96.7668(10) -202_455 . -203_555 N C4 C16 H11 125.5242(8) -202_455 . -203_555 N C4 C16 H15 146.1818(11) -202_455 . -202_455 N C4 C16 H12 141.6402(12) -202_455 . -201_565 N C4 C16 C14 142.4935(8) -202_455 . 2_665 N C4 C16 C15 10.03270(30) -202_455 . 2_665 N C4 C16 C17 31.3577(10) -202_455 . 1_555 N C4 C16 C18 43.0261(13) -202_455 . 3_565 N C4 C16 N4 113.8533(5) -202_455 . 1_555 N C4 C16 N4 116.97380(30) -202_455 . 3_565 N C4 C16 H28 135.7656(13) -202_455 . 2_665 N C4 C16 H29 133.3729(7) -202_455 . 2_665 N C4 C16 H32 129.8030(9) -202_455 . 1_555 N C4 C16 H33 78.4262(4) -202_455 . 1_555 N C4 C16 H36 53.5433(4) -202_455 . 3_565 N C5 C16 C6 23.5989(7) -203_555 . -201_565 N C5 C16 C7 47.7259(15) -203_555 . -202_455 N C5 C16 H6 142.6355(10) -203_555 . -201_565 N C5 C16 H7 129.05830(10) -203_555 . -201_565 N C5 C16 H8 173.03650(10) -203_555 . -202_455 N C5 C16 H9 114.2076(11) -203_555 . -202_455 N C5 C16 H10 68.3617(5) -203_555 . -203_555 N C5 C16 H11 83.6595(17) -203_555 . -203_555 N C5 C16 H15 41.2324(13) -203_555 . -202_455 N C5 C16 H12 21.9433(6) -203_555 . -201_565 N C5 C16 C14 28.2765(6) -203_555 . 2_665 N C5 C16 C15 140.9910(12) -203_555 . 2_665 N C5 C16 C17 162.5978(5) -203_555 . 1_555 N C5 C16 C18 133.2231(13) -203_555 . 3_565 N C5 C16 N4 50.2735 -203_555 . 1_555 N C5 C16 N4 58.32840(20) -203_555 . 3_565 N C5 C16 H28 26.1046(7) -203_555 . 2_665 N C5 C16 H29 75.6237(16) -203_555 . 2_665 N C5 C16 H32 78.5195(18) -203_555 . 1_555 N C5 C16 H33 85.17790(20) -203_555 . 1_555 N C5 C16 H36 106.6771(11) -203_555 . 3_565 N C6 C16 C7 30.8818(9) -201_565 . -202_455 N C6 C16 H6 165.18100(30) -201_565 . -201_565 N C6 C16 H7 106.8678(6) -201_565 . -201_565 N C6 C16 H8 151.5318(8) -201_565 . -202_455 N C6 C16 H9 137.6234(4) -201_565 . -202_455 N C6 C16 H10 89.9736(11) -201_565 . -203_555 N C6 C16 H11 68.8300(13) -201_565 . -203_555 N C6 C16 H15 48.6104(15) -201_565 . -202_455 N C6 C16 H12 42.0095(13) -201_565 . -201_565 N C6 C16 C14 19.35830(30) -201_565 . 2_665 N C6 C16 C15 157.7102(7) -201_565 . 2_665 N C6 C16 C17 144.6880(11) -201_565 . 1_555 N C6 C16 C18 122.8845(17) -201_565 . 3_565 N C6 C16 N4 47.98040(10) -201_565 . 1_555 N C6 C16 N4 46.03490(20) -201_565 . 3_565 N C6 C16 H28 47.3864(13) -201_565 . 2_665 N C6 C16 H29 55.2011(10) -201_565 . 2_665 N C6 C16 H32 65.9488(14) -201_565 . 1_555 N C6 C16 H33 107.6820(5) -201_565 . 1_555 N C6 C16 H36 130.1912(4) -201_565 . 3_565 N C7 C16 H6 147.6134(8) -202_455 . -201_565 N C7 C16 H7 82.1602(14) -202_455 . -201_565 N C7 C16 H8 125.5472(16) -202_455 . -202_455 N C7 C16 H9 141.37540(30) -202_455 . -202_455 N C7 C16 H10 95.3724(13) -202_455 . -203_555 N C7 C16 H11 37.99340(30) -202_455 . -203_555 N C7 C16 H15 41.9443(13) -202_455 . -202_455 N C7 C16 H12 54.9523(17) -202_455 . -201_565 N C7 C16 C14 48.8794(12) -202_455 . 2_665 N C7 C16 C15 171.03281(30) -202_455 . 2_665 N C7 C16 C17 131.7087(15) -202_455 . 1_555 N C7 C16 C18 129.1280(15) -202_455 . 3_565 N C7 C16 N4 76.1198(8) -202_455 . 1_555 N C7 C16 N4 66.9929(5) -202_455 . 3_565 N C7 C16 H28 60.6935(18) -202_455 . 2_665 N C7 C16 H29 28.64500(20) -202_455 . 2_665 N C7 C16 H32 35.2533(5) -202_455 . 1_555 N C7 C16 H33 113.0134(7) -202_455 . 1_555 N C7 C16 H36 137.60750(10) -202_455 . 3_565 N H6 C16 H7 83.7918(8) -201_565 . -201_565 N H6 C16 H8 41.0168(10) -201_565 . -202_455 N H6 C16 H9 28.66780(20) -201_565 . -202_455 N H6 C16 H10 75.2461(14) -201_565 . -203_555 N H6 C16 H11 112.7434(11) -201_565 . -203_555 N H6 C16 H15 118.6578(18) -201_565 . -202_455 N H6 C16 H12 123.2026(15) -201_565 . -201_565 N H6 C16 C14 160.2783(4) -201_565 . 2_665 N H6 C16 C15 26.4138(6) -201_565 . 2_665 N H6 C16 C17 50.1309(14) -201_565 . 1_555 N H6 C16 C18 70.3060(19) -201_565 . 3_565 N H6 C16 N4 135.9652 -201_565 . 1_555 N H6 C16 N4 144.27499(30) -201_565 . 3_565 N H6 C16 H28 117.9008(16) -201_565 . 2_665 N H6 C16 H29 130.9333(8) -201_565 . 2_665 N H6 C16 H32 113.5438(13) -201_565 . 1_555 N H6 C16 H33 57.7021(8) -201_565 . 1_555 N H6 C16 H36 36.34330(10) -201_565 . 3_565 N H7 C16 H8 44.91480(20) -201_565 . -202_455 N H7 C16 H9 111.2772(10) -201_565 . -202_455 N H7 C16 H10 136.12640(10) -201_565 . -203_555 N H7 C16 H11 51.7083(14) -201_565 . -203_555 N H7 C16 H15 109.2362(5) -201_565 . -202_455 N H7 C16 H12 134.31410(20) -201_565 . -201_565 N H7 C16 C14 114.0814(4) -201_565 . 2_665 N H7 C16 C15 89.5477(11) -201_565 . 2_665 N H7 C16 C17 51.06300(10) -201_565 . 1_555 N H7 C16 C18 67.9017(4) -201_565 . 3_565 N H7 C16 N4 118.18860(20) -201_565 . 1_555 N H7 C16 N4 98.39820(30) -201_565 . 3_565 N H7 C16 H28 138.93700(30) -201_565 . 2_665 N H7 C16 H29 53.6621(15) -201_565 . 2_665 N H7 C16 H32 58.9107(14) -201_565 . 1_555 N H7 C16 H33 130.33290(20) -201_565 . 1_555 N H7 C16 H36 118.8612(9) -201_565 . 3_565 N H8 C16 H9 69.6845(12) -202_455 . -202_455 N H8 C16 H10 113.1649(4) -202_455 . -203_555 N H8 C16 H11 89.3804(19) -202_455 . -203_555 N H8 C16 H15 133.6343(13) -202_455 . -202_455 N H8 C16 H12 156.4137(6) -202_455 . -201_565 N H8 C16 C14 151.5454(6) -202_455 . 2_665 N H8 C16 C15 45.6466(13) -202_455 . 2_665 N H8 C16 C17 20.9792(5) -202_455 . 1_555 N H8 C16 C18 50.9364(14) -202_455 . 3_565 N H8 C16 N4 133.4893 -202_455 . 1_555 N H8 C16 N4 122.90020(30) -202_455 . 3_565 N H8 C16 H28 153.6232(7) -202_455 . 2_665 N H8 C16 H29 97.9650(17) -202_455 . 2_665 N H8 C16 H32 94.5332(20) -202_455 . 1_555 N H8 C16 H33 97.35220(20) -202_455 . 1_555 N H8 C16 H36 77.3527(11) -202_455 . 3_565 N H9 C16 H10 49.3235(15) -202_455 . -203_555 N H9 C16 H11 124.0315(6) -202_455 . -203_555 N H9 C16 H15 100.3844(16) -202_455 . -202_455 N H9 C16 H12 96.4475(17) -202_455 . -201_565 N H9 C16 C14 134.6400(6) -202_455 . 2_665 N H9 C16 C15 39.79170(30) -202_455 . 2_665 N H9 C16 C17 76.5153(15) -202_455 . 1_555 N H9 C16 C18 88.8397(18) -202_455 . 3_565 N H9 C16 N4 121.65460(30) -202_455 . 1_555 N H9 C16 N4 139.77490(20) -202_455 . 3_565 N H9 C16 H28 90.7745(18) -202_455 . 2_665 N H9 C16 H29 146.5613(4) -202_455 . 2_665 N H9 C16 H32 120.8159(7) -202_455 . 1_555 N H9 C16 H33 30.9880(9) -202_455 . 1_555 N H9 C16 H36 7.72090(10) -202_455 . 3_565 N H10 C16 H11 102.2257(9) -203_555 . -203_555 N H10 C16 H15 53.6296 -203_555 . -202_455 N H10 C16 H12 47.96410(10) -203_555 . -201_565 N H10 C16 C14 95.2474(10) -203_555 . 2_665 N H10 C16 C15 88.2258(12) -203_555 . 2_665 N H10 C16 C17 125.2499 -203_555 . 1_555 N H10 C16 C18 134.74380(20) -203_555 . 3_565 N H10 C16 N4 103.3308(5) -203_555 . 1_555 N H10 C16 N4 121.0135(7) -203_555 . 3_565 N H10 C16 H28 42.70160(20) -203_555 . 2_665 N H10 C16 H29 117.0174(13) -203_555 . 2_665 N H10 C16 H32 94.9491(9) -203_555 . 1_555 N H10 C16 H33 18.3515(6) -203_555 . 1_555 N H10 C16 H36 43.2767(14) -203_555 . 3_565 N H11 C16 H15 57.9370(9) -203_555 . -202_455 N H11 C16 H12 82.7853(17) -203_555 . -201_565 N H11 C16 C14 85.9300(15) -203_555 . 2_665 N H11 C16 C15 133.1618(6) -203_555 . 2_665 N H11 C16 C17 101.9522(16) -203_555 . 1_555 N H11 C16 C18 117.5890(10) -203_555 . 3_565 N H11 C16 N4 110.5225(11) -203_555 . 1_555 N H11 C16 N4 95.5165(8) -203_555 . 3_565 N H11 C16 H28 87.2310(17) -203_555 . 2_665 N H11 C16 H29 22.55990(20) -203_555 . 2_665 N H11 C16 H32 7.671 -203_555 . 1_555 N H11 C16 H33 112.62460(20) -203_555 . 1_555 N H11 C16 H36 126.6242(5) -203_555 . 3_565 N H15 C16 H12 27.4420(8) -202_455 . -201_565 N H15 C16 C14 64.9857(17) -202_455 . 2_665 N H15 C16 C15 140.0875(13) -202_455 . 2_665 N H15 C16 C17 154.0169(8) -202_455 . 1_555 N H15 C16 C18 170.69800(20) -202_455 . 3_565 N H15 C16 N4 91.0914(13) -202_455 . 1_555 N H15 C16 N4 94.4496(14) -202_455 . 3_565 N H15 C16 H28 30.4001(8) -202_455 . 2_665 N H15 C16 H29 65.0078(13) -202_455 . 2_665 N H15 C16 H32 50.4796(9) -202_455 . 1_555 N H15 C16 H33 71.0691(6) -202_455 . 1_555 N H15 C16 H36 95.7924(14) -202_455 . 3_565 N H12 C16 C14 50.2195(12) -201_565 . 2_665 N H12 C16 C15 131.7687(15) -201_565 . 2_665 N H12 C16 C17 172.88240(20) -201_565 . 1_555 N H12 C16 C18 150.9164(8) -201_565 . 3_565 N H12 C16 N4 69.9056(6) -201_565 . 1_555 N H12 C16 N4 80.1369(9) -201_565 . 3_565 N H12 C16 H28 5.88030(10) -201_565 . 2_665 N H12 C16 H29 83.1559(19) -201_565 . 2_665 N H12 C16 H32 75.8744(17) -201_565 . 1_555 N H12 C16 H33 65.8135(8) -201_565 . 1_555 N H12 C16 H36 89.5318(16) -201_565 . 3_565 N C14 C16 C15 139.0661(10) 2_665 . 2_665 N C14 C16 C17 134.8081(11) 2_665 . 1_555 N C14 C16 C18 107.5555(19) 2_665 . 3_565 N C14 C16 N4 28.6402(4) 2_665 . 1_555 N C14 C16 N4 30.42350(30) 2_665 . 3_565 N C14 C16 H28 54.1630(13) 2_665 . 2_665 N C14 C16 H29 68.7529(12) 2_665 . 2_665 N C14 C16 H32 84.0921(17) 2_665 . 1_555 N C14 C16 H33 110.3591(4) 2_665 . 1_555 N C14 C16 H36 127.0444(5) 2_665 . 3_565 N C15 C16 C17 41.2921(14) 2_665 . 1_555 N C15 C16 C18 49.1925(15) 2_665 . 3_565 N C15 C16 N4 111.0820(6) 2_665 . 1_555 N C15 C16 N4 117.94870(30) 2_665 . 3_565 N C15 C16 H28 125.9116(16) 2_665 . 2_665 N C15 C16 H29 143.2091(4) 2_665 . 2_665 N C15 C16 H32 136.3389(7) 2_665 . 1_555 N C15 C16 H33 70.0280(6) 2_665 . 1_555 N C15 C16 H36 45.00580(20) 2_665 . 3_565 N C17 C16 C18 29.9572(8) 1_555 . 3_565 N C17 C16 N4 112.7140(5) 1_555 . 1_555 N C17 C16 N4 104.4763(8) 1_555 . 3_565 N C17 C16 H28 167.02460(30) 1_555 . 2_665 N C17 C16 H29 103.2752(17) 1_555 . 2_665 N C17 C16 H32 108.5044(16) 1_555 . 1_555 N C17 C16 H33 107.2514(6) 1_555 . 1_555 N C17 C16 H36 83.3789(14) 1_555 . 3_565 N C18 C16 N4 82.9554(13) 3_565 . 1_555 N C18 C16 N4 77.5230(15) 3_565 . 3_565 N C18 C16 H28 149.7768(8) 3_565 . 2_665 N C18 C16 H29 107.6643(14) 3_565 . 2_665 N C18 C16 H32 125.2443(10) 3_565 . 1_555 N C18 C16 H33 117.7641(8) 3_565 . 1_555 N C18 C16 H36 93.2444(16) 3_565 . 3_565 N N4 C16 N4 20.21740(10) 1_555 . 3_565 N N4 C16 H28 71.6324(6) 1_555 . 2_665 N N4 C16 H29 89.7685(8) 1_555 . 2_665 N N4 C16 H32 110.4357(13) 1_555 . 1_555 N N4 C16 H33 111.41280(10) 1_555 . 1_555 N N4 C16 H36 115.9453(4) 1_555 . 3_565 N N4 C16 H28 83.4708(9) 3_565 . 2_665 N N4 C16 H29 73.3194(5) 3_565 . 2_665 N N4 C16 H32 97.4165(10) 3_565 . 1_555 N N4 C16 H33 131.25720(20) 3_565 . 1_555 N N4 C16 H36 135.05940(20) 3_565 . 3_565 N H28 C16 H29 88.7399(19) 2_665 . 2_665 N H28 C16 H32 80.1040(17) 2_665 . 1_555 N H28 C16 H33 60.3097(8) 2_665 . 1_555 N H28 C16 H36 83.7779(17) 2_665 . 3_565 N H29 C16 H32 26.67070(30) 2_665 . 1_555 N H29 C16 H33 131.3309(6) 2_665 . 1_555 N H29 C16 H36 148.96539(20) 2_665 . 3_565 N H32 C16 H33 106.24590(20) 1_555 . 1_555 N H32 C16 H36 122.3680(6) 1_555 . 3_565 N H33 C16 H36 25.0223(8) 1_555 . 3_565 N C2 C17 C3 59.02160(10) -203_444 . -201_454 N C2 C17 C4 51.33160(10) -203_555 . -202_455 N C2 C17 N2 37.4446 -203_555 . -201_565 N C2 C17 N2 11.7202(4) -203_555 . -202_455 N C2 C17 H4 50.5106(6) -203_555 . -203_555 N C2 C17 H5 96.29530(30) -203_555 . -203_555 N C2 C17 H6 70.1730(4) -203_555 . -201_565 N C2 C17 H7 107.0206(15) -203_555 . -201_565 N C2 C17 H8 126.8505(8) -203_555 . -202_455 N C2 C17 C15 50.39130(20) -203_555 . 2_665 N C2 C17 C16 57.30540(10) -203_555 . 1_555 N C2 C17 C18 41.24140(30) -203_555 . 3_565 N C2 C17 C19 44.1379(14) -203_555 . 3_565 N C2 C17 N5 63.1336(8) -203_555 . 1_555 N C2 C17 N5 38.0112(12) -203_555 . 2_665 N C2 C17 H31 119.76190(20) -203_555 . 2_665 N C2 C17 H34 100.5315(6) -203_555 . 1_555 N C2 C17 H35 152.8530(5) -203_555 . 1_555 N C2 C17 H37 100.2534(14) -203_555 . 3_565 N C2 C17 H39 90.2316(11) -203_555 . 3_565 N C3 C17 C4 36.3887(8) -201_565 . -202_455 N C3 C17 N2 71.88490(10) -201_565 . -201_565 N C3 C17 N2 70.26480(20) -201_565 . -202_455 N C3 C17 H4 93.2919(8) -201_565 . -203_555 N C3 C17 H5 104.5232(5) -201_565 . -203_555 N C3 C17 H6 53.9982(9) -201_565 . -201_565 N C3 C17 H7 50.3861(14) -201_565 . -201_565 N C3 C17 H8 82.2162(10) -201_565 . -202_455 N C3 C17 C15 61.3845(4) -201_565 . 2_665 N C3 C17 C16 15.8821(5) -201_565 . 1_555 N C3 C17 C18 18.5098(5) -201_565 . 3_565 N C3 C17 C19 102.9327(13) -201_565 . 3_565 N C3 C17 N5 103.5088(10) -201_565 . 1_555 N C3 C17 N5 96.4472(11) -201_565 . 2_665 N C3 C17 H31 94.63860(30) -201_565 . 2_665 N C3 C17 H34 125.5887(10) -201_565 . 1_555 N C3 C17 H35 100.1561(5) -201_565 . 1_555 N C3 C17 H37 42.5468(13) -201_565 . 3_565 N C3 C17 H39 143.8821(12) -201_565 . 3_565 N C4 C17 N2 83.72820(30) -202_455 . -201_565 N C4 C17 N2 61.97550(20) -202_455 . -202_455 N C4 C17 H4 61.0914(15) -202_455 . -203_555 N C4 C17 H5 135.97231(20) -202_455 . -203_555 N C4 C17 H6 23.07320(20) -202_455 . -201_565 N C4 C17 H7 78.8338(20) -202_455 . -201_565 N C4 C17 H8 75.7140(6) -202_455 . -202_455 N C4 C17 C15 25.49670(30) -202_455 . 2_665 N C4 C17 C16 21.21360(30) -202_455 . 1_555 N C4 C17 C18 28.2350(6) -202_455 . 3_565 N C4 C17 C19 89.1054(14) -202_455 . 3_565 N C4 C17 N5 113.9647(6) -202_455 . 1_555 N C4 C17 N5 77.4880(13) -202_455 . 2_665 N C4 C17 H31 74.90300(20) -202_455 . 2_665 N C4 C17 H34 90.1173(18) -202_455 . 1_555 N C4 C17 H35 122.8020(9) -202_455 . 1_555 N C4 C17 H37 70.5671(18) -202_455 . 3_565 N C4 C17 H39 135.8069(10) -202_455 . 3_565 N N2 C17 N2 33.3313 -201_565 . -202_455 N N2 C17 H4 79.56710(20) -201_565 . -203_555 N N2 C17 H5 58.88550(30) -201_565 . -203_555 N N2 C17 H6 105.5523(5) -201_565 . -201_565 N N2 C17 H7 100.3897(7) -201_565 . -201_565 N N2 C17 H8 154.0847(9) -201_565 . -202_455 N N2 C17 C15 87.81250(20) -201_565 . 2_665 N N2 C17 C16 79.77230(20) -201_565 . 1_555 N N2 C17 C18 61.58700(30) -201_565 . 3_565 N N2 C17 C19 45.9055(8) -201_565 . 3_565 N N2 C17 N5 32.5302(9) -201_565 . 1_555 N N2 C17 N5 51.4926(4) -201_565 . 2_665 N N2 C17 H31 157.11580(20) -201_565 . 2_665 N N2 C17 H34 123.99030(10) -201_565 . 1_555 N N2 C17 H35 123.69980(10) -201_565 . 1_555 N N2 C17 H37 98.0451(7) -201_565 . 3_565 N N2 C17 H39 72.0598(11) -201_565 . 3_565 N N2 C17 H4 47.78840(30) -202_455 . -203_555 N N2 C17 H5 90.28930(10) -202_455 . -203_555 N N2 C17 H6 79.05260(10) -202_455 . -201_565 N N2 C17 H7 116.6875(11) -202_455 . -201_565 N N2 C17 H8 136.4258(5) -202_455 . -202_455 N N2 C17 C15 56.9814 -202_455 . 2_665 N N2 C17 C16 69.02270(20) -202_455 . 1_555 N N2 C17 C18 52.8012(7) -202_455 . 3_565 N N2 C17 C19 32.6821(10) -202_455 . 3_565 N N2 C17 N5 53.8001(5) -202_455 . 1_555 N N2 C17 N5 28.1911(8) -202_455 . 2_665 N N2 C17 H31 125.2003 -202_455 . 2_665 N N2 C17 H34 96.71440(20) -202_455 . 1_555 N N2 C17 H35 156.33771(10) -202_455 . 1_555 N N2 C17 H37 110.5147(10) -202_455 . 3_565 N N2 C17 H39 78.5248(8) -202_455 . 3_565 N H4 C17 H5 125.1447(5) -203_555 . -203_555 N H4 C17 H6 59.5602(11) -203_555 . -201_565 N H4 C17 H7 139.7871(5) -203_555 . -201_565 N H4 C17 H8 103.35110(20) -203_555 . -202_455 N H4 C17 C15 37.1123(11) -203_555 . 2_665 N H4 C17 C16 81.1290(12) -203_555 . 1_555 N H4 C17 C18 76.5045(12) -203_555 . 3_565 N H4 C17 C19 44.17080(10) -203_555 . 3_565 N H4 C17 N5 84.98610(30) -203_555 . 1_555 N H4 C17 N5 32.05510(10) -203_555 . 2_665 N H4 C17 H31 82.94970(10) -203_555 . 2_665 N H4 C17 H34 50.0212 -203_555 . 1_555 N H4 C17 H35 155.79810(20) -203_555 . 1_555 N H4 C17 H37 131.6047(4) -203_555 . 3_565 N H4 C17 H39 78.1955(5) -203_555 . 3_565 N H5 C17 H6 158.1682(4) -203_555 . -201_565 N H5 C17 H7 85.5329(9) -203_555 . -201_565 N H5 C17 H8 129.93430(10) -203_555 . -202_455 N H5 C17 C15 146.68671(10) -203_555 . 2_665 N H5 C17 C16 119.9941 -203_555 . 1_555 N H5 C17 C18 107.8346(4) -203_555 . 3_565 N H5 C17 C19 81.1061(4) -203_555 . 3_565 N H5 C17 N5 40.70390(10) -203_555 . 1_555 N H5 C17 N5 93.7727(4) -203_555 . 2_665 N H5 C17 H31 143.94080(10) -203_555 . 2_665 N H5 C17 H34 128.8198(15) -203_555 . 1_555 N H5 C17 H35 70.76030(10) -203_555 . 1_555 N H5 C17 H37 91.0767(9) -203_555 . 3_565 N H5 C17 H39 57.02870(10) -203_555 . 3_565 N H6 C17 H7 82.4339(16) -201_565 . -201_565 N H6 C17 H8 57.38580(30) -201_565 . -202_455 N H6 C17 C15 24.9104 -201_565 . 2_665 N H6 C17 C16 38.3184(4) -201_565 . 1_555 N H6 C17 C18 50.6891(8) -201_565 . 3_565 N H6 C17 C19 98.8528(9) -201_565 . 3_565 N H6 C17 N5 132.85210(30) -201_565 . 1_555 N H6 C17 N5 85.8010(9) -201_565 . 2_665 N H6 C17 H31 52.2995(4) -201_565 . 2_665 N H6 C17 H34 71.8547(19) -201_565 . 1_555 N H6 C17 H35 113.5314(4) -201_565 . 1_555 N H6 C17 H37 75.2582(15) -201_565 . 3_565 N H6 C17 H39 136.9226(6) -201_565 . 3_565 N H7 C17 H8 60.55230(30) -201_565 . -202_455 N H7 C17 C15 102.8226(16) -201_565 . 2_665 N H7 C17 C16 59.6922(17) -201_565 . 1_555 N H7 C17 C18 68.8211(19) -201_565 . 3_565 N H7 C17 C19 145.63460(10) -201_565 . 3_565 N H7 C17 N5 116.5185(6) -201_565 . 1_555 N H7 C17 N5 144.83510(20) -201_565 . 2_665 N H7 C17 H31 83.6307 -201_565 . 2_665 N H7 C17 H34 132.8649(8) -201_565 . 1_555 N H7 C17 H35 49.7819(9) -201_565 . 1_555 N H7 C17 H37 8.33240(10) -201_565 . 3_565 N H7 C17 H39 140.6326(10) -201_565 . 3_565 N H8 C17 C15 80.4317(4) -202_455 . 2_665 N H8 C17 C16 75.3454(7) -202_455 . 1_555 N H8 C17 C18 93.6878(12) -202_455 . 3_565 N H8 C17 C19 146.82570(10) -202_455 . 3_565 N H8 C17 N5 169.741 -202_455 . 1_555 N H8 C17 N5 135.40550(20) -202_455 . 2_665 N H8 C17 H31 23.38000(30) -202_455 . 2_665 N H8 C17 H34 72.3128(11) -202_455 . 1_555 N H8 C17 H35 59.28650(10) -202_455 . 1_555 N H8 C17 H37 60.43800(30) -202_455 . 3_565 N H8 C17 H39 133.85550(20) -202_455 . 3_565 N C15 C17 C16 46.68 2_665 . 1_555 N C15 C17 C18 49.23300(20) 2_665 . 3_565 N C15 C17 C19 73.9431(9) 2_665 . 3_565 N C15 C17 N5 109.7522(4) 2_665 . 1_555 N C15 C17 N5 60.9066(9) 2_665 . 2_665 N C15 C17 H31 69.3715 2_665 . 2_665 N C15 C17 H34 67.3714(14) 2_665 . 1_555 N C15 C17 H35 138.3326(4) 2_665 . 1_555 N C15 C17 H37 94.7962(15) 2_665 . 3_565 N C15 C17 H39 115.1004(6) 2_665 . 3_565 N C16 C17 C18 18.3424(5) 1_555 . 3_565 N C16 C17 C19 100.6840(13) 1_555 . 3_565 N C16 C17 N5 112.3024(7) 1_555 . 1_555 N C16 C17 N5 91.3664(12) 1_555 . 2_665 N C16 C17 H31 83.0535 1_555 . 2_665 N C16 C17 H34 109.7109(15) 1_555 . 1_555 N C16 C17 H35 107.6770(7) 1_555 . 1_555 N C16 C17 H37 51.3706(16) 1_555 . 3_565 N C16 C17 H39 147.5112(10) 1_555 . 3_565 N C18 C17 C19 85.3790(17) 3_565 . 3_565 N C18 C17 N5 94.0869(12) 3_565 . 1_555 N C18 C17 N5 78.0858(16) 3_565 . 2_665 N C18 C17 H31 100.0287(4) 3_565 . 2_665 N C18 C17 H34 116.5799(12) 3_565 . 1_555 N C18 C17 H35 118.6017(10) 3_565 . 1_555 N C18 C17 H37 61.0495(18) 3_565 . 3_565 N C18 C17 H39 130.1556(15) 3_565 . 3_565 N C19 C17 N5 40.84980(30) 3_565 . 1_555 N C19 C17 N5 13.1367 3_565 . 2_665 N C19 C17 H31 124.32310(20) 3_565 . 2_665 N C19 C17 H34 78.5101(9) 3_565 . 1_555 N C19 C17 H35 147.2357(5) 3_565 . 1_555 N C19 C17 H37 141.39510(10) 3_565 . 3_565 N C19 C17 H39 47.59820(30) 3_565 . 3_565 N N5 C17 N5 53.16650(30) 1_555 . 2_665 N N5 C17 H31 158.7242(6) 1_555 . 2_665 N N5 C17 H34 109.8851(14) 1_555 . 1_555 N N5 C17 H35 110.9083 1_555 . 1_555 N N5 C17 H37 118.2793(6) 1_555 . 3_565 N N5 C17 H39 41.33320(10) 1_555 . 3_565 N N5 C17 H31 114.3757 2_665 . 2_665 N N5 C17 H34 72.7805(6) 2_665 . 1_555 N N5 C17 H35 159.6486(5) 2_665 . 1_555 N N5 C17 H37 138.26379(20) 2_665 . 3_565 N N5 C17 H39 58.44330(30) 2_665 . 3_565 N H31 C17 H34 49.3551(8) 2_665 . 1_555 N H31 C17 H35 76.0277 2_665 . 1_555 N H31 C17 H37 82.6688 2_665 . 3_565 N H31 C17 H39 118.5434(7) 2_665 . 3_565 N H34 C17 H35 106.15040(10) 1_555 . 1_555 N H34 C17 H37 131.8315(8) 1_555 . 3_565 N H34 C17 H39 74.8405(16) 1_555 . 3_565 N H35 C17 H37 57.6608(8) 1_555 . 3_565 N H35 C17 H39 101.35850(20) 1_555 . 3_565 N H37 C17 H39 147.5051(9) 3_565 . 3_565 N C2 C18 C3 136.26100(10) -201_454 . -202_344 N C2 C18 C4 86.6345(10) -201_565 . -203_555 N C2 C18 C5 148.8562(10) -201_565 . -201_565 N C2 C18 C6 146.5887(11) -201_565 . -202_455 N C2 C18 C7 168.20441(30) -201_565 . -203_555 N C2 C18 N2 39.7088(5) -201_565 . -202_455 N C2 C18 N2 29.73340(10) -201_565 . -203_555 N C2 C18 H4 37.6424(10) -201_565 . -201_565 N C2 C18 H5 55.1678(15) -201_565 . -201_565 N C2 C18 H6 93.0736(9) -201_565 . -202_455 N C2 C18 H7 117.2192(5) -201_565 . -202_455 N C2 C18 H8 80.5233(18) -201_565 . -203_555 N C2 C18 H9 91.1201(4) -201_565 . -203_555 N C2 C18 H11 164.92430(20) -201_565 . -201_565 N C2 C18 C14 145.0490(11) -201_565 . 3_565 N C2 C18 C15 62.7886(13) -201_565 . 3_565 N C2 C18 C16 152.5522(8) -201_565 . 2_665 N C2 C18 C17 56.6777(17) -201_565 . 2_665 N C2 C18 C19 3.78840(10) -201_565 . 1_555 N C2 C18 N4 110.8477(18) -201_565 . 1_555 N C2 C18 N4 106.1507(19) -201_565 . 2_665 N C2 C18 H29 160.8143(5) -201_565 . 3_565 N C2 C18 H31 77.0988(18) -201_565 . 3_565 N C2 C18 H32 168.02730(20) -201_565 . 2_665 N C3 C18 C4 99.2094(4) -202_455 . -203_555 N C3 C18 C5 74.8337(11) -202_455 . -201_565 N C3 C18 C6 71.1484(10) -202_455 . -202_455 N C3 C18 C7 51.56010(30) -202_455 . -203_555 N C3 C18 N2 115.9221(6) -202_455 . -202_455 N C3 C18 N2 156.35570(10) -202_455 . -203_555 N C3 C18 H4 136.57600(20) -202_455 . -201_565 N C3 C18 H5 81.1445(17) -202_455 . -201_565 N C3 C18 H6 90.9091(4) -202_455 . -202_455 N C3 C18 H7 19.2501(6) -202_455 . -202_455 N C3 C18 H8 67.2199(16) -202_455 . -203_555 N C3 C18 H9 106.56810(10) -202_455 . -203_555 N C3 C18 H11 29.54620(10) -202_455 . -201_565 N C3 C18 C14 76.4195(12) -202_455 . 3_565 N C3 C18 C15 118.2553(6) -202_455 . 3_565 N C3 C18 C16 67.6170(8) -202_455 . 2_665 N C3 C18 C17 83.3143(17) -202_455 . 2_665 N C3 C18 C19 132.93851(20) -202_455 . 1_555 N C3 C18 N4 90.3939(12) -202_455 . 1_555 N C3 C18 N4 105.2078(16) -202_455 . 2_665 N C3 C18 H29 31.50610(20) -202_455 . 3_565 N C3 C18 H31 76.1735(14) -202_455 . 3_565 N C3 C18 H32 33.8673 -202_455 . 2_665 N C4 C18 C5 85.8630(12) -203_555 . -201_565 N C4 C18 C6 110.3121(4) -203_555 . -202_455 N C4 C18 C7 101.3309(7) -203_555 . -203_555 N C4 C18 N2 126.1137(14) -203_555 . -202_455 N C4 C18 N2 98.1212(8) -203_555 . -203_555 N C4 C18 H4 49.9317 -203_555 . -201_565 N C4 C18 H5 93.4875(10) -203_555 . -201_565 N C4 C18 H6 8.3231 -203_555 . -202_455 N C4 C18 H7 97.08860(10) -203_555 . -202_455 N C4 C18 H8 57.63440(30) -203_555 . -203_555 N C4 C18 H9 16.45840(20) -203_555 . -203_555 N C4 C18 H11 91.4895(9) -203_555 . -201_565 N C4 C18 C14 101.7187(7) -203_555 . 3_565 N C4 C18 C15 24.09820(30) -203_555 . 3_565 N C4 C18 C16 74.1323(15) -203_555 . 2_665 N C4 C18 C17 73.5598(6) -203_555 . 2_665 N C4 C18 C19 85.3574(9) -203_555 . 1_555 N C4 C18 N4 142.65089(20) -203_555 . 1_555 N C4 C18 N4 125.39820(20) -203_555 . 2_665 N C4 C18 H29 108.1471(5) -203_555 . 3_565 N C4 C18 H31 46.68840(10) -203_555 . 3_565 N C4 C18 H32 89.0949(10) -203_555 . 2_665 N C5 C18 C6 24.4585(8) -201_565 . -202_455 N C5 C18 C7 26.3729(9) -201_565 . -203_555 N C5 C18 N2 140.2312(5) -201_565 . -202_455 N C5 C18 N2 122.4902(10) -201_565 . -203_555 N C5 C18 H4 122.8637(17) -201_565 . -201_565 N C5 C18 H5 155.5219(6) -201_565 . -201_565 N C5 C18 H6 83.0125(11) -201_565 . -202_455 N C5 C18 H7 93.7005(5) -201_565 . -202_455 N C5 C18 H8 119.6976(12) -201_565 . -203_555 N C5 C18 H9 74.2294(9) -201_565 . -203_555 N C5 C18 H11 45.5395(12) -201_565 . -201_565 N C5 C18 C14 16.3536(5) -201_565 . 3_565 N C5 C18 C15 104.7268(17) -201_565 . 3_565 N C5 C18 C16 15.5928(4) -201_565 . 2_665 N C5 C18 C17 147.1187(9) -201_565 . 2_665 N C5 C18 C19 151.9437(9) -201_565 . 1_555 N C5 C18 N4 61.8601(15) -201_565 . 1_555 N C5 C18 N4 55.9692(13) -201_565 . 2_665 N C5 C18 H29 47.6512(14) -201_565 . 3_565 N C5 C18 H31 117.5333(14) -201_565 . 3_565 N C5 C18 H32 41.5177(11) -201_565 . 2_665 N C6 C18 C7 21.8851(8) -202_455 . -203_555 N C6 C18 N2 118.8196(12) -202_455 . -202_455 N C6 C18 N2 117.1218(12) -202_455 . -203_555 N C6 C18 H4 141.5183(11) -202_455 . -201_565 N C6 C18 H5 145.6658(9) -202_455 . -201_565 N C6 C18 H6 107.13820(30) -202_455 . -202_455 N C6 C18 H7 89.9005(4) -202_455 . -202_455 N C6 C18 H8 132.8859(7) -202_455 . -203_555 N C6 C18 H9 98.31760(10) -202_455 . -203_555 N C6 C18 H11 47.3634(13) -202_455 . -201_565 N C6 C18 C14 9.71400(30) -202_455 . 3_565 N C6 C18 C15 128.3643(9) -202_455 . 3_565 N C6 C18 C16 37.4286(11) -202_455 . 2_665 N C6 C18 C17 154.4576(7) -202_455 . 2_665 N C6 C18 C19 150.2687(10) -202_455 . 1_555 N C6 C18 N4 39.6495(8) -202_455 . 1_555 N C6 C18 N4 40.5065(8) -202_455 . 2_665 N C6 C18 H29 39.6555(12) -202_455 . 3_565 N C6 C18 H31 135.5147(8) -202_455 . 3_565 N C6 C18 H32 45.1780(13) -202_455 . 2_665 N C7 C18 N2 132.3888(7) -203_555 . -202_455 N C7 C18 N2 139.0070(4) -203_555 . -203_555 N C7 C18 H4 147.1440(9) -203_555 . -201_565 N C7 C18 H5 131.9111(14) -203_555 . -201_565 N C7 C18 H6 95.7228(7) -203_555 . -202_455 N C7 C18 H7 70.79730(30) -203_555 . -202_455 N C7 C18 H8 111.0580(15) -203_555 . -203_555 N C7 C18 H9 94.24100(30) -203_555 . -203_555 N C7 C18 H11 25.5432(5) -203_555 . -201_565 N C7 C18 C14 24.9767(9) -203_555 . 3_565 N C7 C18 C15 124.2471(11) -203_555 . 3_565 N C7 C18 C16 29.3031(8) -203_555 . 2_665 N C7 C18 C17 133.7882(14) -203_555 . 2_665 N C7 C18 C19 171.55840(20) -203_555 . 1_555 N C7 C18 N4 57.6961(14) -203_555 . 1_555 N C7 C18 N4 62.1483(15) -203_555 . 2_665 N C7 C18 H29 21.6475(5) -203_555 . 3_565 N C7 C18 H31 114.6955(15) -203_555 . 3_565 N C7 C18 H32 23.3160(5) -203_555 . 2_665 N N2 C18 N2 40.4420(5) -202_455 . -203_555 N N2 C18 H4 77.2326(15) -202_455 . -201_565 N N2 C18 H5 56.5043(9) -202_455 . -201_565 N N2 C18 H6 131.8662(14) -202_455 . -202_455 N N2 C18 H7 103.50930(10) -202_455 . -202_455 N N2 C18 H8 98.8856(16) -202_455 . -203_555 N N2 C18 H9 130.0878(9) -202_455 . -203_555 N N2 C18 H11 138.2255(6) -202_455 . -201_565 N N2 C18 C14 124.5615(10) -202_455 . 3_565 N N2 C18 C15 102.4743(17) -202_455 . 3_565 N N2 C18 C16 155.63040(10) -202_455 . 2_665 N N2 C18 C17 71.6910(14) -202_455 . 2_665 N N2 C18 C19 40.7668(5) -202_455 . 1_555 N N2 C18 N4 79.3048(20) -202_455 . 1_555 N N2 C18 N4 84.5780(17) -202_455 . 2_665 N N2 C18 H29 123.3914(9) -202_455 . 3_565 N N2 C18 H31 102.2066(18) -202_455 . 3_565 N N2 C18 H32 141.8805(5) -202_455 . 2_665 N N2 C18 H4 51.0584(8) -203_555 . -201_565 N N2 C18 H5 81.8646(16) -203_555 . -201_565 N N2 C18 H6 106.2610(8) -203_555 . -202_455 N N2 C18 H7 141.4973(5) -203_555 . -202_455 N N2 C18 H8 109.8545(19) -203_555 . -203_555 N N2 C18 H9 94.44220(30) -203_555 . -203_555 N N2 C18 H11 164.2426 -203_555 . -201_565 N N2 C18 C14 115.4547(13) -203_555 . 3_565 N N2 C18 C15 75.4074(11) -203_555 . 3_565 N N2 C18 C16 133.1952(7) -203_555 . 2_665 N N2 C18 C17 86.3074(18) -203_555 . 2_665 N N2 C18 C19 33.51700(20) -203_555 . 1_555 N N2 C18 N4 85.4859(18) -203_555 . 1_555 N N2 C18 N4 77.1471(20) -203_555 . 2_665 N N2 C18 H29 149.84280(30) -203_555 . 3_565 N N2 C18 H31 104.9373(19) -203_555 . 3_565 N N2 C18 H32 162.2256 -203_555 . 2_665 N H4 C18 H5 72.8089(20) -201_565 . -201_565 N H4 C18 H6 57.24030(10) -201_565 . -202_455 N H4 C18 H7 121.9140(5) -201_565 . -202_455 N H4 C18 H8 69.9448(13) -201_565 . -203_555 N H4 C18 H9 53.5967(6) -201_565 . -203_555 N H4 C18 H11 141.0707(9) -201_565 . -201_565 N H4 C18 C14 132.3891(14) -201_565 . 3_565 N H4 C18 C15 25.84390(30) -201_565 . 3_565 N H4 C18 C16 117.8788(17) -201_565 . 2_665 N H4 C18 C17 60.8323(17) -201_565 . 2_665 N H4 C18 C19 37.2622(10) -201_565 . 1_555 N H4 C18 N4 132.9688(10) -201_565 . 1_555 N H4 C18 N4 117.5217(13) -201_565 . 2_665 N H4 C18 H29 157.8998(5) -201_565 . 3_565 N H4 C18 H31 60.4279(12) -201_565 . 3_565 N H4 C18 H32 138.9878(10) -201_565 . 2_665 N H5 C18 H6 92.8510(8) -201_565 . -202_455 N H5 C18 H7 62.0524(11) -201_565 . -202_455 N H5 C18 H8 43.5878(7) -201_565 . -203_555 N H5 C18 H9 108.9431(8) -201_565 . -203_555 N H5 C18 H11 110.1108(18) -201_565 . -201_565 N H5 C18 C14 154.5694(6) -201_565 . 3_565 N H5 C18 C15 82.4563(17) -201_565 . 3_565 N H5 C18 C16 143.4502(9) -201_565 . 2_665 N H5 C18 C17 19.9770(5) -201_565 . 2_665 N H5 C18 C19 51.7941(15) -201_565 . 1_555 N H5 C18 N4 123.7316(12) -201_565 . 1_555 N H5 C18 N4 137.6973(8) -201_565 . 2_665 N H5 C18 H29 110.3438(19) -201_565 . 3_565 N H5 C18 H31 50.3596(9) -201_565 . 3_565 N H5 C18 H32 114.0458(17) -201_565 . 2_665 N H6 C18 H7 89.45400(10) -202_455 . -202_455 N H6 C18 H8 53.74800(10) -202_455 . -203_555 N H6 C18 H9 21.19380(10) -202_455 . -203_555 N H6 C18 H11 83.9118(8) -202_455 . -201_565 N H6 C18 C14 99.2689(6) -202_455 . 3_565 N H6 C18 C15 31.48240(30) -202_455 . 3_565 N H6 C18 C16 70.0078(14) -202_455 . 2_665 N H6 C18 C17 72.93230(30) -202_455 . 2_665 N H6 C18 C19 91.4623(9) -202_455 . 1_555 N H6 C18 N4 143.1131(4) -202_455 . 1_555 N H6 C18 N4 128.1114 -202_455 . 2_665 N H6 C18 H29 100.6897(5) -202_455 . 3_565 N H6 C18 H31 43.70630(10) -202_455 . 3_565 N H6 C18 H32 81.7666(9) -202_455 . 2_665 N H7 C18 H8 52.3350(9) -202_455 . -203_555 N H7 C18 H9 108.9875 -202_455 . -203_555 N H7 C18 H11 48.1649(7) -202_455 . -201_565 N H7 C18 C14 95.5978(6) -202_455 . 3_565 N H7 C18 C15 110.1743 -202_455 . 3_565 N H7 C18 C16 85.04490(20) -202_455 . 2_665 N H7 C18 C17 64.6009(11) -202_455 . 2_665 N H7 C18 C19 113.8045(4) -202_455 . 1_555 N H7 C18 N4 102.9054(5) -202_455 . 1_555 N H7 C18 N4 120.3717(9) -202_455 . 2_665 N H7 C18 H29 50.3233(8) -202_455 . 3_565 N H7 C18 H31 62.9250(7) -202_455 . 3_565 N H7 C18 H32 52.2742(6) -202_455 . 2_665 N H8 C18 H9 74.00200(10) -203_555 . -203_555 N H8 C18 H11 85.8357(20) -203_555 . -201_565 N H8 C18 C14 132.5804(7) -203_555 . 3_565 N H8 C18 C15 60.2927(8) -203_555 . 3_565 N H8 C18 C16 104.2489(16) -203_555 . 2_665 N H8 C18 C17 27.45150(20) -203_555 . 2_665 N H8 C18 C19 76.8251(17) -203_555 . 1_555 N H8 C18 N4 154.41631(30) -203_555 . 1_555 N H8 C18 N4 172.4221 -203_555 . 2_665 N H8 C18 H29 96.8428(18) -203_555 . 3_565 N H8 C18 H31 11.76970(10) -203_555 . 3_565 N H8 C18 H32 87.7421(20) -203_555 . 2_665 N H9 C18 H11 91.26330(30) -203_555 . -201_565 N H9 C18 C14 89.0145(5) -203_555 . 3_565 N H9 C18 C15 30.6700(8) -203_555 . 3_565 N H9 C18 C16 65.1717(11) -203_555 . 2_665 N H9 C18 C17 89.23490(30) -203_555 . 2_665 N H9 C18 C19 90.8551(4) -203_555 . 1_555 N H9 C18 N4 126.6176(4) -203_555 . 1_555 N H9 C18 N4 108.9476 -203_555 . 2_665 N H9 C18 H29 106.51660(10) -203_555 . 3_565 N H9 C18 H31 63.14490(10) -203_555 . 3_565 N H9 C18 H32 87.8961(4) -203_555 . 2_665 N H11 C18 C14 49.8913(14) -201_565 . 3_565 N H11 C18 C15 115.3930(12) -201_565 . 3_565 N H11 C18 C16 38.4850(9) -201_565 . 2_665 N H11 C18 C17 108.4750(19) -201_565 . 2_665 N H11 C18 C19 161.21460(30) -201_565 . 1_555 N H11 C18 N4 79.3344(18) -201_565 . 1_555 N H11 C18 N4 87.1096(20) -201_565 . 2_665 N H11 C18 H29 16.8349(4) -201_565 . 3_565 N H11 C18 H31 90.7449(19) -201_565 . 3_565 N H11 C18 H32 4.47650(10) -201_565 . 2_665 N C14 C18 C15 118.7823(13) 3_565 . 3_565 N C14 C18 C16 31.0849(9) 3_565 . 2_665 N C14 C18 C17 158.2380(6) 3_565 . 2_665 N C14 C18 C19 148.8266(10) 3_565 . 1_555 N C14 C18 N4 45.5943(10) 3_565 . 1_555 N C14 C18 N4 41.8980(8) 3_565 . 2_665 N C14 C18 H29 45.5237(14) 3_565 . 3_565 N C14 C18 H31 132.5280(9) 3_565 . 3_565 N C14 C18 H32 46.8883(13) 3_565 . 2_665 N C15 C18 C16 95.6248(19) 3_565 . 2_665 N C15 C18 C17 64.5844(13) 3_565 . 2_665 N C15 C18 C19 61.7934(12) 3_565 . 1_555 N C15 C18 N4 145.2348(5) 3_565 . 1_555 N C15 C18 N4 125.7183(8) 3_565 . 2_665 N C15 C18 H29 132.1509(8) 3_565 . 3_565 N C15 C18 H31 48.6559(7) 3_565 . 3_565 N C15 C18 H32 113.1523(13) 3_565 . 2_665 N C16 C18 C17 131.7004(13) 2_665 . 2_665 N C16 C18 C19 153.9535(7) 2_665 . 1_555 N C16 C18 N4 76.5304(19) 2_665 . 1_555 N C16 C18 N4 71.5601(17) 2_665 . 2_665 N C16 C18 H29 46.5621(12) 2_665 . 3_565 N C16 C18 H31 101.9914(17) 2_665 . 3_565 N C16 C18 H32 34.0214(8) 2_665 . 2_665 N C17 C18 C19 52.8927(16) 2_665 . 1_555 N C17 C18 N4 143.7066(7) 2_665 . 1_555 N C17 C18 N4 156.0856(4) 2_665 . 2_665 N C17 C18 H29 114.8021(19) 2_665 . 3_565 N C17 C18 H31 31.4448(4) 2_665 . 3_565 N C17 C18 H32 111.3665(19) 2_665 . 2_665 N C19 C18 N4 113.8850(17) 1_555 . 1_555 N C19 C18 N4 109.7868(18) 1_555 . 2_665 N C19 C18 H29 159.2874(5) 1_555 . 3_565 N C19 C18 H31 73.6412(17) 1_555 . 3_565 N C19 C18 H32 164.23940(30) 1_555 . 2_665 N N4 C18 N4 19.63410(30) 1_555 . 2_665 N N4 C18 H29 64.6734(15) 1_555 . 3_565 N N4 C18 H31 165.79170(20) 1_555 . 3_565 N N4 C18 H32 79.0443(19) 1_555 . 2_665 N N4 C18 H29 75.6683(18) 2_665 . 3_565 N N4 C18 H31 171.78320(10) 2_665 . 3_565 N N4 C18 H32 85.4191(20) 2_665 . 2_665 N H29 C18 H31 103.8288(17) 3_565 . 3_565 N H29 C18 H32 19.0949(4) 3_565 . 2_665 N H31 C18 H32 91.8531(20) 3_565 . 2_665 N C2 C19 C2 77.2045(16) -201_454 . -202_344 N C2 C19 C2 70.9181(12) -201_454 . -203_444 N C2 C19 C4 19.4917(4) -201_565 . -203_555 N C2 C19 N2 75.7694(15) -201_565 . -201_565 N C2 C19 N2 52.6591(13) -201_565 . -202_455 N C2 C19 N2 51.2686(16) -201_565 . -203_555 N C2 C19 H4 67.94820(20) -201_565 . -201_565 N C2 C19 H5 54.21940(20) -201_565 . -201_565 N C2 C19 C15 34.2600(6) -201_565 . 3_565 N C2 C19 C17 44.74620(20) -201_565 . 2_665 N C2 C19 C18 3.02050(10) -201_565 . 1_555 N C2 C19 C19 109.7283(7) -201_565 . 2_665 N C2 C19 C19 99.38890(30) -201_565 . 3_565 N C2 C19 N5 108.3836(6) -201_565 . 1_555 N C2 C19 N5 90.7318 -201_565 . 2_665 N C2 C19 N5 100.5603(4) -201_565 . 3_565 N C2 C19 H34 74.1093(7) -201_565 . 2_665 N C2 C19 H38 108.8340(8) -201_565 . 1_555 N C2 C19 H38 99.6208(6) -201_565 . 3_565 N C2 C19 H39 112.2648(15) -201_565 . 1_555 N C2 C19 H39 131.6006(4) -201_565 . 2_665 N C2 C19 C2 59.8464(6) -202_344 . -203_444 N C2 C19 C4 88.6282(17) -202_455 . -203_555 N C2 C19 N2 29.23360(30) -202_455 . -201_565 N C2 C19 N2 63.9662(10) -202_455 . -202_455 N C2 C19 N2 26.1917 -202_455 . -203_555 N C2 C19 H4 95.5381(6) -202_455 . -201_565 N C2 C19 H5 121.9621(14) -202_455 . -201_565 N C2 C19 C15 93.0711(16) -202_455 . 3_565 N C2 C19 C17 121.3499(18) -202_455 . 2_665 N C2 C19 C18 80.2030(17) -202_455 . 1_555 N C2 C19 C19 34.0145(9) -202_455 . 2_665 N C2 C19 C19 74.37730(20) -202_455 . 3_565 N C2 C19 N5 42.5872(6) -202_455 . 1_555 N C2 C19 N5 96.07330(10) -202_455 . 2_665 N C2 C19 N5 52.9090(4) -202_455 . 3_565 N C2 C19 H34 138.4519(5) -202_455 . 2_665 N C2 C19 H38 95.5485(7) -202_455 . 1_555 N C2 C19 H38 113.95650(30) -202_455 . 3_565 N C2 C19 H39 151.83580(30) -202_455 . 1_555 N C2 C19 H39 66.0739(16) -202_455 . 2_665 N C2 C19 C4 90.2825(17) -203_555 . -203_555 N C2 C19 N2 31.12870(30) -203_555 . -201_565 N C2 C19 N2 18.711 -203_555 . -202_455 N C2 C19 N2 59.9495(9) -203_555 . -203_555 N C2 C19 H4 135.8723(14) -203_555 . -201_565 N C2 C19 H5 74.4143(5) -203_555 . -201_565 N C2 C19 C15 105.1532(18) -203_555 . 3_565 N C2 C19 C17 88.8278(9) -203_555 . 2_665 N C2 C19 C18 72.0172(13) -203_555 . 1_555 N C2 C19 C19 64.12590(20) -203_555 . 2_665 N C2 C19 C19 29.9099(9) -203_555 . 3_565 N C2 C19 N5 49.3881(4) -203_555 . 1_555 N C2 C19 N5 38.6982(6) -203_555 . 2_665 N C2 C19 N5 112.20320(20) -203_555 . 3_565 N C2 C19 H34 133.0754(4) -203_555 . 2_665 N C2 C19 H38 155.20250(10) -203_555 . 1_555 N C2 C19 H38 57.3459(10) -203_555 . 3_565 N C2 C19 H39 97.0480(11) -203_555 . 1_555 N C2 C19 H39 112.0301(6) -203_555 . 2_665 N C4 C19 N2 93.4736(19) -203_555 . -201_565 N C4 C19 N2 71.8308(17) -203_555 . -202_455 N C4 C19 N2 62.7607(17) -203_555 . -203_555 N C4 C19 H4 50.33580(20) -203_555 . -201_565 N C4 C19 H5 56.22610(30) -203_555 . -201_565 N C4 C19 C15 15.28870(20) -203_555 . 3_565 N C4 C19 C17 39.63220(20) -203_555 . 2_665 N C4 C19 C18 18.2783(4) -203_555 . 1_555 N C4 C19 C19 122.6337(9) -203_555 . 2_665 N C4 C19 C19 118.0385(7) -203_555 . 3_565 N C4 C19 N5 125.5895(10) -203_555 . 1_555 N C4 C19 N5 105.3713(4) -203_555 . 2_665 N C4 C19 N5 95.61410(20) -203_555 . 3_565 N C4 C19 H34 56.7032(11) -203_555 . 2_665 N C4 C19 H38 92.2709(12) -203_555 . 1_555 N C4 C19 H38 109.62270(30) -203_555 . 3_565 N C4 C19 H39 108.7220(14) -203_555 . 1_555 N C4 C19 H39 126.8203(6) -203_555 . 2_665 N N2 C19 N2 40.0011(5) -201_565 . -202_455 N N2 C19 N2 38.7894(4) -201_565 . -203_555 N N2 C19 H4 120.2110(10) -201_565 . -201_565 N N2 C19 H5 101.8391(10) -201_565 . -201_565 N N2 C19 C15 104.2987(19) -201_565 . 3_565 N N2 C19 C17 110.6986(14) -201_565 . 2_665 N N2 C19 C18 78.1887(16) -201_565 . 1_555 N N2 C19 C19 39.2152(7) -201_565 . 2_665 N N2 C19 C19 47.4057(5) -201_565 . 3_565 N N2 C19 N5 32.6201(9) -201_565 . 1_555 N N2 C19 N5 66.98960(20) -201_565 . 2_665 N N2 C19 N5 81.07450(10) -201_565 . 3_565 N N2 C19 H34 149.8768(8) -201_565 . 2_665 N N2 C19 H38 124.0739(4) -201_565 . 1_555 N N2 C19 H38 85.2210(6) -201_565 . 3_565 N N2 C19 H39 124.7074(7) -201_565 . 1_555 N N2 C19 H39 85.6752(11) -201_565 . 2_665 N N2 C19 N2 54.4386(13) -202_455 . -203_555 N N2 C19 H4 119.5992(15) -202_455 . -201_565 N N2 C19 H5 61.8381(5) -202_455 . -201_565 N N2 C19 C15 86.8965(19) -202_455 . 3_565 N N2 C19 C17 72.7512(9) -202_455 . 2_665 N N2 C19 C18 53.5560(13) -202_455 . 1_555 N N2 C19 C19 78.13790(20) -202_455 . 2_665 N N2 C19 C19 46.9302(10) -202_455 . 3_565 N N2 C19 N5 65.9432(5) -202_455 . 1_555 N N2 C19 N5 46.6658(10) -202_455 . 2_665 N N2 C19 N5 115.9537(5) -202_455 . 3_565 N N2 C19 H34 116.6643(4) -202_455 . 2_665 N N2 C19 H38 153.58600(30) -202_455 . 1_555 N N2 C19 H38 63.5083(14) -202_455 . 3_565 N N2 C19 H39 99.7215(15) -202_455 . 1_555 N N2 C19 H39 125.6241(6) -202_455 . 2_665 N N2 C19 H4 81.8121(6) -203_555 . -201_565 N N2 C19 H5 100.6621(16) -203_555 . -201_565 N N2 C19 C15 69.0988(16) -203_555 . 3_565 N N2 C19 C17 95.8880(18) -203_555 . 2_665 N N2 C19 C18 54.2856(16) -203_555 . 1_555 N N2 C19 C19 59.9630(9) -203_555 . 2_665 N N2 C19 C19 84.87980(10) -203_555 . 3_565 N N2 C19 N5 65.1808(7) -203_555 . 1_555 N N2 C19 N5 98.38520(20) -203_555 . 2_665 N N2 C19 N5 63.9150(7) -203_555 . 3_565 N N2 C19 H34 116.5494(6) -203_555 . 2_665 N N2 C19 H38 99.7359(10) -203_555 . 1_555 N N2 C19 H38 116.74290(10) -203_555 . 3_565 N N2 C19 H39 153.86501(30) -203_555 . 1_555 N N2 C19 H39 86.9715(17) -203_555 . 2_665 N H4 C19 H5 93.6655(4) -201_565 . -201_565 N H4 C19 C15 35.27190(30) -201_565 . 3_565 N H4 C19 C17 73.02970(30) -201_565 . 2_665 N H4 C19 C18 67.74240(20) -201_565 . 1_555 N H4 C19 C19 116.59300(10) -201_565 . 2_665 N H4 C19 C19 165.6440(5) -201_565 . 3_565 N H4 C19 N5 133.95261(10) -201_565 . 1_555 N H4 C19 N5 152.69009(30) -201_565 . 2_665 N H4 C19 N5 61.87950(10) -201_565 . 3_565 N H4 C19 H34 45.76530(20) -201_565 . 2_665 N H4 C19 H38 42.0167(10) -201_565 . 1_555 N H4 C19 H38 145.08540(10) -201_565 . 3_565 N H4 C19 H39 112.62440(30) -201_565 . 1_555 N H4 C19 H39 84.8631(5) -201_565 . 2_665 N H5 C19 C15 65.2251(5) -201_565 . 3_565 N H5 C19 C17 20.68900(10) -201_565 . 2_665 N H5 C19 C18 51.53240(10) -201_565 . 1_555 N H5 C19 C19 138.52080(30) -201_565 . 2_665 N H5 C19 C19 83.5031 -201_565 . 3_565 N H5 C19 N5 122.24750(20) -201_565 . 1_555 N H5 C19 N5 59.30900(10) -201_565 . 2_665 N H5 C19 N5 151.6753(5) -201_565 . 3_565 N H5 C19 H34 59.85960(20) -201_565 . 2_665 N H5 C19 H38 126.59650(30) -201_565 . 1_555 N H5 C19 H38 55.4719(7) -201_565 . 3_565 N H5 C19 H39 58.2982(17) -201_565 . 1_555 N H5 C19 H39 171.95959(10) -201_565 . 2_665 N C15 C19 C17 45.7241(4) 3_565 . 2_665 N C15 C19 C18 33.4052(6) 3_565 . 1_555 N C15 C19 C19 126.0033(7) 3_565 . 2_665 N C15 C19 C19 133.3197(9) 3_565 . 3_565 N C15 C19 N5 134.2658(9) 3_565 . 1_555 N C15 C19 N5 119.3421(5) 3_565 . 2_665 N C15 C19 N5 86.6504 3_565 . 3_565 N C15 C19 H34 47.5648(10) 3_565 . 2_665 N C15 C19 H38 77.2881(13) 3_565 . 1_555 N C15 C19 H38 120.58200(10) 3_565 . 3_565 N C15 C19 H39 109.5432(12) 3_565 . 1_555 N C15 C19 H39 116.0008(8) 3_565 . 2_665 N C17 C19 C18 41.72830(10) 2_665 . 1_555 N C17 C19 C19 149.8712(7) 2_665 . 2_665 N C17 C19 C19 103.15710(10) 2_665 . 3_565 N C17 C19 N5 138.2108(5) 2_665 . 1_555 N C17 C19 N5 79.81600(10) 2_665 . 2_665 N C17 C19 N5 132.1615(4) 2_665 . 3_565 N C17 C19 H34 44.2866(5) 2_665 . 2_665 N C17 C19 H38 108.5656(5) 2_665 . 1_555 N C17 C19 H38 75.6848(6) 2_665 . 3_565 N C17 C19 H39 69.6207(16) 2_665 . 1_555 N C17 C19 H39 156.99809(20) 2_665 . 2_665 N C18 C19 C19 112.6132(7) 1_555 . 2_665 N C18 C19 C19 99.98140(30) 1_555 . 3_565 N C18 C19 N5 110.8061(7) 1_555 . 1_555 N C18 C19 N5 90.0513 1_555 . 2_665 N C18 C19 N5 102.8374(4) 1_555 . 3_565 N C18 C19 H34 71.7165(8) 1_555 . 2_665 N C18 C19 H38 109.0902(8) 1_555 . 1_555 N C18 C19 H38 98.1230(6) 1_555 . 3_565 N C18 C19 H39 109.4398(16) 1_555 . 1_555 N C18 C19 H39 134.08800(30) 1_555 . 2_665 N C19 C19 C19 60.0 2_665 . 3_565 N C19 C19 N5 18.2812 2_665 . 1_555 N C19 C19 N5 85.9362 2_665 . 2_665 N C19 C19 N5 56.4221 2_665 . 3_565 N C19 C19 H34 160.335 2_665 . 2_665 N C19 C19 H38 94.0943 2_665 . 1_555 N C19 C19 H38 98.2636 2_665 . 3_565 N C19 C19 H39 123.9559(5) 2_665 . 1_555 N C19 C19 H39 48.0439(4) 2_665 . 2_665 N C19 C19 N5 41.7201 3_565 . 1_555 N C19 C19 N5 25.9376 3_565 . 2_665 N C19 C19 N5 116.4191 3_565 . 3_565 N C19 C19 H34 139.4389 3_565 . 2_665 N C19 C19 H38 147.2005(4) 3_565 . 1_555 N C19 C19 H38 40.49210(10) 3_565 . 3_565 N C19 C19 H39 77.84690(20) 3_565 . 1_555 N C19 C19 H39 99.82790(10) 3_565 . 2_665 N N5 C19 N5 67.6553 1_555 . 2_665 N N5 C19 N5 74.6996 1_555 . 3_565 N N5 C19 H34 177.33910(10) 1_555 . 2_665 N N5 C19 H38 111.13110(10) 1_555 . 1_555 N N5 C19 H38 80.5481 1_555 . 3_565 N N5 C19 H39 110.79110(30) 1_555 . 1_555 N N5 C19 H39 63.23050(20) 1_555 . 2_665 N N5 C19 N5 142.348 2_665 . 3_565 N N5 C19 H34 113.5579 2_665 . 2_665 N N5 C19 H38 159.0491(7) 2_665 . 1_555 N N5 C19 H38 18.6753(4) 2_665 . 3_565 N N5 C19 H39 58.5626(5) 2_665 . 1_555 N N5 C19 H39 122.44680(30) 2_665 . 2_665 N N5 C19 H34 104.084 3_565 . 2_665 N N5 C19 H38 42.99940(30) 3_565 . 1_555 N N5 C19 H38 151.93390(20) 3_565 . 3_565 N N5 C19 H39 141.7944(9) 3_565 . 1_555 N N5 C19 H39 31.6597(8) 3_565 . 2_665 N H34 C19 H38 66.8361 2_665 . 1_555 N H34 C19 H38 100.06470(10) 2_665 . 3_565 N H34 C19 H39 68.63390(20) 2_665 . 1_555 N H34 C19 H39 114.48950(30) 2_665 . 2_665 N H38 C19 H38 142.9038(11) 1_555 . 3_565 N H38 C19 H39 105.4284(12) 1_555 . 1_555 N H38 C19 H39 48.59890(30) 1_555 . 2_665 N H38 C19 H39 39.92280(10) 3_565 . 1_555 N H38 C19 H39 123.2094(9) 3_565 . 2_665 N H39 C19 H39 115.0342(18) 1_555 . 2_665 N C3 N4 C3 102.7906(16) -201_454 . -202_344 N C3 N4 C5 138.0977(11) -201_565 . -201_565 N C3 N4 C5 32.9387(4) -201_565 . -203_555 N C3 N4 C6 66.2772(19) -201_565 . -201_565 N C3 N4 C6 163.76210(20) -201_565 . -202_455 N C3 N4 C6 106.7594(7) -201_565 . -203_555 N C3 N4 C7 44.9189(14) -201_565 . -202_455 N C3 N4 C7 142.25000(10) -201_565 . -203_555 N C3 N4 N3 142.7002(4) -201_565 . -201_565 N C3 N4 N3 99.8798(14) -201_565 . -202_455 N C3 N4 N3 114.7473(12) -201_565 . -203_555 N C3 N4 C13 133.7647(6) -201_565 . 1_555 N C3 N4 C13 90.1394(18) -201_565 . 3_565 N C3 N4 C14 87.83970(10) -201_565 . 1_555 N C3 N4 C14 31.3547(6) -201_565 . 2_665 N C3 N4 C14 139.7339(10) -201_565 . 3_565 N C3 N4 C16 21.86920(10) -201_565 . 1_555 N C3 N4 C16 125.4078(15) -201_565 . 2_665 N C3 N4 C18 99.8059(19) -201_565 . 1_555 N C3 N4 C18 11.4977 -201_565 . 3_565 N C3 N4 N4 116.23310(30) -201_565 . 2_665 N C3 N4 N4 66.38390(30) -201_565 . 3_565 N C3 N4 H29 123.12830(10) -201_565 . 3_565 N C3 N4 C5 36.2988(5) -202_455 . -201_565 N C3 N4 C5 107.9166(6) -202_455 . -203_555 N C3 N4 C6 142.3019(5) -202_455 . -201_565 N C3 N4 C6 72.4803(19) -202_455 . -202_455 N C3 N4 C6 130.9226(4) -202_455 . -203_555 N C3 N4 C7 135.09340(10) -202_455 . -202_455 N C3 N4 C7 49.1540(14) -202_455 . -203_555 N C3 N4 N3 113.7775(12) -202_455 . -201_565 N C3 N4 N3 156.84081(20) -202_455 . -202_455 N C3 N4 N3 125.3877(10) -202_455 . -203_555 N C3 N4 C13 102.2129(17) -202_455 . 1_555 N C3 N4 C13 158.77380(10) -202_455 . 3_565 N C3 N4 C14 117.8661(6) -202_455 . 1_555 N C3 N4 C14 114.2055(6) -202_455 . 2_665 N C3 N4 C14 37.4958(6) -202_455 . 3_565 N C3 N4 C16 102.9042(10) -202_455 . 1_555 N C3 N4 C16 23.81160(20) -202_455 . 2_665 N C3 N4 C18 12.96700(10) -202_455 . 1_555 N C3 N4 C18 91.3024(17) -202_455 . 3_565 N C3 N4 N4 95.52580(10) -202_455 . 2_665 N C3 N4 N4 138.2389(8) -202_455 . 3_565 N C3 N4 H29 44.6984(11) -202_455 . 3_565 N C5 N4 C5 140.25160(20) -201_565 . -203_555 N C5 N4 C6 147.0530(5) -201_565 . -201_565 N C5 N4 C6 41.9936(12) -201_565 . -202_455 N C5 N4 C6 101.44180(10) -201_565 . -203_555 N C5 N4 C7 161.5232 -201_565 . -202_455 N C5 N4 C7 29.7083(5) -201_565 . -203_555 N C5 N4 N3 77.5526(7) -201_565 . -201_565 N C5 N4 N3 120.54280(30) -201_565 . -202_455 N C5 N4 N3 102.16750(10) -201_565 . -203_555 N C5 N4 C13 78.6690(8) -201_565 . 1_555 N C5 N4 C13 131.3968(7) -201_565 . 3_565 N C5 N4 C14 103.5421 -201_565 . 1_555 N C5 N4 C14 147.08810(20) -201_565 . 2_665 N C5 N4 C14 2.23430(10) -201_565 . 3_565 N C5 N4 C16 138.2804(5) -201_565 . 1_555 N C5 N4 C16 12.76530(30) -201_565 . 2_665 N C5 N4 C18 38.3621(7) -201_565 . 1_555 N C5 N4 C18 126.6868(12) -201_565 . 3_565 N C5 N4 N4 72.5009 -201_565 . 2_665 N C5 N4 N4 131.949 -201_565 . 3_565 N C5 N4 H29 42.56720(10) -201_565 . 3_565 N C5 N4 C6 43.3806(11) -203_555 . -201_565 N C5 N4 C6 132.62030(20) -203_555 . -202_455 N C5 N4 C6 118.2482 -203_555 . -203_555 N C5 N4 C7 27.2921(5) -203_555 . -202_455 N C5 N4 C7 122.11010(10) -203_555 . -203_555 N C5 N4 N3 131.0536(6) -203_555 . -201_565 N C5 N4 N3 93.70760(30) -203_555 . -202_455 N C5 N4 N3 87.2541(6) -203_555 . -203_555 N C5 N4 C13 101.93720(10) -203_555 . 1_555 N C5 N4 C13 74.2199(9) -203_555 . 3_565 N C5 N4 C14 112.08740(10) -203_555 . 1_555 N C5 N4 C14 6.8418 -203_555 . 2_665 N C5 N4 C14 140.06880(10) -203_555 . 3_565 N C5 N4 C16 12.03330(30) -203_555 . 1_555 N C5 N4 C16 130.4577(4) -203_555 . 2_665 N C5 N4 C18 112.2783(8) -203_555 . 1_555 N C5 N4 C18 37.5169(7) -203_555 . 3_565 N C5 N4 N4 143.9931 -203_555 . 2_665 N C5 N4 N4 84.7254 -203_555 . 3_565 N C5 N4 H29 103.1621 -203_555 . 3_565 N C6 N4 C6 107.5803(18) -201_565 . -202_455 N C6 N4 C6 86.0278(9) -201_565 . -203_555 N C6 N4 C7 21.3869(5) -201_565 . -202_455 N C6 N4 C7 117.7186(10) -201_565 . -203_555 N C6 N4 N3 87.7081(18) -201_565 . -201_565 N C6 N4 N3 53.7292(8) -201_565 . -202_455 N C6 N4 N3 48.5318(7) -201_565 . -203_555 N C6 N4 C13 70.1043(14) -201_565 . 1_555 N C6 N4 C13 31.48650(30) -201_565 . 3_565 N C6 N4 C14 98.29460(10) -201_565 . 1_555 N C6 N4 C14 39.5070(11) -201_565 . 2_665 N C6 N4 C14 144.8521(6) -201_565 . 3_565 N C6 N4 C16 53.3515(15) -201_565 . 1_555 N C6 N4 C16 151.6413 -201_565 . 2_665 N C6 N4 C18 152.16820(30) -201_565 . 1_555 N C6 N4 C18 75.7483(20) -201_565 . 3_565 N C6 N4 N4 121.9376(4) -201_565 . 2_665 N C6 N4 N4 72.81270(20) -201_565 . 3_565 N C6 N4 H29 109.1404(5) -201_565 . 3_565 N C6 N4 C6 87.2295(9) -202_455 . -203_555 N C6 N4 C7 128.2678(12) -202_455 . -202_455 N C6 N4 C7 25.7925(4) -202_455 . -203_555 N C6 N4 N3 47.2990(7) -202_455 . -201_565 N C6 N4 N3 86.9038(17) -202_455 . -202_455 N C6 N4 N3 60.2680(11) -202_455 . -203_555 N C6 N4 C13 37.4776(4) -202_455 . 1_555 N C6 N4 C13 90.4136(19) -202_455 . 3_565 N C6 N4 C14 108.18270(10) -202_455 . 1_555 N C6 N4 C14 135.7711(4) -202_455 . 2_665 N C6 N4 C14 39.8693(11) -202_455 . 3_565 N C6 N4 C16 142.58681(10) -202_455 . 1_555 N C6 N4 C16 53.2342(16) -202_455 . 2_665 N C6 N4 C18 78.8945(20) -202_455 . 1_555 N C6 N4 C18 157.66080(30) -202_455 . 3_565 N C6 N4 N4 79.92190(10) -202_455 . 2_665 N C6 N4 N4 127.5860(5) -202_455 . 3_565 N C6 N4 H29 42.8790(4) -202_455 . 3_565 N C6 N4 C7 92.6177(4) -203_555 . -202_455 N C6 N4 C7 110.9412(6) -203_555 . -203_555 N C6 N4 N3 42.22910(20) -203_555 . -201_565 N C6 N4 N3 34.59130(10) -203_555 . -202_455 N C6 N4 N3 74.5206(11) -203_555 . -203_555 N C6 N4 C13 84.4005(14) -203_555 . 1_555 N C6 N4 C13 58.1740(6) -203_555 . 3_565 N C6 N4 C14 28.9782(9) -203_555 . 1_555 N C6 N4 C14 111.436 -203_555 . 2_665 N C6 N4 C14 101.44450(10) -203_555 . 3_565 N C6 N4 C16 118.77990(30) -203_555 . 1_555 N C6 N4 C16 110.8620(4) -203_555 . 2_665 N C6 N4 C18 121.6617(6) -203_555 . 1_555 N C6 N4 C18 115.1095(7) -203_555 . 3_565 N C6 N4 N4 36.0305(5) -203_555 . 2_665 N C6 N4 N4 40.4808(4) -203_555 . 3_565 N C6 N4 H29 129.9586(6) -203_555 . 3_565 N C7 N4 C7 133.0894(5) -202_455 . -203_555 N C7 N4 N3 106.1393(11) -202_455 . -201_565 N C7 N4 N3 66.47780(20) -202_455 . -202_455 N C7 N4 N3 69.91820(20) -202_455 . -203_555 N C7 N4 C13 90.9794(8) -202_455 . 1_555 N C7 N4 C13 48.5014(4) -202_455 . 3_565 N C7 N4 C14 94.5759 -202_455 . 1_555 N C7 N4 C14 21.4276(5) -202_455 . 2_665 N C7 N4 C14 159.97610(10) -202_455 . 3_565 N C7 N4 C16 34.4307(10) -202_455 . 1_555 N C7 N4 C16 156.3281 -202_455 . 2_665 N C7 N4 C18 139.17120(30) -202_455 . 1_555 N C7 N4 C18 54.7049(15) -202_455 . 3_565 N C7 N4 N4 124.76470(10) -202_455 . 2_665 N C7 N4 N4 66.2734 -202_455 . 3_565 N C7 N4 H29 118.95640(20) -202_455 . 3_565 N C7 N4 N3 72.9361(4) -203_555 . -201_565 N C7 N4 N3 112.1144(13) -203_555 . -202_455 N C7 N4 N3 77.9409(5) -203_555 . -203_555 N C7 N4 C13 53.91130(30) -203_555 . 1_555 N C7 N4 C13 111.1705(14) -203_555 . 3_565 N C7 N4 C14 125.6734 -203_555 . 1_555 N C7 N4 C14 127.9749 -203_555 . 2_665 N C7 N4 C14 27.6498(4) -203_555 . 3_565 N C7 N4 C16 127.35990(10) -203_555 . 1_555 N C7 N4 C16 35.7487(10) -203_555 . 2_665 N C7 N4 C18 58.2459(15) -203_555 . 1_555 N C7 N4 C18 132.84450(10) -203_555 . 3_565 N C7 N4 N4 93.8951 -203_555 . 2_665 N C7 N4 N4 151.00169(20) -203_555 . 3_565 N C7 N4 H29 19.79950(10) -203_555 . 3_565 N N3 N4 N3 43.1561(10) -201_565 . -202_455 N N3 N4 N3 47.8289(14) -201_565 . -203_555 N N3 N4 C13 45.7024(13) -201_565 . 1_555 N N3 N4 C13 57.6476(15) -201_565 . 3_565 N N3 N4 C14 69.1936(7) -201_565 . 1_555 N N3 N4 C14 126.9278(6) -201_565 . 2_665 N N3 N4 C14 76.2846(6) -201_565 . 3_565 N N3 N4 C16 140.52490(20) -201_565 . 1_555 N N3 N4 C16 90.2448(11) -201_565 . 2_665 N N3 N4 C18 114.1347(15) -201_565 . 1_555 N N3 N4 C18 153.7450(5) -201_565 . 3_565 N N3 N4 N4 54.9264(9) -201_565 . 2_665 N N3 N4 N4 81.02410(20) -201_565 . 3_565 N N3 N4 H29 89.6515(4) -201_565 . 3_565 N N3 N4 N3 45.5971(12) -202_455 . -203_555 N N3 N4 C13 64.1989(18) -202_455 . 1_555 N N3 N4 C13 23.7221(5) -202_455 . 3_565 N N3 N4 C14 58.1402(10) -202_455 . 1_555 N N3 N4 C14 87.84650(30) -202_455 . 2_665 N N3 N4 C14 119.3783(4) -202_455 . 3_565 N N3 N4 C16 99.8867(8) -202_455 . 1_555 N N3 N4 C16 133.07320(10) -202_455 . 2_665 N N3 N4 C18 153.6273(5) -202_455 . 1_555 N N3 N4 C18 111.2840(15) -202_455 . 3_565 N N3 N4 N4 69.9465(4) -202_455 . 2_665 N N3 N4 N4 49.9284(10) -202_455 . 3_565 N N3 N4 H29 123.1919(12) -202_455 . 3_565 N N3 N4 C13 24.1066(8) -203_555 . 1_555 N N3 N4 C13 33.6277(9) -203_555 . 3_565 N N3 N4 C14 102.30610(20) -203_555 . 1_555 N N3 N4 C14 85.6528(5) -203_555 . 2_665 N N3 N4 C14 99.9979 -203_555 . 3_565 N N3 N4 C16 98.9577(10) -203_555 . 1_555 N N3 N4 C16 112.4759(5) -203_555 . 2_665 N N3 N4 C18 136.0841(10) -203_555 . 1_555 N N3 N4 C18 123.5238(13) -203_555 . 3_565 N N3 N4 N4 101.2683(4) -203_555 . 2_665 N N3 N4 N4 94.05730(10) -203_555 . 3_565 N N3 N4 H29 81.08920(10) -203_555 . 3_565 N C13 N4 C13 57.3352(17) 1_555 . 3_565 N C13 N4 C14 113.2428(5) 1_555 . 1_555 N C13 N4 C14 102.5068 1_555 . 2_665 N C13 N4 C14 76.4592(8) 1_555 . 3_565 N C13 N4 C16 113.9046(5) 1_555 . 1_555 N C13 N4 C16 88.4584(13) 1_555 . 2_665 N C13 N4 C18 112.1508(17) 1_555 . 1_555 N C13 N4 C18 139.2338(8) 1_555 . 3_565 N C13 N4 N4 99.21670(30) 1_555 . 2_665 N C13 N4 N4 114.1144(8) 1_555 . 3_565 N C13 N4 H29 59.3563(6) 1_555 . 3_565 N C13 N4 C14 78.8841(5) 3_565 . 1_555 N C13 N4 C14 69.4282(9) 3_565 . 2_665 N C13 N4 C14 129.5099(8) 3_565 . 3_565 N C13 N4 C16 82.8838(13) 3_565 . 1_555 N C13 N4 C16 143.53259(30) 3_565 . 2_665 N C13 N4 C18 169.24879(10) 3_565 . 1_555 N C13 N4 C18 101.2605(19) 3_565 . 3_565 N C13 N4 N4 93.66120(10) 3_565 . 2_665 N C13 N4 N4 62.4577(7) 3_565 . 3_565 N C13 N4 H29 114.0823(10) 3_565 . 3_565 N C14 N4 C14 105.9049 1_555 . 2_665 N C14 N4 C14 104.6483 1_555 . 3_565 N C14 N4 C16 106.51890(20) 1_555 . 1_555 N C14 N4 C16 107.36860(20) 1_555 . 2_665 N C14 N4 C18 105.3758(5) 1_555 . 1_555 N C14 N4 C18 92.84060(20) 1_555 . 3_565 N C14 N4 N4 32.0037 1_555 . 2_665 N C14 N4 N4 28.4175 1_555 . 3_565 N C14 N4 H29 144.675 1_555 . 3_565 N C14 N4 C14 146.90820(10) 2_665 . 3_565 N C14 N4 C16 13.8496(4) 2_665 . 1_555 N C14 N4 C16 137.0790(4) 2_665 . 2_665 N C14 N4 C18 117.7693(8) 2_665 . 1_555 N C14 N4 C18 38.0154(8) 2_665 . 3_565 N C14 N4 N4 137.9064 2_665 . 2_665 N C14 N4 N4 78.2259 2_665 . 3_565 N C14 N4 H29 109.4163 2_665 . 3_565 N C14 N4 C16 138.8080(5) 3_565 . 1_555 N C14 N4 C16 14.3298(4) 3_565 . 2_665 N C14 N4 C18 40.1500(8) 3_565 . 1_555 N C14 N4 C18 128.2785(11) 3_565 . 3_565 N C14 N4 N4 73.3503 3_565 . 2_665 N C14 N4 N4 133.0637 3_565 . 3_565 N C14 N4 H29 41.10370(10) 3_565 . 3_565 N C16 N4 C16 126.5813(9) 1_555 . 2_665 N C16 N4 C18 104.9109(13) 1_555 . 1_555 N C16 N4 C18 25.48440(30) 1_555 . 3_565 N C16 N4 N4 137.05119(20) 1_555 . 2_665 N C16 N4 N4 81.1879 1_555 . 3_565 N C16 N4 H29 107.62440(10) 1_555 . 3_565 N C16 N4 C18 25.9465(4) 2_665 . 1_555 N C16 N4 C18 113.9636(15) 2_665 . 3_565 N C16 N4 N4 78.5947 2_665 . 2_665 N C16 N4 N4 134.68320(20) 2_665 . 3_565 N C16 N4 H29 42.5391(5) 2_665 . 3_565 N C18 N4 C18 88.4969(19) 1_555 . 3_565 N C18 N4 N4 85.64080(10) 1_555 . 2_665 N C18 N4 N4 125.4091(7) 1_555 . 3_565 N C18 N4 H29 56.8411(11) 1_555 . 3_565 N C18 N4 N4 117.7494(5) 3_565 . 2_665 N C18 N4 N4 74.72500(30) 3_565 . 3_565 N C18 N4 H29 114.82560(10) 3_565 . 3_565 N N4 N4 N4 60.0 2_665 . 3_565 N N4 N4 H29 112.6716 2_665 . 3_565 N N4 N4 H29 170.43770(10) 3_565 . 3_565 N C2 N5 C2 83.3341(17) -202_344 . -203_444 N C2 N5 N2 43.9959(11) -202_455 . -201_565 N C2 N5 N2 69.7166(11) -202_455 . -202_455 N C2 N5 N2 39.9823(5) -202_455 . -203_555 N C2 N5 H4 63.37350(30) -202_455 . -202_455 N C2 N5 H5 107.7274(17) -202_455 . -203_555 N C2 N5 C15 34.5223(6) -202_455 . 1_555 N C2 N5 C17 108.2528(18) -202_455 . 1_555 N C2 N5 C17 30.12370(30) -202_455 . 3_565 N C2 N5 C19 74.19350(30) -202_455 . 1_555 N C2 N5 C19 52.4231(9) -202_455 . 2_665 N C2 N5 C19 107.9152(4) -202_455 . 3_565 N C2 N5 N5 99.66520(20) -202_455 . 2_665 N C2 N5 N5 62.2569(6) -202_455 . 3_565 N C2 N5 H38 114.6903(10) -202_455 . 2_665 N C2 N5 H39 75.5878(18) -202_455 . 2_665 N C2 N5 H39 170.6905 -202_455 . 3_565 N C2 N5 N2 39.3445(6) -203_555 . -201_565 N C2 N5 N2 32.4572(4) -203_555 . -202_455 N C2 N5 N2 65.8773(9) -203_555 . -203_555 N C2 N5 H4 121.6568(14) -203_555 . -202_455 N C2 N5 H5 49.7852(4) -203_555 . -203_555 N C2 N5 C15 101.3186(20) -203_555 . 1_555 N C2 N5 C17 37.24750(20) -203_555 . 1_555 N C2 N5 C17 112.0627(14) -203_555 . 3_565 N C2 N5 C19 74.12380(20) -203_555 . 1_555 N C2 N5 C19 109.22070(30) -203_555 . 2_665 N C2 N5 C19 42.1547(9) -203_555 . 3_565 N C2 N5 N5 47.4627(8) -203_555 . 2_665 N C2 N5 N5 89.7433 -203_555 . 3_565 N C2 N5 H38 139.9288(4) -203_555 . 2_665 N C2 N5 H39 129.6595(5) -203_555 . 2_665 N C2 N5 H39 87.4155(18) -203_555 . 3_565 N N2 N5 N2 36.23820(20) -201_565 . -202_455 N N2 N5 N2 39.7097(4) -201_565 . -203_555 N N2 N5 H4 94.2561(12) -201_565 . -202_455 N N2 N5 H5 74.7092(10) -201_565 . -203_555 N N2 N5 C15 66.8336(15) -201_565 . 1_555 N N2 N5 C17 68.8278(8) -201_565 . 1_555 N N2 N5 C17 73.2685(7) -201_565 . 3_565 N N2 N5 C19 69.1519(7) -201_565 . 1_555 N N2 N5 C19 81.24430(30) -201_565 . 2_665 N N2 N5 C19 71.5372(6) -201_565 . 3_565 N N2 N5 N5 68.9790(7) -201_565 . 2_665 N N2 N5 N5 73.0549(5) -201_565 . 3_565 N N2 N5 H38 142.77049(20) -201_565 . 2_665 N N2 N5 H39 107.1195(11) -201_565 . 2_665 N N2 N5 H39 126.7339(11) -201_565 . 3_565 N N2 N5 N2 37.8118(4) -202_455 . -203_555 N N2 N5 H4 129.5741(14) -202_455 . -202_455 N N2 N5 H5 82.2249(7) -202_455 . -203_555 N N2 N5 C15 100.4953(17) -202_455 . 1_555 N N2 N5 C17 69.0611(6) -202_455 . 1_555 N N2 N5 C17 90.9856(8) -202_455 . 3_565 N N2 N5 C19 42.8332(6) -202_455 . 1_555 N N2 N5 C19 77.90110(10) -202_455 . 2_665 N N2 N5 C19 38.4301(7) -202_455 . 3_565 N N2 N5 N5 33.1031(9) -202_455 . 2_665 N N2 N5 N5 57.2861(4) -202_455 . 3_565 N N2 N5 H38 172.16479(10) -202_455 . 2_665 N N2 N5 H39 97.2313(8) -202_455 . 2_665 N N2 N5 H39 102.7528(11) -202_455 . 3_565 N N2 N5 H4 102.7953(8) -203_555 . -202_455 N N2 N5 H5 112.3511(13) -203_555 . -203_555 N N2 N5 C15 74.5001(11) -203_555 . 1_555 N N2 N5 C17 102.6287(11) -203_555 . 1_555 N N2 N5 C17 53.75170(30) -203_555 . 3_565 N N2 N5 C19 36.4122(9) -203_555 . 1_555 N N2 N5 C19 44.1751(7) -203_555 . 2_665 N N2 N5 C19 71.49860(20) -203_555 . 3_565 N N2 N5 N5 61.14280(30) -203_555 . 2_665 N N2 N5 N5 33.6939(9) -203_555 . 3_565 N N2 N5 H38 149.24590(30) -203_555 . 2_665 N N2 N5 H39 68.7439(15) -203_555 . 2_665 N N2 N5 H39 135.6088(6) -203_555 . 3_565 N H4 N5 H5 94.8945(5) -202_455 . -203_555 N H4 N5 C15 29.62910(30) -202_455 . 1_555 N H4 N5 C17 108.8750(6) -202_455 . 1_555 N H4 N5 C17 55.61250(20) -202_455 . 3_565 N H4 N5 C19 130.69099(10) -202_455 . 1_555 N H4 N5 C19 87.5172 -202_455 . 2_665 N H4 N5 C19 163.7993(5) -202_455 . 3_565 N H4 N5 N5 162.4545(5) -202_455 . 2_665 N H4 N5 N5 111.27840(10) -202_455 . 3_565 N H4 N5 H38 52.6222(12) -202_455 . 2_665 N H4 N5 H39 88.4289(5) -202_455 . 2_665 N H4 N5 H39 121.54630(20) -202_455 . 3_565 N H5 N5 C15 97.5835(12) -203_555 . 1_555 N H5 N5 C17 15.12760(10) -203_555 . 1_555 N H5 N5 C17 133.6644(13) -203_555 . 3_565 N H5 N5 C19 122.10050(20) -203_555 . 1_555 N H5 N5 C19 155.9422(7) -203_555 . 2_665 N H5 N5 C19 74.21990(10) -203_555 . 3_565 N H5 N5 N5 85.8424 -203_555 . 2_665 N H5 N5 N5 139.4832(4) -203_555 . 3_565 N H5 N5 H38 90.1474(8) -203_555 . 2_665 N H5 N5 H39 176.103 -203_555 . 2_665 N H5 N5 H39 64.9901(17) -203_555 . 3_565 N C15 N5 C17 106.7310(14) 1_555 . 1_555 N C15 N5 C17 38.61840(10) 1_555 . 3_565 N C15 N5 C19 107.35090(30) 1_555 . 1_555 N C15 N5 C19 73.14020(30) 1_555 . 2_665 N C15 N5 C19 138.2283(9) 1_555 . 3_565 N C15 N5 N5 132.8707(8) 1_555 . 2_665 N C15 N5 N5 91.7183 1_555 . 3_565 N C15 N5 H38 82.2164(15) 1_555 . 2_665 N C15 N5 H39 86.3118(12) 1_555 . 2_665 N C15 N5 H39 148.3672(5) 1_555 . 3_565 N C17 N5 C17 137.6536(14) 1_555 . 3_565 N C17 N5 C19 107.27840(10) 1_555 . 1_555 N C17 N5 C19 146.4535(4) 1_555 . 2_665 N C17 N5 C19 59.33420(20) 1_555 . 3_565 N C17 N5 N5 70.76100(10) 1_555 . 2_665 N C17 N5 N5 125.61700(20) 1_555 . 3_565 N C17 N5 H38 103.1392(6) 1_555 . 2_665 N C17 N5 H39 162.28281(10) 1_555 . 2_665 N C17 N5 H39 63.1306(18) 1_555 . 3_565 N C17 N5 C19 75.07930(10) 3_565 . 1_555 N C17 N5 C19 34.7018(4) 3_565 . 2_665 N C17 N5 C19 124.08010(20) 3_565 . 3_565 N C17 N5 N5 112.17980(10) 3_565 . 2_665 N C17 N5 N5 56.07250(20) 3_565 . 3_565 N C17 N5 H38 95.6042(6) 3_565 . 2_665 N C17 N5 H39 50.1261(13) 3_565 . 2_665 N C17 N5 H39 158.9566(4) 3_565 . 3_565 N C19 N5 C19 45.2997 1_555 . 2_665 N C19 N5 C19 52.3437 1_555 . 3_565 N C19 N5 N5 39.5833 1_555 . 2_665 N C19 N5 N5 20.4179 1_555 . 3_565 N C19 N5 H38 143.4591(7) 1_555 . 2_665 N C19 N5 H39 56.37630(30) 1_555 . 2_665 N C19 N5 H39 104.28100(20) 1_555 . 3_565 N C19 N5 C19 97.6403 2_665 . 3_565 N C19 N5 N5 84.8825 2_665 . 2_665 N C19 N5 N5 24.8878 2_665 . 3_565 N C19 N5 H38 109.93410(20) 2_665 . 2_665 N C19 N5 H39 26.0273(8) 2_665 . 2_665 N C19 N5 H39 132.7662(8) 2_665 . 3_565 N C19 N5 N5 12.7642 3_565 . 2_665 N C19 N5 N5 72.7614 3_565 . 3_565 N C19 N5 H38 137.3121(6) 3_565 . 2_665 N C19 N5 H39 102.94930(10) 3_565 . 2_665 N C19 N5 H39 65.2036(4) 3_565 . 3_565 N N5 N5 N5 60.0 2_665 . 3_565 N N5 N5 H38 144.9105(8) 2_665 . 2_665 N N5 N5 H39 91.6037 2_665 . 2_665 N N5 N5 H39 74.60060(20) 2_665 . 3_565 N N5 N5 H38 130.2598(4) 3_565 . 2_665 N N5 N5 H39 40.0059(5) 3_565 . 2_665 N N5 N5 H39 118.9182(5) 3_565 . 3_565 N H38 N5 H39 90.2577(9) 2_665 . 2_665 N H38 N5 H39 72.1624(10) 2_665 . 3_565 N H39 N5 H39 111.4900(18) 2_665 . 3_565 N C9 H22 C9 46.57090(30) -201_565 . -203_555 N C9 H22 C10 102.5471(11) -201_565 . 2_665 N C9 H22 C10 65.4246(17) -201_565 . -201_565 N C9 H22 C10 88.0555(9) -201_565 . -203_555 N C9 H22 H18 104.0955(17) -201_565 . -203_555 N C9 H22 H19 66.6178(6) -201_565 . -202_455 N C9 H22 H19 17.60750(10) -201_565 . -203_555 N C9 H22 H20 151.82640(30) -201_565 . 2_665 N C9 H22 H21 76.6050(15) -201_565 . 3_565 N C9 H22 H21 117.7023(6) -201_565 . -201_565 N C9 H22 C11 72.84790(10) -201_565 . 1_555 N C9 H22 C11 26.16820(30) -201_565 . 2_665 N C9 H22 C12 49.90930(20) -201_565 . 2_665 N C9 H22 C10 122.1509(16) -203_555 . 2_665 N C9 H22 C10 107.8132(14) -203_555 . -201_565 N C9 H22 C10 83.3593(19) -203_555 . -203_555 N C9 H22 H18 71.7423(18) -203_555 . -203_555 N C9 H22 H19 24.99090(20) -203_555 . -202_455 N C9 H22 H19 55.1365(7) -203_555 . -203_555 N C9 H22 H20 150.9487(6) -203_555 . 2_665 N C9 H22 H21 120.9242(12) -203_555 . 3_565 N C9 H22 H21 130.7469(13) -203_555 . -201_565 N C9 H22 C11 47.7862(7) -203_555 . 1_555 N C9 H22 C11 72.62930(10) -203_555 . 2_665 N C9 H22 C12 27.5754(6) -203_555 . 2_665 N C10 H22 C10 47.8686(9) 2_665 . -201_565 N C10 H22 C10 42.2657(4) 2_665 . -203_555 N C10 H22 H18 151.4508(7) 2_665 . -203_555 N C10 H22 H19 108.1562(15) 2_665 . -202_455 N C10 H22 H19 112.0966(11) 2_665 . -203_555 N C10 H22 H20 51.1076(14) 2_665 . 2_665 N C10 H22 H21 47.0954(11) 2_665 . 3_565 N C10 H22 H21 15.2183(5) 2_665 . -201_565 N C10 H22 C11 79.9906(7) 2_665 . 1_555 N C10 H22 C11 90.1443(4) 2_665 . 2_665 N C10 H22 C12 147.1643(11) 2_665 . 2_665 N C10 H22 C10 71.9012(10) -201_565 . -203_555 N C10 H22 H18 157.94991(30) -201_565 . -203_555 N C10 H22 H19 115.5111(9) -201_565 . -202_455 N C10 H22 H19 67.8311(19) -201_565 . -203_555 N C10 H22 H20 86.9578(19) -201_565 . 2_665 N C10 H22 H21 13.86220(20) -201_565 . 3_565 N C10 H22 H21 60.9117(14) -201_565 . -201_565 N C10 H22 C11 96.87070(10) -201_565 . 1_555 N C10 H22 C11 44.6352(12) -201_565 . 2_665 N C10 H22 C12 114.5759(15) -201_565 . 2_665 N C10 H22 H18 128.8182(7) -203_555 . -203_555 N C10 H22 H19 65.9669(19) -203_555 . -202_455 N C10 H22 H19 105.0454(8) -203_555 . -203_555 N C10 H22 H20 77.5966(14) -203_555 . 2_665 N C10 H22 H21 79.4764(13) -203_555 . 3_565 N C10 H22 H21 47.4212(6) -203_555 . -201_565 N C10 H22 C11 37.8096(11) -203_555 . 1_555 N C10 H22 C11 94.12640(20) -203_555 . 2_665 N C10 H22 C12 110.9121(13) -203_555 . 2_665 N H18 H22 H19 73.8291(13) -203_555 . -202_455 N H18 H22 H19 96.3188(18) -203_555 . -203_555 N H18 H22 H20 103.7869(20) -203_555 . 2_665 N H18 H22 H21 151.5503(6) -203_555 . 3_565 N H18 H22 H21 136.6567(12) -203_555 . -201_565 N H18 H22 C11 98.2381(5) -203_555 . 1_555 N H18 H22 C11 118.3889(11) -203_555 . 2_665 N H18 H22 C12 54.9721(16) -203_555 . 2_665 N H19 H22 H19 78.5808(9) -202_455 . -203_555 N H19 H22 H20 126.0176(8) -202_455 . 2_665 N H19 H22 H21 129.2323(7) -202_455 . 3_565 N H19 H22 H21 111.6270(14) -202_455 . -201_565 N H19 H22 C11 28.1707(8) -202_455 . 1_555 N H19 H22 C11 92.27990(20) -202_455 . 2_665 N H19 H22 C12 48.9171(7) -202_455 . 2_665 N H19 H22 H20 151.6417 -203_555 . 2_665 N H19 H22 H21 75.8193(18) -203_555 . 3_565 N H19 H22 H21 127.0205(6) -203_555 . -201_565 N H19 H22 C11 89.44030(20) -203_555 . 1_555 N H19 H22 C11 23.2026(7) -203_555 . 2_665 N H19 H22 C12 47.7570(4) -203_555 . 2_665 N H20 H22 H21 77.0018(18) 2_665 . 3_565 N H20 H22 H21 36.6797(9) 2_665 . -201_565 N H20 H22 C11 106.94180(10) 2_665 . 1_555 N H20 H22 C11 130.0230(7) 2_665 . 2_665 N H20 H22 C12 158.2441(4) 2_665 . 2_665 N H21 H22 H21 57.2457(15) 3_565 . -201_565 N H21 H22 C11 108.82550(10) 3_565 . 1_555 N H21 H22 C11 53.0964(11) 3_565 . 2_665 N H21 H22 C12 123.5747(14) 3_565 . 2_665 N H21 H22 C11 84.2775(6) -201_565 . 1_555 N H21 H22 C11 104.58040(10) -201_565 . 2_665 N H21 H22 C12 158.1746(7) -201_565 . 2_665 N C11 H22 C11 92.9658 1_555 . 2_665 N C11 H22 C12 74.90460(10) 1_555 . 2_665 N C11 H22 C12 70.62320(30) 2_665 . 2_665 N C9 H23 C10 61.0720(15) -203_555 . -203_555 N C9 H23 H19 12.90670(10) -203_555 . -202_455 N C9 H23 H20 113.3707(6) -203_555 . -203_555 N C9 H23 H21 76.3172(15) -203_555 . 2_665 N C9 H23 C11 25.5861(4) -203_555 . 1_555 N C10 H23 H19 65.3454(18) -203_555 . -202_455 N C10 H23 H20 52.3127(9) -203_555 . -203_555 N C10 H23 H21 15.3916 -203_555 . 2_665 N C10 H23 C11 38.7976(11) -203_555 . 1_555 N H19 H23 H20 116.6124(9) -202_455 . -203_555 N H19 H23 H21 80.6777(18) -202_455 . 2_665 N H19 H23 C11 26.6584(8) -202_455 . 1_555 N H20 H23 H21 37.0671(9) -203_555 . 2_665 N H20 H23 C11 90.09580(10) -203_555 . 1_555 N H21 H23 C11 54.0621(11) 2_665 . 1_555 N C8 H24 C8 100.8999(10) -202_455 . -203_555 N C8 H24 C9 98.4246(18) -202_455 . -201_565 N C8 H24 C9 146.6986(7) -202_455 . -202_455 N C8 H24 H16 72.2567(5) -202_455 . -202_455 N C8 H24 H17 44.7465(9) -202_455 . -202_455 N C8 H24 H17 125.6234(12) -202_455 . -203_555 N C8 H24 H18 74.8020(18) -202_455 . -201_565 N C8 H24 H19 159.0813(4) -202_455 . -201_565 N C8 H24 C11 147.1360(7) -202_455 . 3_565 N C8 H24 C12 110.9943(5) -202_455 . 1_555 N C8 H24 C12 79.91300(20) -202_455 . 2_665 N C8 H24 C12 55.8627(6) -202_455 . 3_565 N C8 H24 C13 64.3421(18) -202_455 . 3_565 N C8 H24 H25 43.7855(7) -202_455 . 3_565 N C8 H24 H26 13.28270(30) -202_455 . 2_665 N C8 H24 C9 95.0027(6) -203_555 . -201_565 N C8 H24 C9 58.9383(15) -203_555 . -202_455 N C8 H24 H16 140.8863(8) -203_555 . -202_455 N C8 H24 H17 116.13200(10) -203_555 . -202_455 N C8 H24 H17 45.3228 -203_555 . -203_555 N C8 H24 H18 136.17120(10) -203_555 . -201_565 N C8 H24 H19 84.0947(11) -203_555 . -201_565 N C8 H24 C11 95.3374(8) -203_555 . 3_565 N C8 H24 C12 12.1522(4) -203_555 . 1_555 N C8 H24 C12 50.07730(10) -203_555 . 2_665 N C8 H24 C12 87.9269 -203_555 . 3_565 N C8 H24 C13 55.02510(20) -203_555 . 3_565 N C8 H24 H25 135.82091(30) -203_555 . 3_565 N C8 H24 H26 111.2271(12) -203_555 . 2_665 N C9 H24 C9 61.1108(12) -201_565 . -202_455 N C9 H24 H16 123.93300(20) -201_565 . -202_455 N C9 H24 H17 56.4678(9) -201_565 . -202_455 N C9 H24 H17 121.32020(30) -201_565 . -203_555 N C9 H24 H18 44.7531(4) -201_565 . -201_565 N C9 H24 H19 60.7577(15) -201_565 . -201_565 N C9 H24 C11 51.4791(12) -201_565 . 3_565 N C9 H24 C12 86.75540(10) -201_565 . 1_555 N C9 H24 C12 54.0991(7) -201_565 . 2_665 N C9 H24 C12 45.4697(11) -201_565 . 3_565 N C9 H24 C13 137.4704(9) -201_565 . 3_565 N C9 H24 H25 71.5530(7) -201_565 . 3_565 N C9 H24 H26 105.0700(16) -201_565 . 2_665 N C9 H24 H16 140.51460(20) -202_455 . -202_455 N C9 H24 H17 116.62060(30) -202_455 . -202_455 N C9 H24 H17 61.0863(9) -202_455 . -203_555 N C9 H24 H18 100.8971(16) -202_455 . -201_565 N C9 H24 H19 26.2783(5) -202_455 . -201_565 N C9 H24 C11 36.3992(7) -202_455 . 3_565 N C9 H24 C12 46.8265(11) -202_455 . 1_555 N C9 H24 C12 66.8223(5) -202_455 . 2_665 N C9 H24 C12 94.6809 -202_455 . 3_565 N C9 H24 C13 111.5695(18) -202_455 . 3_565 N C9 H24 H25 132.1721(5) -202_455 . 3_565 N C9 H24 H26 159.6302(4) -202_455 . 2_665 N H16 H24 H17 86.58990(10) -202_455 . -202_455 N H16 H24 H17 106.69600(20) -202_455 . -203_555 N H16 H24 H18 80.4903(6) -202_455 . -201_565 N H16 H24 H19 116.27330(20) -202_455 . -201_565 N H16 H24 C11 111.1048(4) -202_455 . 3_565 N H16 H24 C12 148.96080(30) -202_455 . 1_555 N H16 H24 C12 151.56560(30) -202_455 . 2_665 N H16 H24 C12 115.59830(10) -202_455 . 3_565 N H16 H24 C13 89.2131(10) -202_455 . 3_565 N H16 H24 H25 64.32110(10) -202_455 . 3_565 N H16 H24 H26 58.98230(20) -202_455 . 2_665 N H17 H24 H17 160.97701(20) -202_455 . -203_555 N H17 H24 H18 33.9990(8) -202_455 . -201_565 N H17 H24 H19 114.8149(5) -202_455 . -201_565 N H17 H24 C11 102.40220(10) -202_455 . 3_565 N H17 H24 C12 118.1004 -202_455 . 1_555 N H17 H24 C12 69.2015 -202_455 . 2_665 N H17 H24 C12 29.8032 -202_455 . 3_565 N H17 H24 C13 106.4430(8) -202_455 . 3_565 N H17 H24 H25 22.494 -202_455 . 3_565 N H17 H24 H26 48.8010(7) -202_455 . 2_665 N H17 H24 H18 159.4185(6) -203_555 . -201_565 N H17 H24 H19 72.0144(9) -203_555 . -201_565 N H17 H24 C11 85.7478(5) -203_555 . 3_565 N H17 H24 C12 45.1009 -203_555 . 1_555 N H17 H24 C12 94.0482 -203_555 . 2_665 N H17 H24 C12 133.0617 -203_555 . 3_565 N H17 H24 C13 61.2817(6) -203_555 . 3_565 N H17 H24 H25 166.6865(4) -203_555 . 3_565 N H17 H24 H26 126.8385(12) -203_555 . 2_665 N H18 H24 H19 87.4747(15) -201_565 . -201_565 N H18 H24 C11 73.6962(11) -201_565 . 3_565 N H18 H24 C12 130.53360(30) -201_565 . 1_555 N H18 H24 C12 86.82 -201_565 . 2_665 N H18 H24 C12 52.9455(4) -201_565 . 3_565 N H18 H24 C13 139.06641(10) -201_565 . 3_565 N H18 H24 H25 33.0276(10) -201_565 . 3_565 N H18 H24 H26 73.5524(18) -201_565 . 2_665 N H19 H24 C11 13.8847(4) -201_565 . 3_565 N H19 H24 C12 72.2379(6) -201_565 . 1_555 N H19 H24 C12 88.23150(10) -201_565 . 2_665 N H19 H24 C12 104.51430(30) -201_565 . 3_565 N H19 H24 C13 131.7705(15) -201_565 . 3_565 N H19 H24 H25 120.2982(5) -201_565 . 3_565 N H19 H24 H26 160.86440(30) -201_565 . 2_665 N C11 H24 C12 83.21870(30) 3_565 . 1_555 N C11 H24 C12 89.21280(10) 3_565 . 2_665 N C11 H24 C12 96.82490(10) 3_565 . 3_565 N C11 H24 C13 145.5566(11) 3_565 . 3_565 N C11 H24 H25 106.43220(10) 3_565 . 3_565 N C11 H24 H26 146.9799(7) 3_565 . 2_665 N C12 H24 C12 49.0946 1_555 . 2_665 N C12 H24 C12 88.4777 1_555 . 3_565 N C12 H24 C13 66.8239(6) 1_555 . 3_565 N C12 H24 H25 139.94020(10) 1_555 . 3_565 N C12 H24 H26 122.1980(8) 1_555 . 2_665 N C12 H24 C12 39.4333 2_665 . 3_565 N C12 H24 C13 83.85770(10) 2_665 . 3_565 N C12 H24 H25 91.5245 2_665 . 3_565 N C12 H24 H26 93.07470(10) 2_665 . 2_665 N C12 H24 C13 98.8775(4) 3_565 . 3_565 N C12 H24 H25 52.2434 3_565 . 3_565 N C12 H24 H26 66.1160(4) 3_565 . 2_665 N C13 H24 H25 107.4417(10) 3_565 . 3_565 N C13 H24 H26 67.2935(18) 3_565 . 2_665 N H25 H24 H26 40.6141(8) 3_565 . 2_665 N C8 H25 C9 61.0113(11) -203_555 . -202_455 N C8 H25 H16 52.7766 -203_555 . -203_555 N C8 H25 H17 79.19870(10) -203_555 . -203_555 N C8 H25 H18 102.34600(30) -203_555 . -202_455 N C8 H25 H13 86.7727(5) -203_555 . -201_565 N C8 H25 C12 27.0578(4) -203_555 . 1_555 N C8 H25 C13 56.76830(10) -203_555 . 3_565 N C8 H25 H24 17.6658(6) -203_555 . 2_665 N C8 H25 H26 52.7455(5) -203_555 . 3_565 N C9 H25 H16 93.69060(20) -202_455 . -203_555 N C9 H25 H17 50.62490(30) -202_455 . -203_555 N C9 H25 H18 45.8645(9) -202_455 . -202_455 N C9 H25 H13 106.6684(16) -202_455 . -201_565 N C9 H25 C12 36.3730(7) -202_455 . 1_555 N C9 H25 C13 85.2535(20) -202_455 . 3_565 N C9 H25 H24 49.66230(30) -202_455 . 2_665 N C9 H25 H26 110.3762(16) -202_455 . 3_565 N H16 H25 H17 131.338 -203_555 . -203_555 N H16 H25 H18 105.57840(10) -203_555 . -202_455 N H16 H25 H13 117.1155(11) -203_555 . -201_565 N H16 H25 C12 75.09990(10) -203_555 . 1_555 N H16 H25 C13 97.8464(4) -203_555 . 3_565 N H16 H25 H24 50.35410(10) -203_555 . 2_665 N H16 H25 H26 62.9539(4) -203_555 . 3_565 N H17 H25 H18 74.50850(10) -203_555 . -202_455 N H17 H25 H13 60.2587(12) -203_555 . -201_565 N H17 H25 C12 56.5357 -203_555 . 1_555 N H17 H25 C13 53.9187(11) -203_555 . 3_565 N H17 H25 H24 81.64900(10) -203_555 . 2_665 N H17 H25 H26 96.15040(30) -203_555 . 3_565 N H18 H25 H13 131.3220(14) -202_455 . -201_565 N H18 H25 C12 81.58010(20) -202_455 . 1_555 N H18 H25 C13 125.9024(13) -202_455 . 3_565 N H18 H25 H24 86.2878(4) -202_455 . 2_665 N H18 H25 H26 155.0077(7) -202_455 . 3_565 N H13 H25 C12 87.5560(5) -201_565 . 1_555 N H13 H25 C13 30.6342(6) -201_565 . 3_565 N H13 H25 H24 102.98680(10) -201_565 . 2_665 N H13 H25 H26 54.1619(14) -201_565 . 3_565 N C12 H25 C13 58.2919(10) 1_555 . 3_565 N C12 H25 H24 25.1579 1_555 . 2_665 N C12 H25 H26 74.0817(10) 1_555 . 3_565 N C13 H25 H24 72.4192(7) 3_565 . 2_665 N C13 H25 H26 42.6523(9) 3_565 . 3_565 N H24 H25 H26 69.2585(11) 2_665 . 3_565 N C6 H26 C7 25.4731(7) -202_455 . -203_555 N C6 H26 C8 119.4262(15) -202_455 . -201_565 N C6 H26 N3 39.8851(5) -202_455 . -201_565 N C6 H26 H15 69.5512(17) -202_455 . -203_555 N C6 H26 H16 141.6770(4) -202_455 . -201_565 N C6 H26 H17 120.2094(17) -202_455 . -201_565 N C6 H26 H12 64.3883(18) -202_455 . -202_455 N C6 H26 H13 55.64600(10) -202_455 . -202_455 N C6 H26 C12 117.5540(17) -202_455 . 2_665 N C6 H26 C13 49.8981(4) -202_455 . 1_555 N C6 H26 C13 72.52750(10) -202_455 . 2_665 N C6 H26 H24 124.3725(14) -202_455 . 3_565 N C6 H26 H25 143.4935(11) -202_455 . 2_665 N C6 H26 H28 53.9595(17) -202_455 . 3_565 N C7 H26 C8 142.7846(8) -203_555 . -201_565 N C7 H26 N3 65.2978(13) -203_555 . -201_565 N C7 H26 H15 48.5419(10) -203_555 . -203_555 N C7 H26 H16 148.57370(20) -203_555 . -201_565 N C7 H26 H17 114.6692(18) -203_555 . -201_565 N C7 H26 H12 63.5176(18) -203_555 . -202_455 N C7 H26 H13 45.98270(30) -203_555 . -202_455 N C7 H26 C12 134.0235(12) -203_555 . 2_665 N C7 H26 C13 62.0187 -203_555 . 1_555 N C7 H26 C13 97.5609(8) -203_555 . 2_665 N C7 H26 H24 148.6637(7) -203_555 . 3_565 N C7 H26 H25 127.4355(16) -203_555 . 2_665 N C7 H26 H28 52.2323(16) -203_555 . 3_565 N C8 H26 N3 82.4375(20) -201_565 . -201_565 N C8 H26 H15 166.57880(20) -201_565 . -203_555 N C8 H26 H16 59.3468(9) -201_565 . -201_565 N C8 H26 H17 64.6264(15) -201_565 . -201_565 N C8 H26 H12 125.4303(12) -201_565 . -202_455 N C8 H26 H13 115.1451(4) -201_565 . -202_455 N C8 H26 C12 20.8819(4) -201_565 . 2_665 N C8 H26 C13 83.7886(8) -201_565 . 1_555 N C8 H26 C13 55.4583(14) -201_565 . 2_665 N C8 H26 H24 6.87650(10) -201_565 . 3_565 N C8 H26 H25 71.0474(18) -201_565 . 2_665 N C8 H26 H28 132.3919(11) -201_565 . 3_565 N N3 H26 H15 102.7957(20) -201_565 . -203_555 N N3 H26 H16 111.0194(9) -201_565 . -201_565 N N3 H26 H17 119.1306(11) -201_565 . -201_565 N N3 H26 H12 72.7442(14) -201_565 . -202_455 N N3 H26 H13 83.1139(6) -201_565 . -202_455 N N3 H26 C12 88.5894(19) -201_565 . 2_665 N N3 H26 C13 51.479 -201_565 . 1_555 N N3 H26 C13 33.0290(4) -201_565 . 2_665 N N3 H26 H24 86.1070(19) -201_565 . 3_565 N N3 H26 H25 145.0831(4) -201_565 . 2_665 N N3 H26 H28 68.1202(14) -201_565 . 3_565 N H15 H26 H16 107.2972(11) -203_555 . -201_565 N H15 H26 H17 121.1663(12) -203_555 . -201_565 N H15 H26 H12 47.0227(9) -203_555 . -202_455 N H15 H26 H13 77.9767(6) -203_555 . -202_455 N H15 H26 C12 166.42419(10) -203_555 . 2_665 N H15 H26 C13 109.2061(10) -203_555 . 1_555 N H15 H26 C13 124.2200(12) -203_555 . 2_665 N H15 H26 H24 159.74651(30) -203_555 . 3_565 N H15 H26 H25 108.2036(17) -203_555 . 2_665 N H15 H26 H28 42.8171(8) -203_555 . 3_565 N H16 H26 H17 94.6829(19) -201_565 . -201_565 N H16 H26 H12 85.3202(19) -201_565 . -202_455 N H16 H26 H13 162.64481(30) -201_565 . -202_455 N H16 H26 C12 74.7054(13) -201_565 . 2_665 N H16 H26 C13 142.31171(10) -201_565 . 1_555 N H16 H26 C13 79.9039(5) -201_565 . 2_665 N H16 H26 H24 52.4747(8) -201_565 . 3_565 N H16 H26 H25 74.7273(15) -201_565 . 2_665 N H16 H26 H28 96.6746(18) -201_565 . 3_565 N H17 H26 H12 166.85820(30) -201_565 . -202_455 N H17 H26 H13 68.9948(16) -201_565 . -202_455 N H17 H26 C12 45.5178(11) -201_565 . 2_665 N H17 H26 C13 74.2338(11) -201_565 . 1_555 N H17 H26 C13 112.8621 -201_565 . 2_665 N H17 H26 H24 67.2240(16) -201_565 . 3_565 N H17 H26 H25 28.1070(7) -201_565 . 2_665 N H17 H26 H28 162.9221(4) -201_565 . 3_565 N H12 H26 H13 109.1807(15) -202_455 . -202_455 N H12 H26 C12 145.7312(8) -202_455 . 2_665 N H12 H26 C13 113.3864(14) -202_455 . 1_555 N H12 H26 C13 80.11190(30) -202_455 . 2_665 N H12 H26 H24 121.7300(13) -202_455 . 3_565 N H12 H26 H25 141.5648(10) -202_455 . 2_665 N H12 H26 H28 11.36170(20) -202_455 . 3_565 N H13 H26 C12 96.3552(8) -202_455 . 2_665 N H13 H26 C13 40.79770(10) -202_455 . 1_555 N H13 H26 C13 111.27770(30) -202_455 . 2_665 N H13 H26 H24 121.55320(20) -202_455 . 3_565 N H13 H26 H25 87.9186(11) -202_455 . 2_665 N H13 H26 H28 98.0480(13) -202_455 . 3_565 N C12 H26 C13 72.0682(12) 2_665 . 1_555 N C12 H26 C13 69.2932(11) 2_665 . 2_665 N C12 H26 H24 25.9615(5) 2_665 . 3_565 N C12 H26 H25 58.8983(16) 2_665 . 2_665 N C12 H26 H28 150.7399(7) 2_665 . 3_565 N C13 H26 C13 72.14900(10) 1_555 . 2_665 N C13 H26 H24 90.6252(7) 1_555 . 3_565 N C13 H26 H25 102.0998(5) 1_555 . 2_665 N C13 H26 H28 103.6267(13) 1_555 . 3_565 N C13 H26 H24 57.0610(14) 2_665 . 3_565 N C13 H26 H25 126.4596(5) 2_665 . 2_665 N C13 H26 H28 81.7558(4) 2_665 . 3_565 N H24 H26 H25 70.1274(19) 3_565 . 2_665 N H24 H26 H28 129.8328(12) 3_565 . 3_565 N H25 H26 H28 146.7579(10) 2_665 . 3_565 N C6 H27 C7 25.20050(10) -202_455 . -203_555 N C6 H27 N3 37.29320(10) -202_455 . -203_555 N C6 H27 H14 71.7252(10) -202_455 . -203_555 N C6 H27 H16 120.6468(7) -202_455 . -203_555 N C6 H27 H17 77.7288(18) -202_455 . -201_565 N C6 H27 H13 29.20210(30) -202_455 . -202_455 N C6 H27 C13 36.5357(7) -202_455 . 1_555 N C6 H27 H29 45.37800(30) -202_455 . 3_565 N C7 H27 N3 58.50200(30) -203_555 . -203_555 N C7 H27 H14 46.6846(10) -203_555 . -203_555 N C7 H27 H16 144.7594(6) -203_555 . -203_555 N C7 H27 H17 92.5635(21) -203_555 . -201_565 N C7 H27 H13 35.3781(7) -203_555 . -202_455 N C7 H27 C13 61.6987(6) -203_555 . 1_555 N C7 H27 H29 22.47150(30) -203_555 . 3_565 N N3 H27 H14 98.7081(13) -203_555 . -203_555 N N3 H27 H16 86.4208(9) -203_555 . -203_555 N N3 H27 H17 83.4675(11) -203_555 . -201_565 N N3 H27 H13 61.46390(10) -203_555 . -202_455 N N3 H27 C13 25.9923(5) -203_555 . 1_555 N N3 H27 H29 70.7434(6) -203_555 . 3_565 N H14 H27 H16 158.27840(30) -203_555 . -203_555 N H14 H27 H17 122.3854(14) -203_555 . -201_565 N H14 H27 H13 73.47910(10) -203_555 . -202_455 N H14 H27 C13 108.24270(30) -203_555 . 1_555 N H14 H27 H29 28.2211(7) -203_555 . 3_565 N H16 H27 H17 79.0536(16) -203_555 . -201_565 N H16 H27 H13 126.54480(20) -203_555 . -202_455 N H16 H27 C13 85.5248 -203_555 . 1_555 N H16 H27 H29 151.4706(4) -203_555 . 3_565 N H17 H27 H13 57.2488(13) -201_565 . -202_455 N H17 H27 C13 57.7450(6) -201_565 . 1_555 N H17 H27 H29 113.7622(18) -201_565 . 3_565 N H13 H27 C13 46.74840(10) -202_455 . 1_555 N H13 H27 H29 56.7540(5) -202_455 . 3_565 N C13 H27 H29 81.1884(4) 1_555 . 3_565 N C5 H28 C6 54.1777(10) -202_455 . -203_555 N C5 H28 C7 37.8585(5) -202_455 . -201_565 N C5 H28 N3 76.8183(9) -202_455 . -202_455 N C5 H28 H10 68.2573(17) -202_455 . -202_455 N C5 H28 H15 94.3878(13) -202_455 . -201_565 N C5 H28 H12 143.1426(9) -202_455 . -203_555 N C5 H28 C14 14.67540(10) -202_455 . 1_555 N C5 H28 C16 9.01360(10) -202_455 . 3_565 N C5 H28 H26 111.8472(19) -202_455 . 2_665 N C5 H28 H33 58.7438(16) -202_455 . 3_565 N C5 H28 H36 40.8116(10) -202_455 . 2_665 N C6 H28 C7 33.70000(20) -203_555 . -201_565 N C6 H28 N3 37.6285 -203_555 . -202_455 N C6 H28 H10 121.9588(7) -203_555 . -202_455 N C6 H28 H15 81.0398 -203_555 . -201_565 N C6 H28 H12 89.65280(20) -203_555 . -203_555 N C6 H28 C14 41.7175(11) -203_555 . 1_555 N C6 H28 C16 62.7209(9) -203_555 . 3_565 N C6 H28 H26 60.4136(7) -203_555 . 2_665 N C6 H28 H33 112.8885(5) -203_555 . 3_565 N C6 H28 H36 94.9255 -203_555 . 2_665 N C7 H28 N3 70.73030(20) -201_565 . -202_455 N C7 H28 H10 94.3167(8) -201_565 . -202_455 N C7 H28 H15 63.3217(7) -201_565 . -201_565 N C7 H28 H12 108.08870(20) -201_565 . -203_555 N C7 H28 C14 35.38340(30) -201_565 . 1_555 N C7 H28 C16 42.7824(5) -201_565 . 3_565 N C7 H28 H26 76.6652(12) -201_565 . 2_665 N C7 H28 H33 88.0655(7) -201_565 . 3_565 N C7 H28 H36 73.57910(30) -201_565 . 2_665 N N3 H28 H10 136.9593(6) -202_455 . -202_455 N N3 H28 H15 109.5925(5) -202_455 . -201_565 N N3 H28 H12 77.20110(30) -202_455 . -203_555 N N3 H28 C14 62.1993(10) -202_455 . 1_555 N N3 H28 C16 85.5738(7) -202_455 . 3_565 N N3 H28 H26 62.26270(20) -202_455 . 2_665 N N3 H28 H33 126.3981(5) -202_455 . 3_565 N N3 H28 H36 109.5343 -202_455 . 2_665 N H10 H28 H15 97.6760(13) -202_455 . -201_565 N H10 H28 H12 144.8798(9) -202_455 . -203_555 N H10 H28 C14 82.0446(18) -202_455 . 1_555 N H10 H28 C16 59.4450(16) -202_455 . 3_565 N H10 H28 H26 155.0993(6) -202_455 . 2_665 N H10 H28 H33 10.74510(20) -202_455 . 3_565 N H10 H28 H36 28.9363(7) -202_455 . 2_665 N H15 H28 H12 70.4985(11) -201_565 . -203_555 N H15 H28 C14 97.8389(10) -201_565 . 1_555 N H15 H28 C16 93.5243(15) -201_565 . 3_565 N H15 H28 H26 57.4798(7) -201_565 . 2_665 N H15 H28 H33 102.6278(13) -201_565 . 3_565 N H15 H28 H36 105.0739(13) -201_565 . 2_665 N H12 H28 C14 131.3049(9) -203_555 . 1_555 N H12 H28 C16 150.4226(8) -203_555 . 3_565 N H12 H28 H26 31.6595(10) -203_555 . 2_665 N H12 H28 H33 155.5676(8) -203_555 . 3_565 N H12 H28 H36 173.09351(20) -203_555 . 2_665 N C14 H28 C16 23.61740(30) 1_555 . 3_565 N C14 H28 H26 101.6336(19) 1_555 . 2_665 N C14 H28 H33 72.0627(17) 1_555 . 3_565 N C14 H28 H36 53.6782(11) 1_555 . 2_665 N C16 H28 H26 118.7678(18) 3_565 . 2_665 N C16 H28 H33 50.1832(14) 3_565 . 3_565 N C16 H28 H36 32.6908(9) 3_565 . 2_665 N H26 H28 H33 158.8363(6) 2_665 . 3_565 N H26 H28 H36 150.0862(9) 2_665 . 2_665 N H33 H28 H36 18.4851(6) 3_565 . 2_665 N C3 H29 C5 47.20790(10) -203_555 . -202_455 N C3 H29 C6 89.0094(16) -203_555 . -203_555 N C3 H29 C7 81.2989(13) -203_555 . -201_565 N C3 H29 H7 51.7326(16) -203_555 . -203_555 N C3 H29 H11 78.0456(5) -203_555 . -202_455 N C3 H29 H14 133.59979(10) -203_555 . -201_565 N C3 H29 H15 102.3766(15) -203_555 . -201_565 N C3 H29 H13 147.5149(11) -203_555 . -203_555 N C3 H29 C13 119.3593(17) -203_555 . 2_665 N C3 H29 C14 49.60960(30) -203_555 . 1_555 N C3 H29 C16 31.30720(30) -203_555 . 3_565 N C3 H29 C18 8.72490(20) -203_555 . 2_665 N C3 H29 N4 65.48480(30) -203_555 . 2_665 N C3 H29 H27 155.9761(7) -203_555 . 2_665 N C3 H29 H32 87.8855 -203_555 . 3_565 N C3 H29 H37 35.4211(12) -203_555 . 2_665 N C5 H29 C6 49.1182(12) -202_455 . -203_555 N C5 H29 C7 34.2814(12) -202_455 . -201_565 N C5 H29 H7 96.0983(14) -202_455 . -203_555 N C5 H29 H11 73.49550(20) -202_455 . -202_455 N C5 H29 H14 150.26649(10) -202_455 . -201_565 N C5 H29 H15 58.6277(12) -202_455 . -201_565 N C5 H29 H13 104.6767(7) -202_455 . -203_555 N C5 H29 C13 84.8120(11) -202_455 . 2_665 N C5 H29 C14 14.5373 -202_455 . 1_555 N C5 H29 C16 18.07240(30) -202_455 . 3_565 N C5 H29 C18 39.91300(30) -202_455 . 2_665 N C5 H29 N4 56.5541 -202_455 . 2_665 N C5 H29 H27 126.78870(10) -202_455 . 2_665 N C5 H29 H32 71.98210(10) -202_455 . 3_565 N C5 H29 H37 79.7408(9) -202_455 . 2_665 N C6 H29 C7 25.7912 -203_555 . -201_565 N C6 H29 H7 140.47350(10) -203_555 . -203_555 N C6 H29 H11 106.70860(30) -203_555 . -202_455 N C6 H29 H14 135.9877(14) -203_555 . -201_565 N C6 H29 H15 51.8498(4) -203_555 . -201_565 N C6 H29 H13 58.7712(5) -203_555 . -203_555 N C6 H29 C13 35.7145 -203_555 . 2_665 N C6 H29 C14 40.3563(12) -203_555 . 1_555 N C6 H29 C16 66.6246(15) -203_555 . 3_565 N C6 H29 C18 80.2901(17) -203_555 . 2_665 N C6 H29 N4 43.1113(7) -203_555 . 2_665 N C6 H29 H27 78.1229(11) -203_555 . 2_665 N C6 H29 H32 95.9846 -203_555 . 3_565 N C6 H29 H37 124.4263(4) -203_555 . 2_665 N C7 H29 H7 129.55600(20) -201_565 . -203_555 N C7 H29 H11 81.02400(30) -201_565 . -202_455 N C7 H29 H14 132.4832(9) -201_565 . -201_565 N C7 H29 H15 33.1621 -201_565 . -201_565 N C7 H29 H13 71.0846(4) -201_565 . -203_555 N C7 H29 C13 57.24000(20) -201_565 . 2_665 N C7 H29 C14 34.4211(9) -201_565 . 1_555 N C7 H29 C16 51.8380(15) -201_565 . 3_565 N C7 H29 C18 73.5360(14) -201_565 . 2_665 N C7 H29 N4 61.08130(20) -201_565 . 2_665 N C7 H29 H27 94.6078(12) -201_565 . 2_665 N C7 H29 H32 71.20440(10) -201_565 . 3_565 N C7 H29 H37 113.61120(30) -201_565 . 2_665 N H7 H29 H11 73.0090(4) -203_555 . -202_455 N H7 H29 H14 83.3626(15) -203_555 . -201_565 N H7 H29 H15 132.0918(6) -203_555 . -201_565 N H7 H29 H13 159.2224(6) -203_555 . -203_555 N H7 H29 C13 157.7243(5) -203_555 . 2_665 N H7 H29 C14 101.2283(13) -203_555 . 1_555 N H7 H29 C16 78.0949(17) -203_555 . 3_565 N H7 H29 C18 60.3985(18) -203_555 . 2_665 N H7 H29 N4 105.7099(9) -203_555 . 2_665 N H7 H29 H27 135.7023(13) -203_555 . 2_665 N H7 H29 H32 87.8764 -203_555 . 3_565 N H7 H29 H37 16.5546(5) -203_555 . 2_665 N H11 H29 H14 77.9985(4) -202_455 . -201_565 N H11 H29 H15 61.4173(9) -202_455 . -201_565 N H11 H29 H13 112.99990(20) -202_455 . -203_555 N H11 H29 C13 127.94350(10) -202_455 . 2_665 N H11 H29 C14 88.02570(20) -202_455 . 1_555 N H11 H29 C16 66.75150(30) -202_455 . 3_565 N H11 H29 C18 81.0508(6) -202_455 . 2_665 N H11 H29 N4 129.82710(30) -202_455 . 2_665 N H11 H29 H27 124.93680(20) -202_455 . 2_665 N H11 H29 H32 14.8984(4) -202_455 . 3_565 N H11 H29 H37 70.74890(30) -202_455 . 2_665 N H14 H29 H15 100.0779(9) -201_565 . -201_565 N H14 H29 H13 78.7843(9) -201_565 . -203_555 N H14 H29 C13 106.7315(16) -201_565 . 2_665 N H14 H29 C14 163.4014 -201_565 . 1_555 N H14 H29 C16 143.59360(10) -201_565 . 3_565 N H14 H29 C18 142.15820(30) -201_565 . 2_665 N H14 H29 N4 152.03310(20) -201_565 . 2_665 N H14 H29 H27 65.1566(5) -201_565 . 2_665 N H14 H29 H32 78.29420(10) -201_565 . 3_565 N H14 H29 H37 98.8203(10) -201_565 . 2_665 N H15 H29 H13 62.4129(10) -201_565 . -203_555 N H15 H29 C13 66.8179(10) -201_565 . 2_665 N H15 H29 C14 64.9301(9) -201_565 . 1_555 N H15 H29 C16 71.3542(17) -201_565 . 3_565 N H15 H29 C18 96.9907(15) -201_565 . 2_665 N H15 H29 N4 93.20100(20) -201_565 . 2_665 N H15 H29 H27 85.6297(17) -201_565 . 2_665 N H15 H29 H32 47.4903(5) -201_565 . 3_565 N H15 H29 H37 122.7618(8) -201_565 . 2_665 N H13 H29 C13 29.5249(7) -203_555 . 2_665 N H13 H29 C14 98.8903(7) -203_555 . 1_555 N H13 H29 C16 122.6811(11) -203_555 . 3_565 N H13 H29 C18 138.8162(12) -203_555 . 2_665 N H13 H29 N4 85.9070(6) -203_555 . 2_665 N H13 H29 H27 24.3768(7) -203_555 . 2_665 N H13 H29 H32 98.72820(30) -203_555 . 3_565 N H13 H29 H37 174.75720(20) -203_555 . 2_665 N C13 H29 C14 74.8657(12) 2_665 . 1_555 N C13 H29 C16 102.0589(15) 2_665 . 3_565 N C13 H29 C18 111.0164(18) 2_665 . 2_665 N C13 H29 N4 56.4887(12) 2_665 . 2_665 N C13 H29 H27 43.1118(11) 2_665 . 2_665 N C13 H29 H32 113.3407(5) 2_665 . 3_565 N C13 H29 H37 150.7624(6) 2_665 . 2_665 N C14 H29 C16 27.70550(30) 1_555 . 3_565 N C14 H29 C18 41.0930(4) 1_555 . 2_665 N C14 H29 N4 42.1421 1_555 . 2_665 N C14 H29 H27 117.96160(10) 1_555 . 2_665 N C14 H29 H32 85.895 1_555 . 3_565 N C14 H29 H37 84.7324(9) 1_555 . 2_665 N C16 H29 C18 25.77370(20) 3_565 . 2_665 N C16 H29 N4 64.14150(10) 3_565 . 2_665 N C16 H29 H27 144.6854(4) 3_565 . 2_665 N C16 H29 H32 70.03320(20) 3_565 . 3_565 N C16 H29 H37 61.8413(12) 3_565 . 2_665 N C18 H29 N4 58.4855(4) 2_665 . 2_665 N C18 H29 H27 150.1536(8) 2_665 . 2_665 N C18 H29 H32 89.1292 2_665 . 3_565 N C18 H29 H37 44.1369(13) 2_665 . 2_665 N N4 H29 H27 91.7254(4) 2_665 . 2_665 N N4 H29 H32 127.5549 2_665 . 3_565 N N4 H29 H37 94.3714(6) 2_665 . 2_665 N H27 H29 H32 113.3492(7) 2_665 . 3_565 N H27 H29 H37 150.4485(9) 2_665 . 2_665 N H32 H29 H37 85.26400(20) 3_565 . 2_665 N C4 H30 H4 57.8918(12) -201_565 . -202_455 N C4 H30 H6 17.9152 -201_565 . -203_555 N C4 H30 H9 39.0904(4) -201_565 . -201_565 N C4 H30 H10 61.8112 -201_565 . -202_455 N C4 H30 C15 17.8808(6) -201_565 . 1_555 N C4 H30 H33 55.78850(20) -201_565 . 3_565 N C4 H30 H36 29.7399(6) -201_565 . 2_665 N H4 H30 H6 68.2664(10) -202_455 . -203_555 N H4 H30 H9 96.9108(16) -202_455 . -201_565 N H4 H30 H10 114.2181(14) -202_455 . -202_455 N H4 H30 C15 40.4654(7) -202_455 . 1_555 N H4 H30 H33 109.1810(16) -202_455 . 3_565 N H4 H30 H36 84.4436(19) -202_455 . 2_665 N H6 H30 H9 34.1217(5) -203_555 . -201_565 N H6 H30 H10 62.1718 -203_555 . -202_455 N H6 H30 C15 29.1493(4) -203_555 . 1_555 N H6 H30 H33 56.16540(20) -203_555 . 3_565 N H6 H30 H36 33.8717(4) -203_555 . 2_665 N H9 H30 H10 28.9177(6) -201_565 . -202_455 N H9 H30 C15 56.8582(10) -201_565 . 1_555 N H9 H30 H33 23.3465(4) -201_565 . 3_565 N H9 H30 H36 17.18840(30) -201_565 . 2_665 N H10 H30 C15 79.0606(6) -202_455 . 1_555 N H10 H30 H33 6.11670(20) -202_455 . 3_565 N H10 H30 H36 32.1038(5) -202_455 . 2_665 N C15 H30 H33 73.1510(8) 1_555 . 3_565 N C15 H30 H36 47.0143(12) 1_555 . 2_665 N H33 H30 H36 26.1414(4) 3_565 . 2_665 N C2 H31 C3 41.5505(6) -202_344 . -203_444 N C2 H31 C4 36.7867(5) -202_455 . -201_565 N C2 H31 H4 42.8212(4) -202_455 . -202_455 N C2 H31 H5 46.97540(20) -202_455 . -202_455 N C2 H31 H6 59.44340(10) -202_455 . -203_555 N C2 H31 H7 78.09840(30) -202_455 . -203_555 N C2 H31 H8 65.98400(10) -202_455 . -201_565 N C2 H31 C15 36.0432 -202_455 . 1_555 N C2 H31 C17 33.29710(20) -202_455 . 3_565 N C2 H31 C18 29.0995(7) -202_455 . 2_665 N C2 H31 H34 80.2182(8) -202_455 . 3_565 N C2 H31 H35 95.1784 -202_455 . 3_565 N C2 H31 H37 67.76210(10) -202_455 . 2_665 N C3 H31 C4 29.0393(5) -203_555 . -201_565 N C3 H31 H4 78.3771(10) -203_555 . -202_455 N C3 H31 H5 60.5559(11) -203_555 . -202_455 N C3 H31 H6 50.4686(10) -203_555 . -203_555 N C3 H31 H7 43.7408(9) -203_555 . -203_555 N C3 H31 H8 43.6001(4) -203_555 . -201_565 N C3 H31 C15 51.78980(20) -203_555 . 1_555 N C3 H31 C17 52.4204(11) -203_555 . 3_565 N C3 H31 C18 14.28730(10) -203_555 . 2_665 N C3 H31 H34 120.9889(14) -203_555 . 3_565 N C3 H31 H35 81.46920(10) -203_555 . 3_565 N C3 H31 H37 33.8610(7) -203_555 . 2_665 N C4 H31 H4 56.1179(15) -201_565 . -202_455 N C4 H31 H5 77.3598(6) -201_565 . -202_455 N C4 H31 H6 25.8625(4) -201_565 . -203_555 N C4 H31 H7 71.5926(14) -201_565 . -203_555 N C4 H31 H8 72.3386(9) -201_565 . -201_565 N C4 H31 C15 24.48020(30) -201_565 . 1_555 N C4 H31 C17 65.0030(6) -201_565 . 3_565 N C4 H31 C18 19.68920(30) -201_565 . 2_665 N C4 H31 H34 100.6734(18) -201_565 . 3_565 N C4 H31 H35 110.1302(4) -201_565 . 3_565 N C4 H31 H37 62.3801(12) -201_565 . 2_665 N H4 H31 H5 78.51590(10) -202_455 . -202_455 N H4 H31 H6 59.7282(14) -202_455 . -203_555 N H4 H31 H7 120.15370(10) -202_455 . -203_555 N H4 H31 H8 108.55770(30) -202_455 . -201_565 N H4 H31 C15 33.1576(11) -202_455 . 1_555 N H4 H31 C17 67.1785 -202_455 . 3_565 N H4 H31 C18 64.0944(11) -202_455 . 2_665 N H4 H31 H34 44.6202(4) -202_455 . 3_565 N H4 H31 H35 130.11960(10) -202_455 . 3_565 N H4 H31 H37 109.65650(30) -202_455 . 2_665 N H5 H31 H6 103.09190(10) -202_455 . -203_555 N H5 H31 H7 62.5044(10) -202_455 . -203_555 N H5 H31 H8 42.1945(9) -202_455 . -201_565 N H5 H31 C15 83.01830(20) -202_455 . 1_555 N H5 H31 C17 13.67900(10) -202_455 . 3_565 N H5 H31 C18 59.5471(9) -202_455 . 2_665 N H5 H31 H34 89.5080(4) -202_455 . 3_565 N H5 H31 H35 51.9292 -202_455 . 3_565 N H5 H31 H37 57.2344(12) -202_455 . 2_665 N H6 H31 H7 85.9084(18) -203_555 . -203_555 N H6 H31 H8 93.2165(14) -203_555 . -201_565 N H6 H31 C15 29.36150(20) -203_555 . 1_555 N H6 H31 C17 90.36510(10) -203_555 . 3_565 N H6 H31 C18 44.9748(7) -203_555 . 2_665 N H6 H31 H34 98.3298(20) -203_555 . 3_565 N H6 H31 H35 130.1481(8) -203_555 . 3_565 N H6 H31 H37 79.1821(17) -203_555 . 2_665 N H7 H31 H8 20.36480(10) -203_555 . -201_565 N H7 H31 C15 95.3980(11) -203_555 . 1_555 N H7 H31 C17 65.6933(6) -203_555 . 3_565 N H7 H31 C18 57.4410(10) -203_555 . 2_665 N H7 H31 H34 151.8322(5) -203_555 . 3_565 N H7 H31 H35 45.1354(10) -203_555 . 3_565 N H7 H31 H37 10.50060(20) -203_555 . 2_665 N H8 H31 C15 92.6124(7) -201_565 . 1_555 N H8 H31 C17 46.6343(6) -201_565 . 3_565 N H8 H31 C18 53.9912(6) -201_565 . 2_665 N H8 H31 H34 131.6873(5) -201_565 . 3_565 N H8 H31 H35 37.8740(5) -201_565 . 3_565 N H8 H31 H37 17.72910(20) -201_565 . 2_665 N C15 H31 C17 69.33950(20) 1_555 . 3_565 N C15 H31 C18 39.00550(10) 1_555 . 2_665 N C15 H31 H34 76.9060(15) 1_555 . 3_565 N C15 H31 H35 128.30690(20) 1_555 . 3_565 N C15 H31 H37 85.6501(9) 1_555 . 2_665 N C17 H31 C18 48.5265(9) 3_565 . 2_665 N C17 H31 H34 86.36580(10) 3_565 . 3_565 N C17 H31 H35 64.3344 3_565 . 3_565 N C17 H31 H37 58.1894(8) 3_565 . 2_665 N C18 H31 H34 106.9956(16) 2_665 . 3_565 N C18 H31 H35 91.2471 2_665 . 3_565 N C18 H31 H37 47.2229(8) 2_665 . 2_665 N H34 H31 H35 120.2982(8) 3_565 . 3_565 N H34 H31 H37 144.2782(7) 3_565 . 2_665 N H35 H31 H37 50.9878(8) 3_565 . 2_665 N C3 H32 C4 22.6702(6) -201_565 . -202_455 N C3 H32 C5 45.15810(10) -201_565 . -203_555 N C3 H32 C6 78.5851(16) -201_565 . -201_565 N C3 H32 C7 71.8564(14) -201_565 . -202_455 N C3 H32 H7 48.0804(13) -201_565 . -201_565 N C3 H32 H11 44.7112(10) -201_565 . -203_555 N C3 H32 H14 110.9479(5) -201_565 . -202_455 N C3 H32 H15 115.1376(14) -201_565 . -202_455 N C3 H32 H13 118.3823(17) -201_565 . -201_565 N C3 H32 C14 45.8968(4) -201_565 . 2_665 N C3 H32 C16 29.3228(4) -201_565 . 1_555 N C3 H32 C18 8.67650(20) -201_565 . 3_565 N C3 H32 H29 68.7427(6) -201_565 . 2_665 N C3 H32 H37 33.5573(10) -201_565 . 3_565 N C4 H32 C5 38.92070(30) -202_455 . -203_555 N C4 H32 C6 82.6070(15) -202_455 . -201_565 N C4 H32 C7 76.7766(13) -202_455 . -202_455 N C4 H32 H7 61.5210(17) -202_455 . -201_565 N C4 H32 H11 64.2701(15) -202_455 . -203_555 N C4 H32 H14 132.03059(10) -202_455 . -202_455 N C4 H32 H15 100.3954(18) -202_455 . -202_455 N C4 H32 H13 130.9580(13) -202_455 . -201_565 N C4 H32 C14 46.87430(30) -202_455 . 2_665 N C4 H32 C16 20.07680(10) -202_455 . 1_555 N C4 H32 C18 18.4771(4) -202_455 . 3_565 N C4 H32 H29 90.2155 -202_455 . 2_665 N C4 H32 H37 45.6744(14) -202_455 . 3_565 N C5 H32 C6 45.4143(12) -203_555 . -201_565 N C5 H32 C7 40.7242(9) -203_555 . -202_455 N C5 H32 H7 93.2299(12) -203_555 . -201_565 N C5 H32 H11 86.7422(9) -203_555 . -203_555 N C5 H32 H14 137.50369(10) -203_555 . -202_455 N C5 H32 H15 70.5206(13) -203_555 . -202_455 N C5 H32 H13 95.5554(10) -203_555 . -201_565 N C5 H32 C14 13.665 -203_555 . 2_665 N C5 H32 C16 19.0053(4) -203_555 . 1_555 N C5 H32 C18 36.66460(20) -203_555 . 3_565 N C5 H32 H29 80.6677 -203_555 . 2_665 N C5 H32 H37 78.4619(9) -203_555 . 3_565 N C6 H32 C7 6.79720(20) -201_565 . -202_455 N C6 H32 H7 116.5909(5) -201_565 . -201_565 N C6 H32 H11 99.9123(8) -201_565 . -203_555 N C6 H32 H14 104.3321(6) -201_565 . -202_455 N C6 H32 H15 57.4800(4) -201_565 . -202_455 N C6 H32 H13 50.14640(20) -201_565 . -201_565 N C6 H32 C14 35.7551(11) -201_565 . 2_665 N C6 H32 C16 62.8440(16) -201_565 . 1_555 N C6 H32 C18 72.7308(17) -201_565 . 3_565 N C6 H32 H29 60.09980(10) -201_565 . 2_665 N C6 H32 H37 108.4151(8) -201_565 . 3_565 N C7 H32 H7 110.27620(30) -202_455 . -201_565 N C7 H32 H11 94.1020(6) -202_455 . -203_555 N C7 H32 H14 105.5187(4) -202_455 . -202_455 N C7 H32 H15 62.63650(20) -202_455 . -202_455 N C7 H32 H13 55.11500(10) -202_455 . -201_565 N C7 H32 C14 29.9578(9) -202_455 . 2_665 N C7 H32 C16 57.3079(13) -202_455 . 1_555 N C7 H32 C18 66.1636(15) -202_455 . 3_565 N C7 H32 H29 57.30600(10) -202_455 . 2_665 N C7 H32 H37 101.6750(6) -202_455 . 3_565 N H7 H32 H11 18.81610(30) -201_565 . -203_555 N H7 H32 H14 73.6540(15) -201_565 . -202_455 N H7 H32 H15 161.90680(10) -201_565 . -202_455 N H7 H32 H13 123.5923(16) -201_565 . -201_565 N H7 H32 C14 92.0302(9) -201_565 . 2_665 N H7 H32 C16 76.5308(17) -201_565 . 1_555 N H7 H32 C18 56.6522(15) -201_565 . 3_565 N H7 H32 H29 69.1060(6) -201_565 . 2_665 N H7 H32 H37 15.8606(4) -201_565 . 3_565 N H11 H32 H14 67.7891(14) -203_555 . -202_455 N H11 H32 H15 155.4105(4) -203_555 . -202_455 N H11 H32 H13 106.7625(18) -203_555 . -201_565 N H11 H32 C14 81.6635(5) -203_555 . 2_665 N H11 H32 C16 73.7652(14) -203_555 . 1_555 N H11 H32 C18 53.0855(11) -203_555 . 3_565 N H11 H32 H29 50.5499(9) -203_555 . 2_665 N H11 H32 H37 24.6980(4) -203_555 . 3_565 N H14 H32 H15 123.6739(16) -202_455 . -202_455 N H14 H32 H13 62.83360(30) -202_455 . -201_565 N H14 H32 C14 124.27360(10) -202_455 . 2_665 N H14 H32 C16 136.53780(10) -202_455 . 1_555 N H14 H32 C18 118.21780(30) -202_455 . 3_565 N H14 H32 H29 56.84240(10) -202_455 . 2_665 N H14 H32 H37 88.6225(12) -202_455 . 3_565 N H15 H32 H13 67.6653(15) -202_455 . -201_565 N H15 H32 C14 74.0671(9) -202_455 . 2_665 N H15 H32 C16 86.0765(17) -202_455 . 1_555 N H15 H32 C18 106.4632(15) -202_455 . 3_565 N H15 H32 H29 114.2200(4) -202_455 . 2_665 N H15 H32 H37 146.0693(5) -202_455 . 3_565 N H13 H32 C14 84.9000(10) -201_565 . 2_665 N H13 H32 C16 112.2809(14) -201_565 . 1_555 N H13 H32 C18 116.3036(17) -201_565 . 3_565 N H13 H32 H29 57.7640(9) -201_565 . 2_665 N H13 H32 H37 130.2844(15) -201_565 . 3_565 N C14 H32 C16 27.3913(4) 2_665 . 1_555 N C14 H32 C18 38.5733(5) 2_665 . 3_565 N C14 H32 H29 67.64230(10) 2_665 . 2_665 N C14 H32 H37 79.0564(6) 2_665 . 3_565 N C16 H32 C18 20.73420(20) 1_555 . 3_565 N C16 H32 H29 83.29610(10) 1_555 . 2_665 N C16 H32 H37 61.0614(13) 1_555 . 3_565 N C18 H32 H29 71.7758(4) 3_565 . 2_665 N C18 H32 H37 41.8305(11) 3_565 . 3_565 N H29 H32 H37 72.6286(6) 2_665 . 3_565 N C3 H33 C4 22.5342(5) -201_565 . -202_455 N C3 H33 C5 35.0418(10) -201_565 . -203_555 N C3 H33 C7 45.5007(14) -201_565 . -202_455 N C3 H33 H6 41.74800(30) -201_565 . -201_565 N C3 H33 H9 85.0430(9) -201_565 . -202_455 N C3 H33 H10 109.3768(4) -201_565 . -203_555 N C3 H33 H12 90.6243(10) -201_565 . -201_565 N C3 H33 C14 37.3062(10) -201_565 . 2_665 N C3 H33 C15 43.7963(4) -201_565 . 2_665 N C3 H33 C16 16.4144(5) -201_565 . 1_555 N C3 H33 C18 12.73570(10) -201_565 . 3_565 N C3 H33 H28 85.9027(11) -201_565 . 2_665 N C3 H33 H30 95.4451(12) -201_565 . 2_665 N C3 H33 H36 27.9751(5) -201_565 . 3_565 N C4 H33 C5 55.7183(16) -202_455 . -203_555 N C4 H33 C7 68.0170(19) -202_455 . -202_455 N C4 H33 H6 24.81030(30) -202_455 . -201_565 N C4 H33 H9 63.2214(14) -202_455 . -202_455 N C4 H33 H10 131.4831(9) -202_455 . -203_555 N C4 H33 H12 111.2819(15) -202_455 . -201_565 N C4 H33 C14 56.6814(15) -202_455 . 2_665 N C4 H33 C15 21.28420(10) -202_455 . 2_665 N C4 H33 C16 38.1950(10) -202_455 . 1_555 N C4 H33 C18 17.15920(20) -202_455 . 3_565 N C4 H33 H28 106.2674(16) -202_455 . 2_665 N C4 H33 H30 73.0626(17) -202_455 . 2_665 N C4 H33 H36 6.0491 -202_455 . 3_565 N C5 H33 C7 19.66660(10) -203_555 . -202_455 N C5 H33 H6 76.7711(13) -203_555 . -201_565 N C5 H33 H9 118.81980(20) -203_555 . -202_455 N C5 H33 H10 76.0208(7) -203_555 . -203_555 N C5 H33 H12 55.78510(10) -203_555 . -201_565 N C5 H33 C14 5.4036 -203_555 . 2_665 N C5 H33 C15 75.5891(15) -203_555 . 2_665 N C5 H33 C16 18.8016(5) -203_555 . 1_555 N C5 H33 C18 39.3441(13) -203_555 . 3_565 N C5 H33 H28 50.94480(10) -203_555 . 2_665 N C5 H33 H30 127.38670(10) -203_555 . 2_665 N C5 H33 H36 59.8462(16) -203_555 . 3_565 N C7 H33 H6 83.9582(18) -202_455 . -201_565 N C7 H33 H9 129.5327(6) -202_455 . -202_455 N C7 H33 H10 64.2366(11) -202_455 . -203_555 N C7 H33 H12 48.6040(5) -202_455 . -201_565 N C7 H33 C14 23.91350(10) -202_455 . 2_665 N C7 H33 C15 89.2098(18) -202_455 . 2_665 N C7 H33 C16 30.4613(8) -202_455 . 1_555 N C7 H33 C18 54.0029(15) -202_455 . 3_565 N C7 H33 H28 44.9698(5) -202_455 . 2_665 N C7 H33 H30 140.79170(20) -202_455 . 2_665 N C7 H33 H36 73.2365(19) -202_455 . 3_565 N H6 H33 H9 45.7294(13) -201_565 . -202_455 N H6 H33 H10 146.5118(8) -201_565 . -203_555 N H6 H33 H12 131.8569(13) -201_565 . -201_565 N H6 H33 C14 78.9260(13) -201_565 . 2_665 N H6 H33 C15 22.2799(5) -201_565 . 2_665 N H6 H33 C16 58.0188(8) -201_565 . 1_555 N H6 H33 C18 41.31430(10) -201_565 . 3_565 N H6 H33 H28 127.3923(14) -201_565 . 2_665 N H6 H33 H30 57.8216(16) -201_565 . 2_665 N H6 H33 H36 24.8545(4) -201_565 . 3_565 N H9 H33 H10 165.1234(5) -202_455 . -203_555 N H9 H33 H12 169.91930(30) -202_455 . -201_565 N H9 H33 C14 119.08990(20) -202_455 . 2_665 N H9 H33 C15 43.4325(13) -202_455 . 2_665 N H9 H33 C16 101.27190(30) -202_455 . 1_555 N H9 H33 C18 79.5179(11) -202_455 . 3_565 N H9 H33 H28 165.5408(4) -202_455 . 2_665 N H9 H33 H30 12.6604(4) -202_455 . 2_665 N H9 H33 H36 58.9831(14) -202_455 . 3_565 N H10 H33 H12 22.5980(7) -203_555 . -201_565 N H10 H33 C14 75.7791(7) -203_555 . 2_665 N H10 H33 C15 151.4327(8) -203_555 . 2_665 N H10 H33 C16 93.31720(20) -203_555 . 1_555 N H10 H33 C18 115.3454(6) -203_555 . 3_565 N H10 H33 H28 27.7469(9) -203_555 . 2_665 N H10 H33 H30 154.9437(8) -203_555 . 2_665 N H10 H33 H36 135.8669(9) -203_555 . 3_565 N H12 H33 C14 54.6122 -201_565 . 2_665 N H12 H33 C15 129.4993(15) -201_565 . 2_665 N H12 H33 C16 74.2106(5) -201_565 . 1_555 N H12 H33 C18 94.3654(13) -201_565 . 3_565 N H12 H33 H28 5.19580(10) -201_565 . 2_665 N H12 H33 H30 162.5882(6) -201_565 . 2_665 N H12 H33 H36 114.7822(16) -201_565 . 3_565 N C14 H33 C15 75.6574(15) 2_665 . 2_665 N C14 H33 C16 21.7638(4) 2_665 . 1_555 N C14 H33 C18 39.7872(13) 2_665 . 3_565 N C14 H33 H28 49.58660(10) 2_665 . 2_665 N C14 H33 H30 126.5578 2_665 . 2_665 N C14 H33 H36 60.2983(16) 2_665 . 3_565 N C15 H33 C16 59.0599(9) 2_665 . 1_555 N C15 H33 C18 36.26270(20) 2_665 . 3_565 N C15 H33 H28 124.3082(17) 2_665 . 2_665 N C15 H33 H30 52.1949(16) 2_665 . 2_665 N C15 H33 H36 16.01840(10) 2_665 . 3_565 N C16 H33 C18 23.5641(7) 1_555 . 3_565 N C16 H33 H28 69.5071(6) 1_555 . 2_665 N C16 H33 H30 111.2018(7) 1_555 . 2_665 N C16 H33 H36 43.0419(10) 1_555 . 3_565 N C18 H33 H28 89.2914(14) 3_565 . 2_665 N C18 H33 H30 88.3401(14) 3_565 . 2_665 N C18 H33 H36 20.54700(30) 3_565 . 3_565 N H28 H33 H30 161.5038(6) 2_665 . 2_665 N H28 H33 H36 109.6633(17) 2_665 . 3_565 N H30 H33 H36 68.1918(17) 2_665 . 3_565 N C2 H34 C4 32.97360(30) -203_555 . -202_455 N C2 H34 H4 44.56380(10) -203_555 . -203_555 N C2 H34 H5 42.30040(20) -203_555 . -203_555 N C2 H34 H6 51.4322(9) -203_555 . -201_565 N C2 H34 H8 59.2289(11) -203_555 . -202_455 N C2 H34 C15 33.6851(4) -203_555 . 2_665 N C2 H34 C17 35.8132(5) -203_555 . 1_555 N C2 H34 C19 34.4900(9) -203_555 . 3_565 N C2 H34 H31 68.0413(13) -203_555 . 2_665 N C2 H34 H38 64.6804(10) -203_555 . 3_565 N C2 H34 H39 65.6689(15) -203_555 . 3_565 N C4 H34 H4 56.1974 -202_455 . -203_555 N C4 H34 H5 58.4822(4) -202_455 . -203_555 N C4 H34 H6 18.8844(6) -202_455 . -201_565 N C4 H34 H8 45.3620(12) -202_455 . -202_455 N C4 H34 C15 14.6097(4) -202_455 . 2_665 N C4 H34 C17 44.4935(7) -202_455 . 1_555 N C4 H34 C19 66.6708(6) -202_455 . 3_565 N C4 H34 H31 47.1938(14) -202_455 . 2_665 N C4 H34 H38 84.8529(10) -202_455 . 3_565 N C4 H34 H39 96.6099(13) -202_455 . 3_565 N H4 H34 H5 84.9430(4) -203_555 . -203_555 N H4 H34 H6 63.72520(20) -203_555 . -201_565 N H4 H34 H8 99.2023(12) -203_555 . -202_455 N H4 H34 C15 43.18020(30) -203_555 . 2_665 N H4 H34 C17 80.3768(6) -203_555 . 1_555 N H4 H34 C19 42.19040(10) -203_555 . 3_565 N H4 H34 H31 103.3244(14) -203_555 . 2_665 N H4 H34 H38 29.5205(10) -203_555 . 3_565 N H4 H34 H39 82.9447(5) -203_555 . 3_565 N H5 H34 H6 74.4575(9) -203_555 . -201_565 N H5 H34 H8 42.24220(10) -203_555 . -202_455 N H5 H34 C15 68.6114(7) -203_555 . 2_665 N H5 H34 C17 14.89880(30) -203_555 . 1_555 N H5 H34 C19 52.94640(10) -203_555 . 3_565 N H5 H34 H31 55.2222(4) -203_555 . 2_665 N H5 H34 H38 94.92050(30) -203_555 . 3_565 N H5 H34 H39 47.5213(14) -203_555 . 3_565 N H6 H34 H8 49.3067(14) -201_565 . -202_455 N H6 H34 C15 22.4064(6) -201_565 . 2_665 N H6 H34 C17 59.6892(12) -201_565 . 1_555 N H6 H34 C19 83.9672 -201_565 . 3_565 N H6 H34 H31 45.3357(14) -201_565 . 2_665 N H6 H34 H38 93.1682(8) -201_565 . 3_565 N H6 H34 H39 115.4150(7) -201_565 . 3_565 N H8 H34 C15 59.9544(16) -202_455 . 2_665 N H8 H34 C17 31.6758(4) -202_455 . 1_555 N H8 H34 C19 87.90070(10) -202_455 . 3_565 N H8 H34 H31 12.98370(30) -202_455 . 2_665 N H8 H34 H38 123.85300(10) -202_455 . 3_565 N H8 H34 H39 88.8328(13) -202_455 . 3_565 N C15 H34 C17 55.9686(10) 2_665 . 1_555 N C15 H34 C19 62.7978(6) 2_665 . 3_565 N C15 H34 H31 61.0080(17) 2_665 . 2_665 N C15 H34 H38 72.5575(13) 2_665 . 3_565 N C15 H34 H39 99.2412(11) 2_665 . 3_565 N C17 H34 C19 57.20340(30) 1_555 . 3_565 N C17 H34 H31 44.2791(7) 1_555 . 2_665 N C17 H34 H38 97.1011(4) 1_555 . 3_565 N C17 H34 H39 61.3889(17) 1_555 . 3_565 N C19 H34 H31 99.1864(4) 3_565 . 2_665 N C19 H34 H38 42.02780(20) 3_565 . 3_565 N C19 H34 H39 41.8544(5) 3_565 . 3_565 N H31 H34 H38 130.99451(30) 2_665 . 3_565 N H31 H34 H39 101.5136(10) 2_665 . 3_565 N H38 H34 H39 70.14070(20) 3_565 . 3_565 N H5 H35 H7 84.9592(8) -203_555 . -201_565 N H5 H35 H8 59.02160(20) -203_555 . -202_455 N H5 H35 C17 25.88920(10) -203_555 . 1_555 N H5 H35 H31 64.9855 -203_555 . 2_665 N H5 H35 H37 67.8653(12) -203_555 . 3_565 N H7 H35 H8 73.2071 -201_565 . -202_455 N H7 H35 C17 79.2296(5) -201_565 . 1_555 N H7 H35 H31 83.92230(20) -201_565 . 2_665 N H7 H35 H37 20.8091(5) -201_565 . 3_565 N H8 H35 C17 33.16190(10) -202_455 . 1_555 N H8 H35 H31 12.31090(20) -202_455 . 2_665 N H8 H35 H37 54.7569(4) -202_455 . 3_565 N C17 H35 H31 39.6379 1_555 . 2_665 N C17 H35 H37 58.6559(10) 1_555 . 3_565 N H31 H35 H37 66.4499(7) 2_665 . 3_565 N C2 H36 C3 43.1997(5) -201_454 . -202_344 N C2 H36 C4 22.74590(30) -201_565 . -203_555 N C2 H36 C5 81.7215(20) -201_565 . -201_565 N C2 H36 C7 90.0798(18) -201_565 . -203_555 N C2 H36 H6 59.9574(11) -201_565 . -202_455 N C2 H36 H9 103.8168(20) -201_565 . -203_555 N C2 H36 H10 152.33040(30) -201_565 . -201_565 N C2 H36 C14 75.3076(20) -201_565 . 3_565 N C2 H36 C15 30.87130(30) -201_565 . 3_565 N C2 H36 C16 67.3271(17) -201_565 . 2_665 N C2 H36 C18 28.1487(4) -201_565 . 1_555 N C2 H36 H28 119.5278(13) -201_565 . 3_565 N C2 H36 H30 96.4254(19) -201_565 . 3_565 N C2 H36 H33 164.05420(20) -201_565 . 2_665 N C3 H36 C4 29.8922(8) -202_455 . -203_555 N C3 H36 C5 50.6074(11) -202_455 . -201_565 N C3 H36 C7 51.5469(12) -202_455 . -203_555 N C3 H36 H6 64.90520(30) -202_455 . -202_455 N C3 H36 H9 134.1484(10) -202_455 . -203_555 N C3 H36 H10 123.2432(7) -202_455 . -201_565 N C3 H36 C14 48.1865(10) -202_455 . 3_565 N C3 H36 C15 64.0971(5) -202_455 . 3_565 N C3 H36 C16 30.2734(9) -202_455 . 2_665 N C3 H36 C18 17.11410(10) -202_455 . 1_555 N C3 H36 H28 93.71410(20) -202_455 . 3_565 N C3 H36 H30 132.0639(12) -202_455 . 3_565 N C3 H36 H33 140.8554(8) -202_455 . 2_665 N C4 H36 C5 78.9739(20) -203_555 . -201_565 N C4 H36 C7 81.4388(20) -203_555 . -203_555 N C4 H36 H6 44.6103(6) -203_555 . -202_455 N C4 H36 H9 106.2613(19) -203_555 . -203_555 N C4 H36 H10 153.13510(10) -203_555 . -201_565 N C4 H36 C14 74.9131(19) -203_555 . 3_565 N C4 H36 C15 34.26580(30) -203_555 . 3_565 N C4 H36 C16 59.7212(18) -203_555 . 2_665 N C4 H36 C18 24.1181(4) -203_555 . 1_555 N C4 H36 H28 122.0239(10) -203_555 . 3_565 N C4 H36 H30 102.5347(20) -203_555 . 3_565 N C4 H36 H33 169.6733 -203_555 . 2_665 N C5 H36 C7 16.31610(30) -201_565 . -203_555 N C5 H36 H6 113.1040(14) -201_565 . -202_455 N C5 H36 H9 174.4498 -201_565 . -203_555 N C5 H36 H10 75.2098(19) -201_565 . -201_565 N C5 H36 C14 7.9208 -201_565 . 3_565 N C5 H36 C15 110.9019(18) -201_565 . 3_565 N C5 H36 C16 20.94730(10) -201_565 . 2_665 N C5 H36 C18 56.4626(15) -201_565 . 1_555 N C5 H36 H28 43.2400(9) -201_565 . 3_565 N C5 H36 H30 171.42480(10) -201_565 . 3_565 N C5 H36 H33 93.8555(21) -201_565 . 2_665 N C7 H36 H6 106.2180(17) -203_555 . -202_455 N C7 H36 H9 160.58569(20) -203_555 . -203_555 N C7 H36 H10 71.6964(19) -203_555 . -201_565 N C7 H36 C14 23.75120(30) -203_555 . 3_565 N C7 H36 C15 115.5729(17) -203_555 . 3_565 N C7 H36 C16 22.81890(20) -203_555 . 2_665 N C7 H36 C18 62.4167(14) -203_555 . 1_555 N C7 H36 H28 45.1035(11) -203_555 . 3_565 N C7 H36 H30 171.41180(10) -203_555 . 3_565 N C7 H36 H33 89.6149(20) -203_555 . 2_665 N H6 H36 H9 70.6307(14) -202_455 . -203_555 N H6 H36 H10 144.2748(9) -202_455 . -201_565 N H6 H36 C14 112.5631(13) -202_455 . 3_565 N H6 H36 C15 38.8749(10) -202_455 . 3_565 N H6 H36 C16 92.3158(13) -202_455 . 2_665 N H6 H36 C18 67.62080(20) -202_455 . 1_555 N H6 H36 H28 149.4296(7) -202_455 . 3_565 N H6 H36 H30 72.5886(16) -202_455 . 3_565 N H6 H36 H33 135.0726(9) -202_455 . 2_665 N H9 H36 H10 99.3525(19) -203_555 . -201_565 N H9 H36 C14 174.96480(10) -203_555 . 3_565 N H9 H36 C15 74.6134(17) -203_555 . 3_565 N H9 H36 C16 162.86110(10) -203_555 . 2_665 N H9 H36 C18 129.0019(14) -203_555 . 1_555 N H9 H36 H28 131.6630(9) -203_555 . 3_565 N H9 H36 H30 10.84800(10) -203_555 . 3_565 N H9 H36 H33 80.7105(20) -203_555 . 2_665 N H10 H36 C14 80.2800(19) -201_565 . 3_565 N H10 H36 C15 172.16409(20) -201_565 . 3_565 N H10 H36 C16 93.5973(17) -201_565 . 2_665 N H10 H36 C18 131.6367(4) -201_565 . 1_555 N H10 H36 H28 33.6929(10) -201_565 . 3_565 N H10 H36 H30 104.1015(19) -201_565 . 3_565 N H10 H36 H33 18.64570(20) -201_565 . 2_665 N C14 H36 C15 105.2804(17) 3_565 . 3_565 N C14 H36 C16 21.0459 3_565 . 2_665 N C14 H36 C18 51.4921(14) 3_565 . 1_555 N C14 H36 H28 47.1846(8) 3_565 . 3_565 N C14 H36 H30 164.63510(20) 3_565 . 3_565 N C14 H36 H33 98.8176(20) 3_565 . 2_665 N C15 H36 C16 93.3321(15) 3_565 . 2_665 N C15 H36 C18 54.52520(30) 3_565 . 1_555 N C15 H36 H28 150.3332(10) 3_565 . 3_565 N C15 H36 H30 69.0950(18) 3_565 . 3_565 N C15 H36 H33 154.73151(30) 3_565 . 2_665 N C16 H36 C18 39.6043(12) 2_665 . 1_555 N C16 H36 H28 63.5312(8) 2_665 . 3_565 N C16 H36 H30 162.25430(20) 2_665 . 3_565 N C16 H36 H33 111.9358(18) 2_665 . 2_665 N C18 H36 H28 98.6198(6) 1_555 . 3_565 N C18 H36 H30 123.3436(15) 1_555 . 3_565 N C18 H36 H33 150.2625(6) 1_555 . 2_665 N H28 H36 H30 133.7721(10) 3_565 . 3_565 N H28 H36 H33 51.8516(12) 3_565 . 2_665 N H30 H36 H33 85.6667(21) 3_565 . 2_665 N C2 H37 C3 38.7840(12) -201_454 . -202_344 N C2 H37 C4 35.74550(20) -201_565 . -203_555 N C2 H37 C5 64.4872(16) -201_565 . -201_565 N C2 H37 C7 88.0514(16) -201_565 . -203_555 N C2 H37 H5 46.06200(20) -201_565 . -201_565 N C2 H37 H6 52.3133 -201_565 . -202_455 N C2 H37 H7 159.54730(10) -201_565 . -202_455 N C2 H37 H8 63.6221(7) -201_565 . -203_555 N C2 H37 H11 107.5854(10) -201_565 . -201_565 N C2 H37 C14 63.4176(18) -201_565 . 3_565 N C2 H37 C15 32.90480(10) -201_565 . 3_565 N C2 H37 C16 58.8869(15) -201_565 . 2_665 N C2 H37 C17 37.35750(10) -201_565 . 2_665 N C2 H37 C18 27.1241(8) -201_565 . 1_555 N C2 H37 H29 103.3089(11) -201_565 . 3_565 N C2 H37 H31 64.4951(7) -201_565 . 3_565 N C2 H37 H32 106.7183(10) -201_565 . 2_665 N C2 H37 H35 99.6392(17) -201_565 . 2_665 N C3 H37 C4 31.4770(4) -202_455 . -203_555 N C3 H37 C5 26.7206(4) -202_455 . -201_565 N C3 H37 C7 49.30790(30) -202_455 . -203_555 N C3 H37 H5 84.1512(11) -202_455 . -201_565 N C3 H37 H6 49.90300(30) -202_455 . -202_455 N C3 H37 H7 134.2221(13) -202_455 . -202_455 N C3 H37 H8 89.7255(8) -202_455 . -203_555 N C3 H37 H11 69.08370(30) -202_455 . -201_565 N C3 H37 C14 24.6553(5) -202_455 . 3_565 N C3 H37 C15 43.2300(8) -202_455 . 3_565 N C3 H37 C16 23.55810(20) -202_455 . 2_665 N C3 H37 C17 74.5426(14) -202_455 . 2_665 N C3 H37 C18 11.9420(4) -202_455 . 1_555 N C3 H37 H29 65.46710(10) -202_455 . 3_565 N C3 H37 H31 87.2451(8) -202_455 . 3_565 N C3 H37 H32 68.48920(30) -202_455 . 2_665 N C3 H37 H35 138.1110(5) -202_455 . 2_665 N C4 H37 C5 42.9193(11) -203_555 . -201_565 N C4 H37 C7 68.9436(10) -203_555 . -203_555 N C4 H37 H5 76.13660(10) -203_555 . -201_565 N C4 H37 H6 20.3287 -203_555 . -202_455 N C4 H37 H7 154.5773(6) -203_555 . -202_455 N C4 H37 H8 59.9594(4) -203_555 . -203_555 N C4 H37 H11 81.8136(6) -203_555 . -201_565 N C4 H37 C14 48.1229(11) -203_555 . 3_565 N C4 H37 C15 13.9724(4) -203_555 . 3_565 N C4 H37 C16 34.7090(11) -203_555 . 2_665 N C4 H37 C17 56.5103(7) -203_555 . 2_665 N C4 H37 C18 25.85490(10) -203_555 . 1_555 N C4 H37 H29 87.3016(5) -203_555 . 3_565 N C4 H37 H31 56.5878(4) -203_555 . 3_565 N C4 H37 H32 79.9088(7) -203_555 . 2_665 N C4 H37 H35 115.5076(10) -203_555 . 2_665 N C5 H37 C7 26.21650(20) -201_565 . -203_555 N C5 H37 H5 110.4650(15) -201_565 . -201_565 N C5 H37 H6 52.1983(10) -201_565 . -202_455 N C5 H37 H7 114.1124(19) -201_565 . -202_455 N C5 H37 H8 100.8008(16) -201_565 . -203_555 N C5 H37 H11 43.1635(7) -201_565 . -201_565 N C5 H37 C14 9.86360(10) -201_565 . 3_565 N C5 H37 C15 56.8795(16) -201_565 . 3_565 N C5 H37 C16 8.36920(10) -201_565 . 2_665 N C5 H37 C17 97.2184(19) -201_565 . 2_665 N C5 H37 C18 37.4959(8) -201_565 . 1_555 N C5 H37 H29 44.4635(7) -201_565 . 3_565 N C5 H37 H31 96.1264(16) -201_565 . 3_565 N C5 H37 H32 42.2327(6) -201_565 . 2_665 N C5 H37 H35 158.18420(10) -201_565 . 2_665 N C7 H37 H5 132.0183(15) -203_555 . -201_565 N C7 H37 H6 75.1061(9) -203_555 . -202_455 N C7 H37 H7 87.9977(17) -203_555 . -202_455 N C7 H37 H8 123.9723(15) -203_555 . -203_555 N C7 H37 H11 21.6581(7) -203_555 . -201_565 N C7 H37 C14 24.65290(20) -203_555 . 3_565 N C7 H37 C15 82.8304(14) -203_555 . 3_565 N C7 H37 C16 34.24860(10) -203_555 . 2_665 N C7 H37 C17 123.0347(17) -203_555 . 2_665 N C7 H37 C18 61.1617(7) -203_555 . 1_555 N C7 H37 H29 18.3750(5) -203_555 . 3_565 N C7 H37 H31 118.4236(15) -203_555 . 3_565 N C7 H37 H32 22.2716(7) -203_555 . 2_665 N C7 H37 H35 171.41460(20) -203_555 . 2_665 N H5 H37 H6 83.48250(30) -201_565 . -202_455 N H5 H37 H7 129.0366(6) -201_565 . -202_455 N H5 H37 H8 55.0560(15) -201_565 . -203_555 N H5 H37 H11 153.1389(8) -201_565 . -201_565 N H5 H37 C14 108.2126(16) -201_565 . 3_565 N H5 H37 C15 65.6780(5) -201_565 . 3_565 N H5 H37 C16 104.8868(13) -201_565 . 2_665 N H5 H37 C17 24.5754(7) -201_565 . 2_665 N H5 H37 C18 72.9715(7) -201_565 . 1_555 N H5 H37 H29 142.1541(12) -201_565 . 3_565 N H5 H37 H31 60.5313(15) -201_565 . 3_565 N H5 H37 H32 152.6328(8) -201_565 . 2_665 N H5 H37 H35 56.4251(16) -201_565 . 2_665 N H6 H37 H7 144.69020(30) -202_455 . -202_455 N H6 H37 H8 49.0637(6) -202_455 . -203_555 N H6 H37 H11 81.0105(8) -202_455 . -201_565 N H6 H37 C14 60.2077(9) -202_455 . 3_565 N H6 H37 C15 19.97960(20) -202_455 . 3_565 N H6 H37 C16 44.1297(9) -202_455 . 2_665 N H6 H37 C17 59.8373(4) -202_455 . 2_665 N H6 H37 C18 46.04390(10) -202_455 . 1_555 N H6 H37 H29 92.6428(4) -202_455 . 3_565 N H6 H37 H31 44.0127(6) -202_455 . 3_565 N H6 H37 H32 78.4923(9) -202_455 . 2_665 N H6 H37 H35 106.5610(9) -202_455 . 2_665 N H7 H37 H8 133.6710(5) -202_455 . -203_555 N H7 H37 H11 73.0214(13) -202_455 . -201_565 N H7 H37 C14 111.4033(19) -202_455 . 3_565 N H7 H37 C15 164.48959(10) -202_455 . 3_565 N H7 H37 C16 121.7122(18) -202_455 . 2_665 N H7 H37 C17 148.4281 -202_455 . 2_665 N H7 H37 C18 145.4108(9) -202_455 . 1_555 N H7 H37 H29 70.1545(12) -202_455 . 3_565 N H7 H37 H31 134.1084(5) -202_455 . 3_565 N H7 H37 H32 74.8078(13) -202_455 . 2_665 N H7 H37 H35 86.0720(18) -202_455 . 2_665 N H8 H37 H11 124.4752(16) -203_555 . -201_565 N H8 H37 C14 107.6843(15) -203_555 . 3_565 N H8 H37 C15 46.7366 -203_555 . 3_565 N H8 H37 C16 92.4980(15) -203_555 . 2_665 N H8 H37 C17 34.8990(9) -203_555 . 2_665 N H8 H37 C18 79.9270(4) -203_555 . 1_555 N H8 H37 H29 140.5287(10) -203_555 . 3_565 N H8 H37 H31 6.2769 -203_555 . 3_565 N H8 H37 H32 121.6512(17) -203_555 . 2_665 N H8 H37 H35 57.5987(15) -203_555 . 2_665 N H11 H37 C14 44.9286(8) -201_565 . 3_565 N H11 H37 C15 94.5349(11) -201_565 . 3_565 N H11 H37 C16 49.5484(5) -201_565 . 2_665 N H11 H37 C17 138.3164(13) -201_565 . 2_665 N H11 H37 C18 80.48170(20) -201_565 . 1_555 N H11 H37 H29 19.5576(7) -201_565 . 3_565 N H11 H37 H31 118.2041(16) -201_565 . 3_565 N H11 H37 H32 2.82760(10) -201_565 . 2_665 N H11 H37 H35 149.7576(8) -201_565 . 2_665 N C14 H37 C15 61.9486(15) 3_565 . 3_565 N C14 H37 C16 16.3724 3_565 . 2_665 N C14 H37 C17 98.8032(19) 3_565 . 2_665 N C14 H37 C18 36.5218(9) 3_565 . 1_555 N C14 H37 H29 41.3845(7) 3_565 . 3_565 N C14 H37 H31 103.5505(15) 3_565 . 3_565 N C14 H37 H32 44.6693(8) 3_565 . 2_665 N C14 H37 H35 162.44650(10) 3_565 . 2_665 N C15 H37 C16 48.6370(15) 3_565 . 2_665 N C15 H37 C17 43.97010(20) 3_565 . 2_665 N C15 H37 C18 34.7849(4) 3_565 . 1_555 N C15 H37 H29 101.2027(9) 3_565 . 3_565 N C15 H37 H31 44.01610(10) 3_565 . 3_565 N C15 H37 H32 92.4215(12) 3_565 . 2_665 N C15 H37 H35 101.5390(15) 3_565 . 2_665 N C16 H37 C17 89.8092(18) 2_665 . 2_665 N C16 H37 C18 32.6517(6) 2_665 . 1_555 N C16 H37 H29 52.5941(6) 2_665 . 3_565 N C16 H37 H31 87.9246(15) 2_665 . 3_565 N C16 H37 H32 48.2620(5) 2_665 . 2_665 N C16 H37 H35 149.8151 2_665 . 2_665 N C17 H37 C18 62.6162(10) 2_665 . 1_555 N C17 H37 H29 140.0095(13) 2_665 . 3_565 N C17 H37 H31 39.1418(9) 2_665 . 3_565 N C17 H37 H32 136.3289(13) 2_665 . 2_665 N C17 H37 H35 63.6833(19) 2_665 . 2_665 N C18 H37 H29 77.39450(30) 1_555 . 3_565 N C18 H37 H31 78.20730(30) 1_555 . 3_565 N C18 H37 H32 79.69570(20) 1_555 . 2_665 N C18 H37 H35 126.1722(9) 1_555 . 2_665 N H29 H37 H31 134.5213(11) 3_565 . 3_565 N H29 H37 H32 22.1074(7) 3_565 . 2_665 N H29 H37 H35 156.1664(6) 3_565 . 2_665 N H31 H37 H32 115.3794(17) 3_565 . 2_665 N H31 H37 H35 62.5623(15) 3_565 . 2_665 N H32 H37 H35 149.1819(8) 2_665 . 2_665 N C2 H38 N2 28.7126(6) -201_565 . -203_555 N C2 H38 H4 34.4624(8) -201_565 . -201_565 N C2 H38 H5 75.4213(15) -201_565 . -202_455 N C2 H38 C15 31.0302(7) -201_565 . 3_565 N C2 H38 C19 32.13090(20) -201_565 . 1_555 N C2 H38 C19 63.27070(20) -201_565 . 2_665 N C2 H38 N5 39.2948(4) -201_565 . 3_565 N C2 H38 H34 59.6279 -201_565 . 2_665 N C2 H38 H39 103.2527(5) -201_565 . 2_665 N N2 H38 H4 56.1892(14) -203_555 . -201_565 N N2 H38 H5 50.0947(8) -203_555 . -202_455 N N2 H38 C15 53.4300(13) -203_555 . 3_565 N N2 H38 C19 35.86440(10) -203_555 . 1_555 N N2 H38 C19 39.0842(4) -203_555 . 2_665 N N2 H38 N5 19.07540(10) -203_555 . 3_565 N N2 H38 H34 88.3237(6) -203_555 . 2_665 N N2 H38 H39 76.6731(11) -203_555 . 2_665 N H4 H38 H5 84.9640(19) -201_565 . -202_455 N H4 H38 C15 3.48810(10) -201_565 . 3_565 N H4 H38 C19 65.1616(6) -201_565 . 1_555 N H4 H38 C19 94.9982(10) -201_565 . 2_665 N H4 H38 N5 72.0076(12) -201_565 . 3_565 N H4 H38 H34 45.4551(5) -201_565 . 2_665 N H4 H38 H39 131.92889(30) -201_565 . 2_665 N H5 H38 C15 84.4429(19) -202_455 . 3_565 N H5 H38 C19 82.7969(8) -202_455 . 1_555 N H5 H38 C19 50.1151 -202_455 . 2_665 N H5 H38 N5 56.3366(7) -202_455 . 3_565 N H5 H38 H34 129.8804(14) -202_455 . 2_665 N H5 H38 H39 54.9196(14) -202_455 . 2_665 N C15 H38 C19 61.6788(5) 3_565 . 1_555 N C15 H38 C19 92.0408(9) 3_565 . 2_665 N C15 H38 N5 68.8545(11) 3_565 . 3_565 N C15 H38 H34 45.5952(5) 3_565 . 2_665 N C15 H38 H39 129.63229(20) 3_565 . 2_665 N C19 H38 C19 45.41370(10) 1_555 . 2_665 N C19 H38 N5 27.06650(10) 1_555 . 3_565 N C19 H38 H34 71.13610(20) 1_555 . 2_665 N C19 H38 H39 82.8384(4) 1_555 . 2_665 N C19 H38 N5 24.01270(20) 2_665 . 3_565 N C19 H38 H34 116.38770(30) 2_665 . 2_665 N C19 H38 H39 40.2222(7) 2_665 . 2_665 N N5 H38 H34 94.4026(5) 3_565 . 2_665 N N5 H38 H39 64.1918(9) 3_565 . 2_665 N H34 H38 H39 151.42979(10) 2_665 . 2_665 N C2 H39 H5 40.4342(13) -201_565 . -201_565 N C2 H39 C17 33.6691(10) -201_565 . 2_665 N C2 H39 C19 30.50010(30) -201_565 . 1_555 N C2 H39 C19 62.1452(8) -201_565 . 3_565 N C2 H39 N5 54.7132(12) -201_565 . 2_665 N C2 H39 N5 41.21340(10) -201_565 . 3_565 N C2 H39 H34 58.0772(5) -201_565 . 2_665 N C2 H39 H38 92.4951(10) -201_565 . 3_565 N H5 H39 C17 19.4438(6) -201_565 . 2_665 N H5 H39 C19 70.7418(16) -201_565 . 1_555 N H5 H39 C19 78.7158(14) -201_565 . 3_565 N H5 H39 N5 63.9717(15) -201_565 . 2_665 N H5 H39 N5 81.6320(14) -201_565 . 3_565 N H5 H39 H34 62.4717(6) -201_565 . 2_665 N H5 H39 H38 77.1392(5) -201_565 . 3_565 N C17 H39 C19 62.7811(13) 2_665 . 1_555 N C17 H39 C19 88.1912(17) 2_665 . 3_565 N C17 H39 N5 75.5362(18) 2_665 . 2_665 N C17 H39 N5 71.4306(10) 2_665 . 3_565 N C17 H39 H34 43.7707 2_665 . 2_665 N C17 H39 H38 96.1500(11) 2_665 . 3_565 N C19 H39 C19 54.1091(6) 1_555 . 3_565 N C19 H39 N5 56.2338(9) 1_555 . 2_665 N C19 H39 N5 12.17840(20) 1_555 . 3_565 N C19 H39 H34 69.5118(6) 1_555 . 2_665 N C19 H39 H38 99.8549(8) 1_555 . 3_565 N C19 H39 N5 15.57400(10) 3_565 . 2_665 N C19 H39 N5 60.3932(5) 3_565 . 3_565 N C19 H39 H34 119.4735(13) 3_565 . 2_665 N C19 H39 H38 48.56270(10) 3_565 . 3_565 N N5 H39 N5 65.3936(7) 2_665 . 3_565 N N5 H39 H34 112.5443(16) 2_665 . 2_665 N N5 H39 H38 43.64580(10) 2_665 . 3_565 N N5 H39 H34 69.0919(5) 3_565 . 2_665 N N5 H39 H38 108.2886(6) 3_565 . 3_565 N H34 H39 H38 139.5749(11) 2_665 . 3_565 N C1 C20 N1 72.7299(6) 1_555 . 1_555 N C1 C20 N1 72.6662(6) 1_555 . 2_445 N C1 C20 N1 72.8035(6) 1_555 . 3_545 N C1 C20 H1 65.3571(8) 1_555 . 1_555 N C1 C20 H2 63.2814(8) 1_555 . 1_555 N C1 C20 H40 66.6347(8) 1_555 . 1_555 N C1 C20 H41 71.3747(6) 1_555 . 1_555 N C1 C20 H42 176.14790(10) 1_555 . 1_555 N N1 C20 N1 0.0 1_555 . 2_445 N N1 C20 N1 0.0 1_555 . 3_545 N N1 C20 H1 109.5165(7) 1_555 . 1_555 N N1 C20 H2 107.3593(8) 1_555 . 1_555 N N1 C20 H40 110.1632(7) 1_555 . 1_555 N N1 C20 H41 111.3047(6) 1_555 . 1_555 N N1 C20 H42 110.7845(5) 1_555 . 1_555 N N1 C20 N1 0.0 2_445 . 3_545 N N1 C20 H1 109.1425(7) 2_445 . 1_555 N N1 C20 H2 107.6533(8) 2_445 . 1_555 N N1 C20 H40 109.7855(7) 2_445 . 1_555 N N1 C20 H41 111.6346(6) 2_445 . 1_555 N N1 C20 H42 110.8360(5) 2_445 . 1_555 N N1 C20 H1 109.2389(7) 3_545 . 1_555 N N1 C20 H2 107.7170(8) 3_545 . 1_555 N N1 C20 H40 109.8798(7) 3_545 . 1_555 N N1 C20 H41 111.6817(6) 3_545 . 1_555 N N1 C20 H42 110.6995(5) 3_545 . 1_555 N H1 C20 H2 100.9809(9) 1_555 . 1_555 N H1 C20 H40 1.2776 1_555 . 1_555 N H1 C20 H41 105.5336(7) 1_555 . 1_555 N H1 C20 H42 111.4412(9) 1_555 . 1_555 N H2 C20 H40 101.7366(9) 1_555 . 1_555 N H2 C20 H41 8.09330(20) 1_555 . 1_555 N H2 C20 H42 116.2183(9) 1_555 . 1_555 N H40 C20 H41 106.1594(7) 1_555 . 1_555 N H40 C20 H42 110.1646(9) 1_555 . 1_555 N H41 C20 H42 108.1461(6) 1_555 . 1_555 N C1 H40 H1 67.0662(7) 1_555 . 1_555 N C1 H40 C20 46.2990(15) 1_555 . 1_555 N H1 H40 C20 113.3652(8) 1_555 . 1_555 N C1 H41 H2 63.2814(8) 1_555 . 1_555 N C1 H41 C20 45.3439(15) 1_555 . 1_555 N H2 H41 C20 108.6253(6) 1_555 . 1_555 N loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_distance _geom_bond_site_symmetry_1 _geom_bond_site_symmetry_2 _geom_bond_publ_flag Al1 O2 1.733(6) . 1_555 N Al1 O3 1.747(6) . 1_655 N Al1 O4 1.734(6) . 1_555 N Al1 O6 1.748(6) . 1_555 N Al1 P1 3.049(10) . -1_656 N Al1 Si1 3.049(10) . -1_656 N Al1 Si2 3.091(17) . 1_655 N Al2 O1 1.743(6) . 1_545 N Al2 O7 1.762(6) . -1_656 N Al2 O8 1.743(6) . 101_445 N Al2 O9 1.783(14) . -2_556 N Al2 Si2 3.096(10) . 101_545 N Al3 O5 1.736(6) . 201_544 N Al3 O10 1.737(6) . 1_554 N Al3 O11 1.726(6) . 1_655 N Al3 O12 1.728(6) . 1_555 N Al3 P1 3.066(16) . 201_554 N Al3 Si1 3.066(16) . 201_554 N Al3 Si3 3.083(12) . 2_654 N Al3 Si3 3.119(13) . -3_656 N Al3 H42 2.521(13) . 102_544 N C1 N1 1.471310(30) . 1_555 N C1 N1 1.466070(30) . 2_445 N C1 N1 1.477420(30) . 3_545 N C1 H1 1.098930(20) . 1_555 N C1 H2 1.096970(20) . 1_555 N C1 H3 1.117270(30) . 1_555 N C1 C20 0.873600(20) . 1_555 N C1 H40 1.109280(20) . 1_555 N C1 H41 1.163790(20) . 1_555 N C1 H42 1.98976(6) . 1_555 N C2 C2 1.69403(4) . 2_665 N C2 C2 1.69403(4) . 3_565 N C2 C3 1.031750(20) . 2_665 N C2 C3 2.15287(4) . 3_565 N C2 C4 0.889140(20) . 3_565 N C2 C5 1.66500(4) . 1_555 N C2 C7 2.20939(6) . 3_565 N C2 N2 1.517650(30) . 1_555 N C2 N2 0.907420(20) . 2_665 N C2 N2 0.799960(20) . 3_565 N C2 H4 1.106550(20) . 1_555 N C2 H4 2.02527(4) . 3_565 N C2 H5 1.100580(20) . 1_555 N C2 H5 1.90120(4) . 2_665 N C2 H6 1.303370(30) . 2_665 N C2 H7 1.88559(4) . 2_665 N C2 H8 1.383600(30) . 3_565 N C2 H9 1.77576(4) . 3_565 N C2 C14 1.67313(5) . -203_444 N C2 C15 0.879090(20) . -203_444 N C2 C16 1.400400(30) . -202_344 N C2 C17 0.938520(20) . -202_344 N C2 C17 2.18010(5) . -203_444 N C2 C18 0.740440(20) . -201_454 N C2 C18 2.01102(4) . -202_344 N C2 C18 2.12796(4) . -203_444 N C2 C19 0.928420(20) . -201_454 N C2 C19 1.752620(30) . -202_344 N C2 C19 1.637420(30) . -203_444 N C2 N4 1.95461(5) . -201_454 N C2 N4 1.95690(5) . -202_344 N C2 N4 2.17902(4) . -203_444 N C2 N5 2.01487(4) . -201_454 N C2 N5 1.383240(20) . -202_344 N C2 N5 1.151610(20) . -203_444 N C2 H30 1.92437(4) . -203_444 N C2 H31 1.484070(30) . -203_444 N C2 H33 1.98243(4) . -202_344 N C2 H34 1.576900(30) . -202_344 N C2 H35 1.97646(4) . -202_344 N C2 H36 1.497220(30) . -201_454 N C2 H37 1.522010(30) . -201_454 N C2 H38 1.652150(30) . -201_454 N C2 H38 2.05862(4) . -203_444 N C2 H39 1.69286(4) . -201_454 N C3 C2 2.15287(4) . 2_665 N C3 C2 1.031750(20) . 3_565 N C3 C4 0.693800(10) . 2_665 N C3 C5 0.957800(20) . 3_565 N C3 C6 1.66642(4) . 1_555 N C3 C7 1.28650(4) . 2_665 N C3 N2 1.536380(30) . 1_555 N C3 N2 1.690380(30) . 2_665 N C3 H4 1.87479(4) . 3_565 N C3 H5 1.333460(30) . 3_565 N C3 H6 1.100220(20) . 1_555 N C3 H7 1.094050(20) . 1_555 N C3 H8 1.204210(20) . 2_665 N C3 H9 1.73728(4) . 2_665 N C3 H10 1.786200(30) . 3_565 N C3 H11 1.231150(30) . 3_565 N C3 H14 1.736740(30) . 2_665 N C3 C14 0.990990(20) . -202_344 N C3 C15 1.137120(20) . -202_344 N C3 C16 0.655020(10) . -201_454 N C3 C17 1.128860(30) . -201_454 N C3 C18 0.360830(10) . -203_444 N C3 C19 1.92991(4) . -203_444 N C3 N4 1.746830(30) . -201_454 N C3 N4 2.04693(4) . -202_344 N C3 N4 1.608000(30) . -203_444 N C3 N5 2.09882(4) . -201_454 N C3 N5 2.17402(4) . -202_344 N C3 H28 1.97463(4) . -202_344 N C3 H29 1.243090(30) . -202_344 N C3 H30 2.06878(4) . -202_344 N C3 H31 1.419750(30) . -202_344 N C3 H32 1.332940(30) . -201_454 N C3 H33 1.628360(30) . -201_454 N C3 H34 1.98872(4) . -201_454 N C3 H35 1.705190(30) . -201_454 N C3 H36 1.209990(30) . -203_444 N C3 H37 0.791970(20) . -203_444 N C4 C2 0.889140(20) . 2_665 N C4 C3 0.693800(10) . 3_565 N C4 C5 1.089040(30) . 2_665 N C4 C6 1.99892(5) . 3_565 N C4 C7 1.67040(4) . 1_555 N C4 N2 1.525460(30) . 1_555 N C4 N2 1.716710(30) . 3_565 N C4 H4 1.316120(30) . 2_665 N C4 H5 1.474310(30) . 2_665 N C4 H6 0.507670(10) . 3_565 N C4 H7 1.586940(30) . 3_565 N C4 H8 1.106700(20) . 1_555 N C4 H9 1.094650(20) . 1_555 N C4 H10 1.473240(30) . 2_665 N C4 H11 1.636860(30) . 2_665 N C4 C14 1.238260(30) . -201_454 N C4 C15 0.482970(10) . -201_454 N C4 C16 0.757930(20) . -203_444 N C4 C17 1.090000(20) . -203_444 N C4 C18 0.537650(10) . -202_344 N C4 C19 1.708640(30) . -202_344 N C4 N4 2.01845(4) . -202_344 N C4 N4 1.977730(30) . -203_444 N C4 N5 1.838610(30) . -201_454 N C4 H28 1.95238(5) . -201_454 N C4 H29 1.77875(4) . -201_454 N C4 H30 1.389110(30) . -201_454 N C4 H31 1.161150(20) . -201_454 N C4 H32 1.69624(4) . -203_444 N C4 H33 1.200830(20) . -203_444 N C4 H34 1.55530(4) . -203_444 N C4 H35 1.91787(4) . -203_444 N C4 H36 0.705910(10) . -202_344 N C4 H37 1.232520(30) . -202_344 N C4 H38 2.06808(4) . -202_344 N C5 C2 1.66500(4) . 1_555 N C5 C3 0.957800(20) . 2_665 N C5 C4 1.089040(30) . 3_565 N C5 C6 0.942660(20) . 2_665 N C5 C7 0.739350(10) . 3_565 N C5 N2 2.19504(4) . 2_665 N C5 N2 2.05927(4) . 3_565 N C5 N3 1.562220(30) . 1_555 N C5 N3 2.18542(4) . 2_665 N C5 N3 1.796050(30) . 3_565 N C5 H6 1.339320(30) . 2_665 N C5 H7 1.787500(30) . 2_665 N C5 H8 1.98087(4) . 3_565 N C5 H9 1.635340(30) . 3_565 N C5 H10 1.096450(20) . 1_555 N C5 H11 1.096950(20) . 1_555 N C5 H14 1.710350(30) . 3_565 N C5 H15 1.355180(30) . 3_565 N C5 H12 1.310770(30) . 2_665 N C5 H13 1.78797(4) . 2_665 N C5 C13 1.86556(4) . -201_454 N C5 C14 0.285270(10) . -203_444 N C5 C15 1.51118(4) . -203_444 N C5 C16 0.363950(10) . -202_344 N C5 C17 2.01360(5) . -202_344 N C5 C18 0.986640(20) . -201_454 N C5 N4 1.401840(30) . -201_454 N C5 N4 1.342650(30) . -202_344 N C5 N4 1.81203(4) . -203_444 N C5 H26 1.82600(5) . -201_454 N C5 H28 1.022170(20) . -203_444 N C5 H29 1.136470(20) . -203_444 N C5 H30 2.02247(4) . -203_444 N C5 H32 1.095240(20) . -202_344 N C5 H33 1.125260(20) . -202_344 N C5 H36 0.975200(20) . -201_454 N C5 H37 1.596540(30) . -201_454 N C6 C3 1.66642(4) . 1_555 N C6 C4 1.99892(5) . 2_665 N C6 C5 0.942660(20) . 3_565 N C6 C6 1.86205(4) . 2_665 N C6 C6 1.86205(4) . 3_565 N C6 C7 0.666790(10) . 2_665 N C6 C8 2.15502(4) . 2_665 N C6 C8 1.75020(4) . 3_565 N C6 N3 1.544590(30) . 1_555 N C6 N3 1.031980(20) . 2_665 N C6 N3 0.882210(20) . 3_565 N C6 H10 1.727470(30) . 3_565 N C6 H11 1.332040(30) . 3_565 N C6 H14 1.64215(4) . 2_665 N C6 H15 1.222780(30) . 2_665 N C6 H17 1.95212(5) . 3_565 N C6 H12 1.099370(20) . 1_555 N C6 H13 1.105830(20) . 1_555 N C6 C12 2.01554(5) . -201_454 N C6 C13 1.583790(30) . -201_454 N C6 C13 2.06070(4) . -202_344 N C6 C13 0.938750(20) . -203_444 N C6 C14 2.06907(4) . -201_454 N C6 C14 0.769740(20) . -202_344 N C6 C14 2.18507(4) . -203_444 N C6 C16 1.264840(30) . -201_454 N C6 C18 1.74765(5) . -203_444 N C6 N4 1.171200(20) . -201_454 N C6 N4 1.531000(30) . -202_344 N C6 N4 1.136440(20) . -203_444 N C6 H25 1.95905(5) . -201_454 N C6 H26 1.126340(30) . -203_444 N C6 H27 1.555700(30) . -203_444 N C6 H28 1.047320(20) . -202_344 N C6 H29 1.131510(20) . -202_344 N C6 H32 1.298120(30) . -201_454 N C6 H33 1.908560(30) . -201_454 N C6 H36 1.88845(4) . -203_444 N C7 C2 2.20939(6) . 2_665 N C7 C3 1.28650(4) . 3_565 N C7 C4 1.67040(4) . 1_555 N C7 C5 0.739350(10) . 2_665 N C7 C6 0.666790(10) . 3_565 N C7 N3 1.542670(30) . 1_555 N C7 N3 1.537840(30) . 2_665 N C7 N3 2.14968(5) . 3_565 N C7 H6 1.88734(4) . 3_565 N C7 H7 1.684790(30) . 3_565 N C7 H10 1.569290(30) . 2_665 N C7 H11 0.667730(10) . 2_665 N C7 H14 1.095850(20) . 1_555 N C7 H15 1.105990(20) . 1_555 N C7 H12 1.343700(30) . 3_565 N C7 H13 1.081170(20) . 3_565 N C7 C13 1.364500(30) . -202_344 N C7 C13 2.23925(4) . -203_444 N C7 C14 0.706240(10) . -201_454 N C7 C15 2.13784(5) . -201_454 N C7 C16 0.933380(20) . -203_444 N C7 C18 1.47940(4) . -202_344 N C7 N4 1.96502(4) . -201_454 N C7 N4 1.470550(30) . -202_344 N C7 N4 1.602610(30) . -203_444 N C7 H26 1.475040(30) . -202_344 N C7 H27 1.484050(30) . -202_344 N C7 H28 1.198330(30) . -201_454 N C7 H29 0.569080(10) . -201_454 N C7 H32 0.640150(10) . -203_444 N C7 H33 1.694620(30) . -203_444 N C7 H36 1.622640(30) . -202_344 N C7 H37 1.65412(4) . -202_344 N C8 C6 1.75020(4) . 2_665 N C8 C6 2.15502(4) . 3_565 N C8 C8 1.67237(4) . 2_665 N C8 C8 1.67237(4) . 3_565 N C8 N3 1.53584(4) . 1_555 N C8 N3 1.96369(4) . 2_665 N C8 N3 1.84926(4) . 3_565 N C8 C9 1.568040(30) . 1_555 N C8 C9 2.02012(4) . 2_665 N C8 C9 1.354260(30) . 3_565 N C8 H15 1.894100(30) . 3_565 N C8 H16 1.097180(20) . 1_555 N C8 H17 1.097800(20) . 1_555 N C8 H17 1.57924(4) . 2_665 N C8 H18 1.494020(30) . 3_565 N C8 H19 1.682620(30) . 2_665 N C8 H19 1.341370(30) . 3_565 N C8 H12 1.602980(30) . 2_665 N C8 H13 1.807110(30) . 2_665 N C8 H13 1.779980(30) . 3_565 N C8 C11 2.14502(4) . -201_454 N C8 C11 1.78896(5) . -202_344 N C8 C12 1.61005(4) . -201_454 N C8 C12 0.506080(10) . -202_344 N C8 C12 1.334360(30) . -203_444 N C8 C13 1.340260(20) . -201_454 N C8 C13 1.237890(20) . -202_344 N C8 C13 2.06696(4) . -203_444 N C8 H22 1.88698(5) . -201_454 N C8 H24 1.81975(4) . -201_454 N C8 H24 1.519990(30) . -202_344 N C8 H24 0.466940(10) . -203_444 N C8 H25 1.064710(20) . -202_344 N C8 H25 2.04327(5) . -203_444 N C8 H26 0.896040(20) . -201_454 N C8 H26 2.01582(4) . -202_344 N C8 H27 1.706880(30) . -202_344 N C8 H28 1.90269(4) . -203_444 N N1 C1 1.471310(30) . 1_555 N N1 C1 1.477420(30) . 2_445 N N1 C1 1.466070(30) . 3_545 N N1 N1 0.01189 . 2_445 N N1 N1 0.01189 . 3_545 N N1 C20 1.471310(30) . 1_555 N N1 C20 1.477420(30) . 2_445 N N1 C20 1.466070(30) . 3_545 N N2 C2 1.517650(30) . 1_555 N N2 C2 0.799960(20) . 2_665 N N2 C2 0.907420(20) . 3_565 N N2 C3 1.536380(30) . 1_555 N N2 C3 1.690380(30) . 3_565 N N2 C4 1.525460(30) . 1_555 N N2 C4 1.716710(30) . 2_665 N N2 C5 2.05928(4) . 2_665 N N2 C5 2.19504(4) . 3_565 N N2 N2 0.932450(20) . 2_665 N N2 N2 0.932450(20) . 3_565 N N2 H4 1.290020(30) . 2_665 N N2 H4 1.84555(4) . 3_565 N N2 H5 1.76511(4) . 2_665 N N2 H5 1.270690(30) . 3_565 N N2 H6 1.91947(4) . 3_565 N N2 H8 2.00677(5) . 2_665 N N2 C14 2.00815(4) . -201_454 N N2 C14 2.09094(4) . -202_344 N N2 C15 1.432610(30) . -201_454 N N2 C15 1.78583(4) . -202_344 N N2 C16 2.00359(4) . -201_454 N N2 C16 1.903430(30) . -203_444 N N2 C17 1.450680(30) . -201_454 N N2 C17 1.69586(4) . -203_444 N N2 C18 1.97220(4) . -201_454 N N2 C18 1.353640(20) . -202_344 N N2 C18 1.343970(20) . -203_444 N N2 C19 1.450270(30) . -201_454 N N2 C19 0.920590(20) . -202_344 N N2 C19 1.090940(20) . -203_444 N N2 N4 2.00265(5) . -201_454 N N2 N4 1.98663(5) . -202_344 N N2 N4 1.86374(5) . -203_444 N N2 N5 0.836570(20) . -201_454 N N2 N5 1.407630(30) . -202_344 N N2 N5 1.465260(30) . -203_444 N N2 H36 1.93755(4) . -202_344 N N2 H37 1.90136(4) . -203_444 N N2 H38 1.548680(30) . -202_344 N N2 H39 1.97538(4) . -202_344 N N2 H39 1.68019(4) . -203_444 N N3 C5 1.562220(30) . 1_555 N N3 C5 1.796050(30) . 2_665 N N3 C5 2.18542(4) . 3_565 N N3 C6 1.544590(30) . 1_555 N N3 C6 0.882210(20) . 2_665 N N3 C6 1.031980(20) . 3_565 N N3 C7 1.542670(30) . 1_555 N N3 C7 2.14968(5) . 2_665 N N3 C7 1.537840(30) . 3_565 N N3 C8 1.53584(4) . 1_555 N N3 C8 1.84926(4) . 2_665 N N3 C8 1.96369(4) . 3_565 N N3 N3 0.797520(20) . 2_665 N N3 N3 0.797520(20) . 3_565 N N3 H15 1.87497(4) . 3_565 N N3 H12 1.401730(30) . 2_665 N N3 H12 1.96496(4) . 3_565 N N3 H13 1.73106(4) . 2_665 N N3 H13 1.475720(30) . 3_565 N N3 C12 2.10536(4) . -201_454 N N3 C12 1.81894(5) . -202_344 N N3 C12 1.93911(5) . -203_444 N N3 C13 1.100060(20) . -201_454 N N3 C13 0.826190(10) . -202_344 N N3 C13 1.451970(30) . -203_444 N N3 C14 1.530410(30) . -201_454 N N3 C14 1.92520(4) . -202_344 N N3 C14 1.344750(20) . -203_444 N N3 C16 1.885510(30) . -202_344 N N3 C16 2.05150(4) . -203_444 N N3 N4 1.054920(20) . -201_454 N N3 N4 0.865530(20) . -202_344 N N3 N4 1.109260(20) . -203_444 N N3 H24 1.85351(5) . -203_444 N N3 H26 1.370860(20) . -201_454 N N3 H26 1.696190(30) . -202_344 N N3 H26 2.05090(4) . -203_444 N N3 H27 1.657770(30) . -202_344 N N3 H28 1.97938(4) . -201_454 N N3 H28 1.437260(30) . -203_444 N N3 H29 1.748140(30) . -201_454 N N3 H29 1.96041(4) . -203_444 N O1 Al2 1.743(6) . 1_565 N O1 P1 1.513(6) . 1_565 N O1 Si1 1.513(6) . 1_565 N O2 Al1 1.733(6) . 1_555 N O2 P2 1.521(6) . 1_655 N O2 Si2 1.521(6) . 1_655 N O3 Al1 1.747(6) . 1_455 N O3 P1 1.523(8) . -3_556 N O3 Si1 1.523(8) . -3_556 N O4 Al1 1.734(6) . 1_555 N O4 P1 1.523(6) . -1_656 N O4 Si1 1.523(6) . -1_656 N O5 Al3 1.736(6) . 101_455 N O5 P1 1.527(6) . 1_565 N O5 Si1 1.527(6) . 1_565 N O6 Al1 1.748(6) . 1_555 N O6 P3 1.516(6) . 201_554 N O6 Si3 1.516(6) . 201_554 N O7 Al2 1.762(6) . -1_656 N O7 P2 1.539(6) . 1_655 N O7 Si2 1.539(6) . 1_655 N O8 Al2 1.743(6) . 201_554 N O8 P2 1.533(6) . 1_655 N O8 Si2 1.533(6) . 1_655 N O9 Al2 1.783(14) . -3_556 N O9 P2 1.469(6) . 1_555 N O9 Si2 1.469(6) . 1_555 N O10 Al3 1.737(6) . 1_556 N O10 P3 1.513(6) . 2_655 N O10 Si3 1.513(6) . 2_655 N O11 Al3 1.726(6) . 1_455 N O11 P3 1.513(7) . -3_556 N O11 Si3 1.513(7) . -3_556 N O11 H42 1.732(18) . 102_444 N O12 Al3 1.728(6) . 1_555 N O12 P3 1.506(6) . -1_656 N O12 Si3 1.506(6) . -1_656 N P1 Al1 3.049(10) . -1_656 N P1 Al3 3.066(16) . 101_445 N P1 O1 1.513(6) . 1_545 N P1 O3 1.523(8) . -2_556 N P1 O4 1.523(6) . -1_656 N P1 O5 1.527(6) . 1_545 N P2 O2 1.521(6) . 1_455 N P2 O7 1.539(6) . 1_455 N P2 O8 1.533(6) . 1_455 N P2 O9 1.469(6) . 1_555 N P3 O6 1.516(6) . 101_445 N P3 O10 1.513(6) . 3_665 N P3 O11 1.513(7) . -2_556 N P3 O12 1.506(6) . -1_656 N Si1 Al1 3.049(10) . -1_656 N Si1 Al3 3.066(16) . 101_445 N Si1 O1 1.513(6) . 1_545 N Si1 O3 1.523(8) . -2_556 N Si1 O4 1.523(6) . -1_656 N Si1 O5 1.527(6) . 1_545 N Si2 Al1 3.091(17) . 1_455 N Si2 Al2 3.096(10) . 201_454 N Si2 O2 1.521(6) . 1_455 N Si2 O7 1.539(6) . 1_455 N Si2 O8 1.533(6) . 1_455 N Si2 O9 1.469(6) . 1_555 N Si3 Al3 3.083(12) . 3_666 N Si3 Al3 3.119(13) . -2_566 N Si3 O6 1.516(6) . 101_445 N Si3 O10 1.513(6) . 3_665 N Si3 O11 1.513(7) . -2_556 N Si3 O12 1.506(6) . -1_656 N Si3 H42 2.470(8) . -203_345 N C9 C8 1.568040(30) . 1_555 N C9 C8 1.354260(30) . 2_665 N C9 C8 2.02012(4) . 3_565 N C9 C9 1.201140(30) . 2_665 N C9 C9 1.201140(30) . 3_565 N C9 C10 1.56164(4) . 1_555 N C9 C10 1.672060(30) . 2_665 N C9 C10 2.10855(4) . 3_565 N C9 C10 2.17553(4) . -202_344 N C9 C10 1.75578(5) . -203_444 N C9 H16 2.07443(4) . 2_665 N C9 H17 1.231900(20) . 2_665 N C9 H18 1.094230(20) . 1_555 N C9 H18 2.09932(5) . 3_565 N C9 H19 1.094860(20) . 1_555 N C9 H19 1.57142(4) . 2_665 N C9 H19 0.531510(10) . 3_565 N C9 H21 1.59055(4) . 2_665 N C9 H21 1.97217(4) . -201_454 N C9 H21 1.87354(4) . -203_444 N C9 C11 1.662720(30) . -201_454 N C9 C11 0.819490(10) . -202_344 N C9 C11 1.132810(20) . -203_444 N C9 C12 1.580670(30) . -201_454 N C9 C12 1.340030(20) . -202_344 N C9 C12 0.896120(20) . -203_444 N C9 C13 2.08967(6) . -202_344 N C9 H22 1.614890(30) . -201_454 N C9 H22 0.850690(20) . -202_344 N C9 H22 1.86908(4) . -203_444 N C9 H23 1.656710(30) . -202_344 N C9 H23 2.04250(4) . -203_444 N C9 H24 1.204650(20) . -201_454 N C9 H24 1.831860(30) . -202_344 N C9 H24 1.156680(20) . -203_444 N C9 H25 1.499190(30) . -203_444 N C9 H26 2.02473(5) . -202_344 N C10 C9 1.56164(4) . 1_555 N C10 C9 2.10855(4) . 2_665 N C10 C9 1.672060(30) . 3_565 N C10 C9 1.75578(5) . -202_344 N C10 C9 2.17553(4) . -203_444 N C10 C10 1.54410(4) . 2_665 N C10 C10 1.54410(4) . 3_565 N C10 C10 1.81562(4) . -201_454 N C10 C10 0.955110(20) . -202_344 N C10 C10 0.955110(20) . -203_444 N C10 H18 2.08693(5) . -202_344 N C10 H19 2.00056(4) . 2_665 N C10 H19 1.41692(4) . 3_565 N C10 H19 1.87165(5) . -201_454 N C10 H19 2.05829(4) . -202_344 N C10 H20 1.095320(20) . 1_555 N C10 H20 1.76261(4) . -202_344 N C10 H20 1.73352(4) . -203_444 N C10 H21 1.096870(20) . 1_555 N C10 H21 1.041000(20) . 2_665 N C10 H21 2.07072(5) . 3_565 N C10 H21 1.79430(4) . -201_454 N C10 H21 1.82729(4) . -202_344 N C10 H21 0.367090(10) . -203_444 N C10 C11 1.554060(30) . 1_555 N C10 C11 2.15116(4) . 2_665 N C10 C11 1.442940(30) . 3_565 N C10 C11 1.720970(30) . -201_454 N C10 C11 0.865630(20) . -202_344 N C10 C11 1.815150(30) . -203_444 N C10 H22 2.03956(4) . 2_665 N C10 H22 1.148560(30) . 3_565 N C10 H22 1.202580(20) . -201_454 N C10 H22 1.411670(30) . -202_344 N C10 H23 1.98191(4) . 3_565 N C10 H23 1.381230(20) . -202_344 N H1 C1 1.098930(20) . 1_555 N H1 H2 1.76522(4) . 1_555 N H1 H3 1.79778(4) . 1_555 N H1 C20 1.123960(20) . 1_555 N H1 H40 0.0273 . 1_555 N H1 H41 1.76834(4) . 1_555 N H1 H42 1.85194(4) . 1_555 N H2 C1 1.096970(20) . 1_555 N H2 H1 1.76522(4) . 1_555 N H2 H3 1.79306(4) . 1_555 N H2 C20 1.163790(20) . 1_555 N H2 H40 1.76628(4) . 1_555 N H2 H41 0.1729 . 1_555 N H2 H42 1.93690(4) . 1_555 N H3 C1 1.117270(30) . 1_555 N H3 H1 1.79778(4) . 1_555 N H3 H2 1.79306(4) . 1_555 N H3 C20 1.98976(6) . 1_555 N H3 H40 1.82091(4) . 1_555 N H3 H41 1.93690(4) . 1_555 N H4 C2 1.106550(20) . 1_555 N H4 C2 2.02527(4) . 2_665 N H4 C3 1.87479(4) . 2_665 N H4 C4 1.316120(30) . 3_565 N H4 N2 1.84555(4) . 2_665 N H4 N2 1.290020(30) . 3_565 N H4 H5 1.75500(4) . 1_555 N H4 H5 1.57614(4) . 2_665 N H4 H6 1.353060(30) . 2_665 N H4 H8 1.676410(30) . 3_565 N H4 H9 1.440860(30) . 3_565 N H4 C15 0.866050(20) . -203_444 N H4 C16 2.02141(5) . -202_344 N H4 C17 1.433410(30) . -202_344 N H4 C17 2.02136(4) . -203_444 N H4 C18 1.596240(30) . -201_454 N H4 C19 1.044270(20) . -201_454 N H4 C19 1.91619(4) . -202_344 N H4 N5 1.99971(4) . -202_344 N H4 N5 0.921870(20) . -203_444 N H4 H30 1.328000(20) . -203_444 N H4 H31 1.543390(30) . -203_444 N H4 H34 1.114080(20) . -202_344 N H4 H36 1.61291(4) . -201_454 N H4 H38 0.770230(20) . -201_454 N H4 H39 1.790230(30) . -201_454 N H4 H39 1.713340(30) . -202_344 N H5 C2 1.100580(20) . 1_555 N H5 C2 1.90120(4) . 3_565 N H5 C3 1.333460(30) . 2_665 N H5 C4 1.474310(30) . 3_565 N H5 N2 1.270690(30) . 2_665 N H5 N2 1.76511(4) . 3_565 N H5 H4 1.75500(4) . 1_555 N H5 H4 1.57614(4) . 3_565 N H5 H6 1.732950(30) . 2_665 N H5 H7 1.429040(30) . 2_665 N H5 H8 0.980060(20) . 3_565 N H5 C15 2.07314(4) . -202_344 N H5 C15 1.523450(30) . -203_444 N H5 C16 1.94892(4) . -202_344 N H5 C17 0.481080(10) . -202_344 N H5 C18 1.340460(30) . -201_454 N H5 C19 1.345310(30) . -201_454 N H5 C19 1.70197(4) . -203_444 N H5 N5 1.202190(20) . -202_344 N H5 N5 1.83122(4) . -203_444 N H5 H31 1.197430(30) . -203_444 N H5 H34 1.457800(30) . -202_344 N H5 H35 1.040250(20) . -202_344 N H5 H37 1.156540(30) . -201_454 N H5 H38 1.444400(30) . -203_444 N H5 H39 1.212430(30) . -201_454 N H6 C2 1.303370(30) . 3_565 N H6 C3 1.100220(20) . 1_555 N H6 C4 0.507670(10) . 2_665 N H6 C5 1.339320(30) . 3_565 N H6 C7 1.88734(4) . 2_665 N H6 N2 1.91947(4) . 2_665 N H6 H4 1.353060(30) . 3_565 N H6 H5 1.732950(30) . 3_565 N H6 H7 1.75502(4) . 1_555 N H6 H8 1.079430(20) . 2_665 N H6 H9 0.737550(20) . 2_665 N H6 H10 1.353350(30) . 3_565 N H6 H11 1.754980(30) . 3_565 N H6 C14 1.558390(30) . -202_344 N H6 C15 0.541250(10) . -202_344 N H6 C16 1.031720(20) . -201_454 N H6 C17 1.277120(20) . -201_454 N H6 C18 1.033660(20) . -203_444 N H6 C19 1.98285(4) . -203_444 N H6 H30 1.047630(20) . -202_344 N H6 H31 1.010500(20) . -202_344 N H6 H32 1.79033(4) . -201_454 N H6 H33 1.028140(20) . -201_454 N H6 H34 1.40578(4) . -201_454 N H6 H36 0.611920(10) . -203_444 N H6 H37 1.428490(30) . -203_444 N H7 C2 1.88559(4) . 3_565 N H7 C3 1.094050(20) . 1_555 N H7 C4 1.586940(30) . 2_665 N H7 C5 1.787500(30) . 3_565 N H7 C7 1.684790(30) . 2_665 N H7 H5 1.429040(30) . 3_565 N H7 H6 1.75502(4) . 1_555 N H7 H8 1.207590(20) . 2_665 N H7 H11 1.211690(30) . 3_565 N H7 H14 1.34504(4) . 2_665 N H7 C14 1.828920(30) . -202_344 N H7 C15 1.94815(4) . -202_344 N H7 C16 1.535690(30) . -201_454 N H7 C17 1.383620(30) . -201_454 N H7 C18 1.428220(30) . -203_444 N H7 H29 1.264250(30) . -202_344 N H7 H31 1.508830(30) . -202_344 N H7 H32 1.352300(30) . -201_454 N H7 H35 1.075470(30) . -201_454 N H7 H37 0.382970(10) . -203_444 N H8 C2 1.383600(30) . 2_665 N H8 C3 1.204210(20) . 3_565 N H8 C4 1.106700(20) . 1_555 N H8 C5 1.98087(4) . 2_665 N H8 N2 2.00677(5) . 3_565 N H8 H4 1.676410(30) . 2_665 N H8 H5 0.980060(20) . 2_665 N H8 H6 1.079430(20) . 3_565 N H8 H7 1.207590(20) . 3_565 N H8 H9 1.75997(4) . 1_555 N H8 H11 1.93421(5) . 2_665 N H8 C15 1.160420(30) . -201_454 N H8 C16 1.619110(30) . -203_444 N H8 C17 0.599180(10) . -203_444 N H8 C18 1.297050(20) . -202_344 N H8 C19 1.86352(4) . -202_344 N H8 H30 1.95902(4) . -201_454 N H8 H31 0.327060(10) . -201_454 N H8 H34 1.087110(20) . -203_444 N H8 H35 0.941730(20) . -203_444 N H8 H36 1.643160(30) . -202_344 N H8 H37 0.910940(20) . -202_344 N H8 H39 1.87081(4) . -202_344 N H9 C2 1.77576(4) . 2_665 N H9 C3 1.73728(4) . 3_565 N H9 C4 1.094650(20) . 1_555 N H9 C5 1.635340(30) . 2_665 N H9 H4 1.440860(30) . 2_665 N H9 H6 0.737550(20) . 3_565 N H9 H8 1.75997(4) . 1_555 N H9 H10 1.125160(30) . 2_665 N H9 C14 1.877870(30) . -201_454 N H9 C15 0.934180(20) . -201_454 N H9 C16 1.452060(30) . -203_444 N H9 C17 1.93619(4) . -203_444 N H9 C18 1.59962(4) . -202_344 N H9 H30 0.421600(10) . -201_454 N H9 H31 1.607300(30) . -201_454 N H9 H33 0.762310(20) . -203_444 N H9 H34 1.73952(4) . -203_444 N H9 H36 0.661990(10) . -202_344 N H10 C3 1.786200(30) . 2_665 N H10 C4 1.473240(30) . 3_565 N H10 C5 1.096450(20) . 1_555 N H10 C6 1.727470(30) . 2_665 N H10 C7 1.569290(30) . 3_565 N H10 H6 1.353350(30) . 2_665 N H10 H9 1.125160(30) . 3_565 N H10 H11 1.75481(4) . 1_555 N H10 H15 1.313570(30) . 3_565 N H10 H12 1.221520(30) . 2_665 N H10 C14 1.343030(30) . -203_444 N H10 C15 1.66245(4) . -203_444 N H10 C16 1.177160(20) . -202_344 N H10 C18 1.743310(30) . -201_454 N H10 H28 0.927060(20) . -203_444 N H10 H30 1.47557(4) . -203_444 N H10 H32 1.68474(4) . -202_344 N H10 H33 0.371250(10) . -202_344 N H10 H36 0.808560(20) . -201_454 N H11 C3 1.231150(30) . 2_665 N H11 C4 1.636860(30) . 3_565 N H11 C5 1.096950(20) . 1_555 N H11 C6 1.332040(30) . 2_665 N H11 C7 0.667730(10) . 3_565 N H11 H6 1.754980(30) . 2_665 N H11 H7 1.211690(30) . 2_665 N H11 H8 1.93421(5) . 3_565 N H11 H10 1.75481(4) . 1_555 N H11 H14 0.691950(10) . 3_565 N H11 H15 1.380330(20) . 3_565 N H11 H12 1.845970(30) . 2_665 N H11 H13 1.361890(30) . 2_665 N H11 C13 1.895370(30) . -201_454 N H11 C14 1.172070(30) . -203_444 N H11 C15 2.09901(4) . -203_444 N H11 C16 1.075780(20) . -202_344 N H11 C18 1.532130(30) . -201_454 N H11 N4 1.97683(4) . -201_454 N H11 H27 1.625160(30) . -201_454 N H11 H28 1.674610(30) . -203_444 N H11 H29 0.449200(10) . -203_444 N H11 H32 0.14957 . -202_344 N H11 H33 1.80696(4) . -202_344 N H11 H36 1.685930(30) . -201_454 N H11 H37 1.266840(30) . -201_454 N H14 C3 1.736740(30) . 3_565 N H14 C5 1.710350(30) . 2_665 N H14 C6 1.64215(4) . 3_565 N H14 C7 1.095850(20) . 1_555 N H14 H7 1.34504(4) . 3_565 N H14 H11 0.691950(10) . 2_665 N H14 H15 1.75974(4) . 1_555 N H14 H13 1.174440(20) . 3_565 N H14 C13 1.866100(30) . -202_344 N H14 C14 1.70939(4) . -201_454 N H14 C16 1.717100(30) . -203_444 N H14 C18 2.06844(4) . -202_344 N H14 H27 1.205060(20) . -202_344 N H14 H29 0.627960(10) . -201_454 N H14 H32 0.734490(20) . -203_444 N H14 H37 1.56630(4) . -202_344 N H15 C5 1.355180(30) . 2_665 N H15 C6 1.222780(30) . 3_565 N H15 C7 1.105990(20) . 1_555 N H15 C8 1.894100(30) . 2_665 N H15 N3 1.87497(4) . 2_665 N H15 H10 1.313570(30) . 2_665 N H15 H11 1.380330(20) . 2_665 N H15 H14 1.75974(4) . 1_555 N H15 H16 1.816070(30) . 2_665 N H15 H17 1.86187(4) . 2_665 N H15 H12 0.771290(20) . 3_565 N H15 H13 1.423190(30) . 3_565 N H15 C13 1.72027(4) . -202_344 N H15 C14 1.462660(30) . -201_454 N H15 C16 1.60748(4) . -203_444 N H15 H25 1.57751(4) . -203_444 N H15 H26 1.011090(20) . -202_344 N H15 H27 1.95221(4) . -202_344 N H15 H28 0.814980(20) . -201_454 N H15 H29 1.537670(30) . -201_454 N H15 H32 1.242920(20) . -203_444 N H15 H33 1.62538(4) . -203_444 N H15 H36 1.86969(5) . -202_344 N H16 C8 1.097180(20) . 1_555 N H16 C9 2.07443(4) . 3_565 N H16 H15 1.816070(30) . 3_565 N H16 H17 1.73944(4) . 1_555 N H16 H17 1.93175(4) . 2_665 N H16 H18 1.766100(30) . 3_565 N H16 H19 1.737730(30) . 3_565 N H16 H12 1.47383(4) . 2_665 N H16 H13 1.862130(30) . 3_565 N H16 C11 2.08561(4) . -202_344 N H16 C12 1.497020(30) . -202_344 N H16 C13 1.770760(30) . -202_344 N H16 H23 1.88410(4) . -202_344 N H16 H24 1.145310(20) . -203_444 N H16 H25 1.340510(30) . -202_344 N H16 H26 1.237620(20) . -201_454 N H16 H27 1.478470(30) . -202_344 N H16 H28 1.80639(5) . -203_444 N H17 C6 1.95212(5) . 2_665 N H17 C8 1.097800(20) . 1_555 N H17 C8 1.57924(4) . 3_565 N H17 C9 1.231900(20) . 3_565 N H17 H15 1.86187(4) . 3_565 N H17 H16 1.73944(4) . 1_555 N H17 H16 1.93175(4) . 3_565 N H17 H18 0.870350(20) . 3_565 N H17 H19 1.301520(20) . 2_665 N H17 H19 1.93347(4) . 3_565 N H17 H13 1.339350(30) . 2_665 N H17 C11 1.79809(4) . -201_454 N H17 C12 1.71771(4) . -201_454 N H17 C12 0.916170(20) . -202_344 N H17 C13 1.342080(30) . -201_454 N H17 H22 1.65903(4) . -201_454 N H17 H24 1.260990(30) . -202_344 N H17 H24 1.379070(30) . -203_444 N H17 H25 0.533270(10) . -202_344 N H17 H26 1.125400(20) . -201_454 N H17 H27 1.555350(30) . -201_454 N H18 C8 1.494020(30) . 2_665 N H18 C9 1.094230(20) . 1_555 N H18 C9 2.09932(5) . 2_665 N H18 C10 2.08693(5) . -203_444 N H18 H16 1.766100(30) . 2_665 N H18 H17 0.870350(20) . 2_665 N H18 H19 1.75256(4) . 1_555 N H18 H19 1.307770(30) . 3_565 N H18 H20 1.86838(5) . -203_444 N H18 H21 1.76930(4) . 2_665 N H18 C11 1.588960(30) . -202_344 N H18 C11 1.759600(30) . -203_444 N H18 C12 1.281340(20) . -203_444 N H18 H22 1.004540(20) . -202_344 N H18 H23 1.84265(4) . -202_344 N H18 H24 1.546850(30) . -201_454 N H18 H24 1.77646(4) . -203_444 N H18 H25 0.844870(20) . -203_444 N H18 H26 1.73836(4) . -202_344 N H19 C8 1.341370(30) . 2_665 N H19 C8 1.682620(30) . 3_565 N H19 C9 1.094860(20) . 1_555 N H19 C9 0.531510(10) . 2_665 N H19 C9 1.57142(4) . 3_565 N H19 C10 1.41692(4) . 2_665 N H19 C10 2.00056(4) . 3_565 N H19 C10 1.87165(5) . -201_454 N H19 C10 2.05829(4) . -203_444 N H19 H16 1.737730(30) . 2_665 N H19 H17 1.93347(4) . 2_665 N H19 H17 1.301520(20) . 3_565 N H19 H18 1.75256(4) . 1_555 N H19 H18 1.307770(30) . 2_665 N H19 H19 1.58361(4) . 2_665 N H19 H19 1.58361(4) . 3_565 N H19 H20 1.83546(4) . 2_665 N H19 H21 1.71172(4) . 3_565 N H19 H21 1.67495(4) . -201_454 N H19 C11 1.593150(30) . -201_454 N H19 C11 1.71469(4) . -202_344 N H19 C11 0.553410(10) . -203_444 N H19 C12 1.183210(20) . -201_454 N H19 C12 1.830560(30) . -202_344 N H19 C12 1.188020(20) . -203_444 N H19 C13 2.07277(6) . -203_444 N H19 H22 1.329780(20) . -202_344 N H19 H22 1.162630(20) . -203_444 N H19 H23 1.233320(20) . -203_444 N H19 H24 0.894810(20) . -201_454 N H19 H24 1.627800(30) . -202_344 N H19 H24 1.93893(4) . -203_444 N H19 H25 1.706930(30) . -201_454 N H20 C10 1.095320(20) . 1_555 N H20 C10 1.73352(4) . -202_344 N H20 C10 1.76261(4) . -203_444 N H20 H18 1.86838(5) . -202_344 N H20 H19 1.83546(4) . 3_565 N H20 H21 1.74977(4) . 1_555 N H20 H21 1.71166(4) . 2_665 N H20 H21 0.830170(20) . -203_444 N H20 C11 1.97441(4) . 3_565 N H20 C11 1.427810(30) . -202_344 N H20 H22 1.354040(30) . 3_565 N H20 H22 1.730830(30) . -201_454 N H20 H23 0.914860(20) . -202_344 N H21 C9 1.59055(4) . 3_565 N H21 C9 1.97217(4) . -201_454 N H21 C9 1.87354(4) . -202_344 N H21 C10 1.096870(20) . 1_555 N H21 C10 2.07072(5) . 2_665 N H21 C10 1.041000(20) . 3_565 N H21 C10 1.79430(4) . -201_454 N H21 C10 0.367080(10) . -202_344 N H21 C10 1.82729(4) . -203_444 N H21 H18 1.76930(4) . 3_565 N H21 H19 1.71172(4) . 2_665 N H21 H19 1.67495(4) . -201_454 N H21 H20 1.74977(4) . 1_555 N H21 H20 1.71166(4) . 3_565 N H21 H20 0.830170(20) . -202_344 N H21 H21 1.182020(30) . -202_344 N H21 H21 1.182020(30) . -203_444 N H21 C11 2.03291(4) . 2_665 N H21 C11 1.134430(30) . 3_565 N H21 C11 1.346060(20) . -201_454 N H21 C11 1.539580(30) . -202_344 N H21 H22 1.395010(30) . 2_665 N H21 H22 1.680170(30) . 3_565 N H21 H22 0.898870(20) . -201_454 N H21 H23 1.350560(30) . 3_565 N H21 H23 1.795360(30) . -201_454 N H12 C5 1.310770(30) . 3_565 N H12 C6 1.099370(20) . 1_555 N H12 C7 1.343700(30) . 2_665 N H12 C8 1.602980(30) . 3_565 N H12 N3 1.96496(4) . 2_665 N H12 N3 1.401730(30) . 3_565 N H12 H10 1.221520(30) . 3_565 N H12 H11 1.845970(30) . 3_565 N H12 H15 0.771290(20) . 2_665 N H12 H16 1.47383(4) . 3_565 N H12 H13 1.75579(4) . 1_555 N H12 H13 1.85661(4) . 2_665 N H12 C12 2.04470(4) . -201_454 N H12 C13 1.615900(30) . -201_454 N H12 C13 1.67974(4) . -203_444 N H12 C14 1.357690(30) . -202_344 N H12 C16 1.64128(4) . -201_454 N H12 N4 1.827540(30) . -201_454 N H12 H25 1.74048(4) . -201_454 N H12 H26 0.907610(20) . -203_444 N H12 H27 1.572130(30) . -201_454 N H12 H28 0.340660(10) . -202_344 N H12 H29 1.89909(4) . -202_344 N H12 H32 1.741780(30) . -201_454 N H12 H33 1.55591(4) . -201_454 N H12 H36 1.82272(5) . -203_444 N H13 C5 1.78797(4) . 3_565 N H13 C6 1.105830(20) . 1_555 N H13 C7 1.081170(20) . 2_665 N H13 C8 1.779980(30) . 2_665 N H13 C8 1.807110(30) . 3_565 N H13 N3 1.475720(30) . 2_665 N H13 N3 1.73106(4) . 3_565 N H13 H11 1.361890(30) . 3_565 N H13 H14 1.174440(20) . 2_665 N H13 H15 1.423190(30) . 2_665 N H13 H16 1.862130(30) . 2_665 N H13 H17 1.339350(30) . 3_565 N H13 H12 1.75579(4) . 1_555 N H13 H12 1.85661(4) . 3_565 N H13 C12 1.836100(30) . -201_454 N H13 C13 0.822880(20) . -203_444 N H13 C14 1.686980(30) . -202_344 N H13 C16 2.01209(5) . -201_454 N H13 N4 1.935200(30) . -203_444 N H13 H24 1.788430(30) . -201_454 N H13 H25 1.521320(30) . -201_454 N H13 H26 1.234100(30) . -203_444 N H13 H27 0.553760(10) . -203_444 N H13 H28 1.82280(4) . -202_344 N H13 H29 1.122090(30) . -202_344 N H13 H32 1.311200(30) . -201_454 N C11 C8 2.14502(4) . -201_454 N C11 C8 1.78896(5) . -203_444 N C11 C9 1.662720(30) . -201_454 N C11 C9 1.132810(20) . -202_344 N C11 C9 0.819480(10) . -203_444 N C11 C10 1.554060(30) . 1_555 N C11 C10 1.442940(30) . 2_665 N C11 C10 2.15116(4) . 3_565 N C11 C10 1.720970(30) . -201_454 N C11 C10 1.815150(30) . -202_344 N C11 C10 0.865630(20) . -203_444 N C11 H16 2.08561(4) . -203_444 N C11 H17 1.79809(4) . -201_454 N C11 H18 1.759600(30) . -202_344 N C11 H18 1.588960(30) . -203_444 N C11 H19 1.593150(30) . -201_454 N C11 H19 0.553410(10) . -202_344 N C11 H19 1.71469(4) . -203_444 N C11 H20 1.97441(4) . 2_665 N C11 H20 1.427810(30) . -203_444 N C11 H21 1.134430(30) . 2_665 N C11 H21 2.03291(4) . 3_565 N C11 H21 1.346060(20) . -201_454 N C11 H21 1.539580(30) . -203_444 N C11 C11 1.55194(4) . 2_665 N C11 C11 1.55194(4) . 3_565 N C11 C12 1.56218(4) . 1_555 N C11 C12 1.655660(30) . 2_665 N C11 C12 2.11644(4) . 3_565 N C11 H22 1.095580(20) . 1_555 N C11 H22 2.07590(5) . 2_665 N C11 H22 1.043970(20) . 3_565 N C11 H22 1.98082(5) . -202_344 N C11 H23 1.094690(20) . 1_555 N C11 H24 1.37871(4) . 2_665 N C11 H24 2.00518(4) . 3_565 N C12 C6 2.01554(5) . -201_454 N C12 C8 1.61005(4) . -201_454 N C12 C8 1.334360(30) . -202_344 N C12 C8 0.506080(10) . -203_444 N C12 N3 2.10536(4) . -201_454 N C12 N3 1.93911(5) . -202_344 N C12 N3 1.81894(5) . -203_444 N C12 C9 1.580670(30) . -201_454 N C12 C9 0.896120(20) . -202_344 N C12 C9 1.340030(20) . -203_444 N C12 H16 1.497020(30) . -203_444 N C12 H17 1.71771(4) . -201_454 N C12 H17 0.916170(20) . -203_444 N C12 H18 1.281340(20) . -202_344 N C12 H19 1.183210(20) . -201_454 N C12 H19 1.188020(20) . -202_344 N C12 H19 1.830560(30) . -203_444 N C12 H12 2.04470(4) . -201_454 N C12 H13 1.836100(30) . -201_454 N C12 C11 1.56218(4) . 1_555 N C12 C11 2.11644(4) . 2_665 N C12 C11 1.655660(30) . 3_565 N C12 C12 1.228380(30) . 2_665 N C12 C12 1.228380(30) . 3_565 N C12 C13 1.568990(30) . 1_555 N C12 C13 2.00792(4) . 2_665 N C12 C13 1.373660(30) . 3_565 N C12 H22 1.55902(4) . 3_565 N C12 H24 1.093840(20) . 1_555 N C12 H24 0.588760(10) . 2_665 N C12 H24 1.62481(4) . 3_565 N C12 H25 1.094960(20) . 1_555 N C12 H26 1.229750(20) . 3_565 N C12 H27 2.09278(4) . 3_565 N C13 C5 1.86556(4) . -201_454 N C13 C6 1.583790(30) . -201_454 N C13 C6 0.938750(20) . -202_344 N C13 C6 2.06070(4) . -203_444 N C13 C7 2.23925(4) . -202_344 N C13 C7 1.364500(30) . -203_444 N C13 C8 1.340260(20) . -201_454 N C13 C8 2.06696(4) . -202_344 N C13 C8 1.237890(20) . -203_444 N C13 N3 1.100060(20) . -201_454 N C13 N3 1.451970(30) . -202_344 N C13 N3 0.826190(10) . -203_444 N C13 C9 2.08967(6) . -203_444 N C13 H11 1.895370(30) . -201_454 N C13 H14 1.866100(30) . -203_444 N C13 H15 1.72027(4) . -203_444 N C13 H16 1.770760(30) . -203_444 N C13 H17 1.342080(30) . -201_454 N C13 H19 2.07277(6) . -202_344 N C13 H12 1.615900(30) . -201_454 N C13 H12 1.67974(4) . -202_344 N C13 H13 0.822880(20) . -202_344 N C13 C12 1.568990(30) . 1_555 N C13 C12 1.373660(30) . 2_665 N C13 C12 2.00792(4) . 3_565 N C13 C13 1.56544(4) . 2_665 N C13 C13 1.56544(4) . 3_565 N C13 C14 2.07242(4) . 2_665 N C13 C14 1.67669(4) . 3_565 N C13 C16 2.15896(5) . 2_665 N C13 N4 1.53678(4) . 1_555 N C13 N4 1.710830(30) . 2_665 N C13 N4 1.828380(30) . 3_565 N C13 H24 1.366320(30) . 2_665 N C13 H24 1.745000(30) . 3_565 N C13 H25 1.585060(30) . 2_665 N C13 H26 1.098350(20) . 1_555 N C13 H26 1.501840(30) . 3_565 N C13 H27 1.096700(20) . 1_555 N C13 H28 1.771810(30) . 2_665 N C13 H28 1.791330(30) . 3_565 N C13 H29 1.585770(30) . 3_565 N C13 H32 1.859980(30) . 2_665 N C14 C2 1.67313(5) . -202_344 N C14 C3 0.990990(20) . -203_444 N C14 C4 1.238260(30) . -201_454 N C14 C5 0.285270(10) . -202_344 N C14 C6 2.06907(4) . -201_454 N C14 C6 2.18507(4) . -202_344 N C14 C6 0.769740(20) . -203_444 N C14 C7 0.706240(10) . -201_454 N C14 N2 2.00815(4) . -201_454 N C14 N2 2.09094(4) . -203_444 N C14 N3 1.530410(30) . -201_454 N C14 N3 1.344750(20) . -202_344 N C14 N3 1.92521(4) . -203_444 N C14 H6 1.558380(30) . -203_444 N C14 H7 1.828920(30) . -203_444 N C14 H9 1.877870(30) . -201_454 N C14 H10 1.343030(30) . -202_344 N C14 H11 1.172070(30) . -202_344 N C14 H14 1.70939(4) . -201_454 N C14 H15 1.462660(30) . -201_454 N C14 H12 1.357690(30) . -203_444 N C14 H13 1.686980(30) . -203_444 N C14 C13 1.67669(4) . 2_665 N C14 C13 2.07242(4) . 3_565 N C14 C14 2.12584(5) . 2_665 N C14 C14 2.12584(5) . 3_565 N C14 C15 1.66392(4) . 1_555 N C14 C16 0.547800(10) . 3_565 N C14 C17 2.08594(5) . 3_565 N C14 C18 1.011580(30) . 2_665 N C14 N4 1.545060(30) . 1_555 N C14 N4 1.120790(30) . 2_665 N C14 N4 1.096880(20) . 3_565 N C14 H26 1.77429(5) . 2_665 N C14 H27 2.08049(4) . 2_665 N C14 H28 1.108490(20) . 1_555 N C14 H29 1.098160(20) . 1_555 N C14 H32 1.184370(30) . 3_565 N C14 H33 1.385120(30) . 3_565 N C14 H36 1.217530(20) . 2_665 N C14 H37 1.654070(30) . 2_665 N C15 C2 0.879090(20) . -202_344 N C15 C3 1.137120(20) . -203_444 N C15 C4 0.482970(10) . -201_454 N C15 C5 1.51118(4) . -202_344 N C15 C7 2.13784(5) . -201_454 N C15 N2 1.432610(30) . -201_454 N C15 N2 1.78583(4) . -203_444 N C15 H4 0.866050(20) . -202_344 N C15 H5 1.523450(30) . -202_344 N C15 H5 2.07314(4) . -203_444 N C15 H6 0.541250(10) . -203_444 N C15 H7 1.94815(4) . -203_444 N C15 H8 1.160420(30) . -201_454 N C15 H9 0.934180(20) . -201_454 N C15 H10 1.66245(4) . -202_344 N C15 H11 2.09901(4) . -202_344 N C15 C14 1.66392(4) . 1_555 N C15 C16 1.210910(30) . 3_565 N C15 C17 1.098340(20) . 3_565 N C15 C18 0.920990(20) . 2_665 N C15 C19 1.474180(30) . 2_665 N C15 N5 1.537760(30) . 1_555 N C15 N5 2.15985(4) . 3_565 N C15 H30 1.095410(20) . 1_555 N C15 H31 1.098570(20) . 1_555 N C15 H33 1.326900(30) . 3_565 N C15 H34 1.223300(30) . 3_565 N C15 H35 2.04935(5) . 3_565 N C15 H36 0.857780(20) . 2_665 N C15 H37 1.576440(30) . 2_665 N C15 H38 1.633580(30) . 2_665 N C16 C2 1.400400(30) . -203_444 N C16 C3 0.655020(10) . -201_454 N C16 C4 0.757930(20) . -202_344 N C16 C5 0.363950(10) . -203_444 N C16 C6 1.264840(30) . -201_454 N C16 C7 0.933380(20) . -202_344 N C16 N2 2.00359(4) . -201_454 N C16 N2 1.903430(30) . -202_344 N C16 N3 2.05150(4) . -202_344 N C16 N3 1.885510(30) . -203_444 N C16 H4 2.02141(5) . -203_444 N C16 H5 1.94892(4) . -203_444 N C16 H6 1.031720(20) . -201_454 N C16 H7 1.535690(30) . -201_454 N C16 H8 1.619110(30) . -202_344 N C16 H9 1.452060(30) . -202_344 N C16 H10 1.177160(20) . -203_444 N C16 H11 1.075780(20) . -203_444 N C16 H14 1.717100(30) . -202_344 N C16 H15 1.60748(4) . -202_344 N C16 H12 1.64128(4) . -201_454 N C16 H13 2.01209(5) . -201_454 N C16 C13 2.15896(5) . 3_565 N C16 C14 0.547800(10) . 2_665 N C16 C15 1.210910(30) . 2_665 N C16 C17 1.66337(4) . 1_555 N C16 C18 0.701080(10) . 3_565 N C16 N4 1.545760(30) . 1_555 N C16 N4 1.97977(4) . 2_665 N C16 N4 1.558290(30) . 3_565 N C16 H28 1.336370(30) . 2_665 N C16 H29 1.170770(20) . 2_665 N C16 H30 1.837380(30) . 2_665 N C16 H31 1.74788(4) . 2_665 N C16 H32 1.107970(20) . 1_555 N C16 H33 1.095810(20) . 1_555 N C16 H36 0.806300(20) . 3_565 N C16 H37 1.299430(20) . 3_565 N C17 C2 2.18009(5) . -202_344 N C17 C2 0.938520(20) . -203_444 N C17 C3 1.128860(30) . -201_454 N C17 C4 1.090000(20) . -202_344 N C17 C5 2.01360(5) . -203_444 N C17 N2 1.450680(30) . -201_454 N C17 N2 1.69586(4) . -202_344 N C17 H4 2.02136(4) . -202_344 N C17 H4 1.433410(30) . -203_444 N C17 H5 0.481080(10) . -203_444 N C17 H6 1.277120(20) . -201_454 N C17 H7 1.383620(30) . -201_454 N C17 H8 0.599180(10) . -202_344 N C17 H9 1.93619(4) . -202_344 N C17 C14 2.08594(5) . 2_665 N C17 C15 1.098340(20) . 2_665 N C17 C16 1.66337(4) . 1_555 N C17 C18 1.112470(20) . 3_565 N C17 C19 1.99057(4) . 2_665 N C17 C19 1.332940(30) . 3_565 N C17 N5 1.525230(30) . 1_555 N C17 N5 1.73553(4) . 2_665 N C17 H30 2.09846(5) . 2_665 N C17 H31 0.774560(20) . 2_665 N C17 H34 1.107210(20) . 1_555 N C17 H35 1.094380(20) . 1_555 N C17 H36 1.762840(30) . 3_565 N C17 H37 1.042730(20) . 3_565 N C17 H38 1.874960(30) . 2_665 N C17 H38 1.97952(4) . 3_565 N C17 H39 1.405100(30) . 3_565 N C18 C2 0.740440(20) . -201_454 N C18 C2 2.12796(4) . -202_344 N C18 C2 2.01102(4) . -203_444 N C18 C3 0.360830(10) . -202_344 N C18 C4 0.537650(10) . -203_444 N C18 C5 0.986650(20) . -201_454 N C18 C6 1.74765(5) . -202_344 N C18 C7 1.47940(4) . -203_444 N C18 N2 1.97220(4) . -201_454 N C18 N2 1.343970(20) . -202_344 N C18 N2 1.353640(20) . -203_444 N C18 H4 1.596240(30) . -201_454 N C18 H5 1.340460(30) . -201_454 N C18 H6 1.033660(20) . -202_344 N C18 H7 1.428220(30) . -202_344 N C18 H8 1.297050(20) . -203_444 N C18 H9 1.59962(4) . -203_444 N C18 H10 1.743310(30) . -201_454 N C18 H11 1.532130(30) . -201_454 N C18 H14 2.06844(4) . -203_444 N C18 C14 1.011580(30) . 3_565 N C18 C15 0.920990(20) . 3_565 N C18 C16 0.701080(10) . 2_665 N C18 C17 1.112470(20) . 2_665 N C18 C18 2.22037(5) . 2_665 N C18 C18 2.22037(5) . 3_565 N C18 C19 1.66595(4) . 1_555 N C18 C19 2.21939(4) . 3_565 N C18 N4 1.564520(30) . 1_555 N C18 N4 1.617120(30) . 2_665 N C18 N4 1.932010(30) . 3_565 N C18 N5 1.95084(4) . 2_665 N C18 N5 1.85808(4) . 3_565 N C18 H28 1.97396(4) . 3_565 N C18 H29 1.536340(30) . 3_565 N C18 H30 1.89348(4) . 3_565 N C18 H31 1.462070(30) . 3_565 N C18 H32 1.617290(30) . 2_665 N C18 H33 1.551800(30) . 2_665 N C18 H34 1.88833(4) . 2_665 N C18 H35 1.89760(4) . 2_665 N C18 H36 1.098010(20) . 1_555 N C18 H37 1.096300(20) . 1_555 N C19 C2 0.928420(20) . -201_454 N C19 C2 1.637420(30) . -202_344 N C19 C2 1.752620(30) . -203_444 N C19 C3 1.92991(4) . -202_344 N C19 C4 1.708640(30) . -203_444 N C19 N2 1.450270(30) . -201_454 N C19 N2 1.090940(20) . -202_344 N C19 N2 0.920590(20) . -203_444 N C19 H4 1.044270(20) . -201_454 N C19 H4 1.91619(4) . -203_444 N C19 H5 1.345310(30) . -201_454 N C19 H5 1.70197(4) . -202_344 N C19 H6 1.98285(4) . -202_344 N C19 H8 1.86352(4) . -203_444 N C19 C15 1.474180(30) . 3_565 N C19 C17 1.332940(30) . 2_665 N C19 C17 1.99057(4) . 3_565 N C19 C18 1.66595(4) . 1_555 N C19 C18 2.21939(4) . 2_665 N C19 C19 1.205800(30) . 2_665 N C19 C19 1.205800(30) . 3_565 N C19 N5 1.519240(30) . 1_555 N C19 N5 1.013590(20) . 2_665 N C19 N5 0.532130(10) . 3_565 N C19 H31 1.88175(4) . 3_565 N C19 H34 1.55392(4) . 2_665 N C19 H38 1.099390(20) . 1_555 N C19 H38 1.68875(4) . 3_565 N C19 H39 1.106850(20) . 1_555 N C19 H39 1.455030(30) . 2_665 N C19 H39 2.04206(4) . 3_565 N N4 C2 1.95461(5) . -201_454 N N4 C2 2.17902(4) . -202_344 N N4 C2 1.95690(5) . -203_444 N N4 C3 1.746830(30) . -201_454 N N4 C3 1.608000(30) . -202_344 N N4 C3 2.04693(4) . -203_444 N N4 C4 1.977730(30) . -202_344 N N4 C4 2.01845(4) . -203_444 N N4 C5 1.401840(30) . -201_454 N N4 C5 1.81203(4) . -202_344 N N4 C5 1.342650(30) . -203_444 N N4 C6 1.171200(20) . -201_454 N N4 C6 1.136440(20) . -202_344 N N4 C6 1.530990(30) . -203_444 N N4 C7 1.96502(4) . -201_454 N N4 C7 1.602610(30) . -202_344 N N4 C7 1.470550(30) . -203_444 N N4 N2 2.00265(5) . -201_454 N N4 N2 1.86374(5) . -202_344 N N4 N2 1.98663(5) . -203_444 N N4 N3 1.054920(20) . -201_454 N N4 N3 1.109260(20) . -202_344 N N4 N3 0.865530(20) . -203_444 N N4 H11 1.97683(4) . -201_454 N N4 H12 1.827540(30) . -201_454 N N4 H13 1.935200(30) . -202_344 N N4 C13 1.53678(4) . 1_555 N N4 C13 1.828380(30) . 2_665 N N4 C13 1.710830(30) . 3_565 N N4 C14 1.545060(30) . 1_555 N N4 C14 1.096880(20) . 2_665 N N4 C14 1.120790(30) . 3_565 N N4 C16 1.545760(30) . 1_555 N N4 C16 1.558290(30) . 2_665 N N4 C16 1.97977(4) . 3_565 N N4 C18 1.564520(30) . 1_555 N N4 C18 1.932010(30) . 2_665 N N4 C18 1.617120(30) . 3_565 N N4 N4 0.544950(10) . 2_665 N N4 N4 0.544950(10) . 3_565 N N4 H28 1.695110(30) . 2_665 N N4 H28 1.93405(4) . 3_565 N N4 H29 1.93532(4) . 2_665 N N4 H29 1.65880(4) . 3_565 N N4 H32 2.02524(5) . 2_665 N N4 H36 2.03226(4) . 3_565 N N5 C2 2.01487(4) . -201_454 N N5 C2 1.151610(20) . -202_344 N N5 C2 1.383240(20) . -203_444 N N5 C3 2.09882(4) . -201_454 N N5 C3 2.17402(4) . -203_444 N N5 C4 1.838610(30) . -201_454 N N5 N2 0.836570(20) . -201_454 N N5 N2 1.465260(30) . -202_344 N N5 N2 1.407630(30) . -203_444 N N5 H4 0.921870(20) . -202_344 N N5 H4 1.99971(4) . -203_444 N N5 H5 1.83122(4) . -202_344 N N5 H5 1.202190(20) . -203_444 N N5 C15 1.537760(30) . 1_555 N N5 C15 2.15985(4) . 2_665 N N5 C17 1.525230(30) . 1_555 N N5 C17 1.73553(4) . 3_565 N N5 C18 1.85808(4) . 2_665 N N5 C18 1.95084(4) . 3_565 N N5 C19 1.519240(30) . 1_555 N N5 C19 0.532130(10) . 2_665 N N5 C19 1.013590(20) . 3_565 N N5 N5 1.471250(30) . 2_665 N N5 N5 1.471250(30) . 3_565 N N5 H34 1.76076(4) . 3_565 N N5 H38 0.797560(10) . 2_665 N N5 H39 1.560110(30) . 2_665 N N5 H39 1.040290(20) . 3_565 N H22 C8 1.88698(5) . -201_454 N H22 C9 1.614890(30) . -201_454 N H22 C9 1.86908(4) . -202_344 N H22 C9 0.850690(20) . -203_444 N H22 C10 1.148560(30) . 2_665 N H22 C10 2.03956(4) . 3_565 N H22 C10 1.202580(20) . -201_454 N H22 C10 1.411670(30) . -203_444 N H22 H17 1.65903(4) . -201_454 N H22 H18 1.004540(20) . -203_444 N H22 H19 1.162620(20) . -202_344 N H22 H19 1.329780(20) . -203_444 N H22 H20 1.354040(30) . 2_665 N H22 H20 1.730830(30) . -201_454 N H22 H21 1.680170(30) . 2_665 N H22 H21 1.395010(30) . 3_565 N H22 H21 0.898870(20) . -201_454 N H22 C11 1.095580(20) . 1_555 N H22 C11 1.043970(20) . 2_665 N H22 C11 2.07590(5) . 3_565 N H22 C11 1.98082(5) . -203_444 N H22 C12 1.55902(4) . 2_665 N H22 H23 1.75161(4) . 1_555 N H22 H23 1.71607(4) . 2_665 N H22 H24 1.68187(4) . 3_565 N H22 H25 1.73904(4) . 2_665 N H23 C9 2.04250(4) . -202_344 N H23 C9 1.656710(30) . -203_444 N H23 C10 1.98191(4) . 2_665 N H23 C10 1.381230(20) . -203_444 N H23 H16 1.88410(4) . -203_444 N H23 H18 1.84265(4) . -203_444 N H23 H19 1.233320(20) . -202_344 N H23 H20 0.914860(20) . -203_444 N H23 H21 1.350560(30) . 2_665 N H23 H21 1.795360(30) . -201_454 N H23 C11 1.094690(20) . 1_555 N H23 H22 1.75161(4) . 1_555 N H23 H22 1.71607(4) . 3_565 N H23 H24 1.782570(30) . 2_665 N H24 C8 1.81975(4) . -201_454 N H24 C8 0.466940(10) . -202_344 N H24 C8 1.519990(30) . -203_444 N H24 N3 1.85351(5) . -202_344 N H24 C9 1.204650(20) . -201_454 N H24 C9 1.156680(20) . -202_344 N H24 C9 1.831860(30) . -203_444 N H24 H16 1.145310(20) . -202_344 N H24 H17 1.379070(30) . -202_344 N H24 H17 1.260990(30) . -203_444 N H24 H18 1.546850(30) . -201_454 N H24 H18 1.77646(4) . -202_344 N H24 H19 0.894810(20) . -201_454 N H24 H19 1.93893(4) . -202_344 N H24 H19 1.627800(30) . -203_444 N H24 H13 1.788430(30) . -201_454 N H24 C11 2.00518(4) . 2_665 N H24 C11 1.37871(4) . 3_565 N H24 C12 1.093840(20) . 1_555 N H24 C12 1.62481(4) . 2_665 N H24 C12 0.588760(10) . 3_565 N H24 C13 1.745000(30) . 2_665 N H24 C13 1.366320(30) . 3_565 N H24 H22 1.68187(4) . 2_665 N H24 H23 1.782570(30) . 3_565 N H24 H24 1.63481(4) . 2_665 N H24 H24 1.63481(4) . 3_565 N H24 H25 1.74954(4) . 1_555 N H24 H25 1.351600(30) . 3_565 N H24 H26 1.344030(20) . 2_665 N H24 H26 1.92280(4) . 3_565 N H24 H27 1.739170(30) . 3_565 N H25 C6 1.95905(5) . -201_454 N H25 C8 2.04327(5) . -202_344 N H25 C8 1.064710(20) . -203_444 N H25 C9 1.499190(30) . -202_344 N H25 H15 1.57751(4) . -202_344 N H25 H16 1.340510(30) . -203_444 N H25 H17 0.533270(10) . -203_444 N H25 H18 0.844870(20) . -202_344 N H25 H19 1.706930(30) . -201_454 N H25 H12 1.74048(4) . -201_454 N H25 H13 1.521320(30) . -201_454 N H25 C12 1.094960(20) . 1_555 N H25 C13 1.585060(30) . 3_565 N H25 H22 1.73904(4) . 3_565 N H25 H24 1.74954(4) . 1_555 N H25 H24 1.351600(30) . 2_665 N H25 H26 0.935550(20) . 3_565 N H25 H27 1.861660(30) . 3_565 N H26 C5 1.82600(5) . -201_454 N H26 C6 1.126340(30) . -202_344 N H26 C7 1.475040(30) . -203_444 N H26 C8 0.896040(20) . -201_454 N H26 C8 2.01582(4) . -203_444 N H26 N3 1.370850(20) . -201_454 N H26 N3 2.05090(4) . -202_344 N H26 N3 1.696190(30) . -203_444 N H26 C9 2.02473(5) . -203_444 N H26 H15 1.011090(20) . -203_444 N H26 H16 1.237620(20) . -201_454 N H26 H17 1.125400(20) . -201_454 N H26 H18 1.73836(4) . -203_444 N H26 H12 0.907610(20) . -202_344 N H26 H13 1.234100(30) . -202_344 N H26 C12 1.229750(20) . 2_665 N H26 C13 1.098350(20) . 1_555 N H26 C13 1.501840(30) . 2_665 N H26 C14 1.77429(5) . 3_565 N H26 H24 1.92280(4) . 2_665 N H26 H24 1.344030(20) . 3_565 N H26 H25 0.935550(20) . 2_665 N H26 H27 1.74139(4) . 1_555 N H26 H27 1.84395(4) . 2_665 N H26 H28 1.179790(30) . 3_565 N H26 H29 1.91257(4) . 3_565 N H26 H32 1.88176(4) . 2_665 N H27 C6 1.555700(30) . -202_344 N H27 C7 1.484050(30) . -203_444 N H27 C8 1.706880(30) . -203_444 N H27 N3 1.657770(30) . -203_444 N H27 H11 1.625160(30) . -201_454 N H27 H14 1.205060(20) . -203_444 N H27 H15 1.95221(4) . -203_444 N H27 H16 1.478470(30) . -203_444 N H27 H17 1.555350(30) . -201_454 N H27 H12 1.572130(30) . -201_454 N H27 H13 0.553760(10) . -202_344 N H27 C12 2.09278(4) . 2_665 N H27 C13 1.096700(20) . 1_555 N H27 C14 2.08049(4) . 3_565 N H27 H24 1.739170(30) . 2_665 N H27 H25 1.861660(30) . 2_665 N H27 H26 1.74139(4) . 1_555 N H27 H26 1.84395(4) . 3_565 N H27 H28 1.737660(30) . 2_665 N H27 H29 1.325650(30) . 3_565 N H27 H32 1.610380(30) . 2_665 N H28 C3 1.97463(4) . -203_444 N H28 C4 1.95238(5) . -201_454 N H28 C5 1.022170(20) . -202_344 N H28 C6 1.047320(20) . -203_444 N H28 C7 1.198330(30) . -201_454 N H28 C8 1.90269(4) . -202_344 N H28 N3 1.97938(4) . -201_454 N H28 N3 1.437260(30) . -202_344 N H28 H10 0.927060(20) . -202_344 N H28 H11 1.674610(30) . -202_344 N H28 H15 0.814980(20) . -201_454 N H28 H16 1.80639(5) . -202_344 N H28 H12 0.340660(10) . -203_444 N H28 H13 1.82280(4) . -203_444 N H28 C13 1.791330(30) . 2_665 N H28 C13 1.771810(30) . 3_565 N H28 C14 1.108490(20) . 1_555 N H28 C16 1.336370(30) . 3_565 N H28 C18 1.97396(4) . 2_665 N H28 N4 1.93405(4) . 2_665 N H28 N4 1.695110(30) . 3_565 N H28 H26 1.179790(30) . 2_665 N H28 H27 1.737660(30) . 3_565 N H28 H29 1.75721(4) . 1_555 N H28 H32 1.582580(30) . 3_565 N H28 H33 1.239360(30) . 3_565 N H28 H36 1.48407(4) . 2_665 N H29 C3 1.243090(30) . -203_444 N H29 C4 1.77875(4) . -201_454 N H29 C5 1.136470(20) . -202_344 N H29 C6 1.131500(20) . -203_444 N H29 C7 0.569080(10) . -201_454 N H29 N3 1.748140(30) . -201_454 N H29 N3 1.96041(4) . -202_344 N H29 H7 1.264250(30) . -203_444 N H29 H11 0.449200(10) . -202_344 N H29 H14 0.627960(10) . -201_454 N H29 H15 1.537670(30) . -201_454 N H29 H12 1.89909(4) . -203_444 N H29 H13 1.122090(30) . -203_444 N H29 C13 1.585770(30) . 2_665 N H29 C14 1.098160(20) . 1_555 N H29 C16 1.170770(20) . 3_565 N H29 C18 1.536340(30) . 2_665 N H29 N4 1.65880(4) . 2_665 N H29 N4 1.93532(4) . 3_565 N H29 H26 1.91257(4) . 2_665 N H29 H27 1.325650(30) . 2_665 N H29 H28 1.75721(4) . 1_555 N H29 H32 0.529130(10) . 3_565 N H29 H36 1.907500(30) . 2_665 N H29 H37 1.34185(4) . 2_665 N H30 C2 1.92437(4) . -202_344 N H30 C3 2.06878(4) . -203_444 N H30 C4 1.389110(30) . -201_454 N H30 C5 2.02247(4) . -202_344 N H30 H4 1.328000(20) . -202_344 N H30 H6 1.047630(20) . -203_444 N H30 H8 1.95902(4) . -201_454 N H30 H9 0.421600(10) . -201_454 N H30 H10 1.47557(4) . -202_344 N H30 C15 1.095410(20) . 1_555 N H30 C16 1.837380(30) . 3_565 N H30 C17 2.09846(5) . 3_565 N H30 C18 1.89348(4) . 2_665 N H30 H31 1.75683(4) . 1_555 N H30 H33 1.130860(30) . 3_565 N H30 H34 1.689010(30) . 3_565 N H30 H36 1.052940(20) . 2_665 N H30 H38 1.92555(4) . 2_665 N H31 C2 1.484070(30) . -202_344 N H31 C3 1.419750(30) . -203_444 N H31 C4 1.161150(20) . -201_454 N H31 H4 1.543390(30) . -202_344 N H31 H5 1.197430(30) . -202_344 N H31 H6 1.010500(20) . -203_444 N H31 H7 1.508830(30) . -203_444 N H31 H8 0.327060(10) . -201_454 N H31 H9 1.607300(30) . -201_454 N H31 C15 1.098570(20) . 1_555 N H31 C16 1.74788(4) . 3_565 N H31 C17 0.774560(20) . 3_565 N H31 C18 1.462070(30) . 2_665 N H31 C19 1.88175(4) . 2_665 N H31 H30 1.75683(4) . 1_555 N H31 H34 0.841800(20) . 3_565 N H31 H35 1.178250(30) . 3_565 N H31 H36 1.615460(30) . 2_665 N H31 H37 1.217010(20) . 2_665 N H31 H39 1.901130(30) . 2_665 N H32 C3 1.332940(30) . -201_454 N H32 C4 1.69624(4) . -202_344 N H32 C5 1.095240(20) . -203_444 N H32 C6 1.298120(30) . -201_454 N H32 C7 0.640150(10) . -202_344 N H32 H6 1.79033(4) . -201_454 N H32 H7 1.352300(30) . -201_454 N H32 H10 1.68474(4) . -203_444 N H32 H11 0.14957 . -203_444 N H32 H14 0.734500(20) . -202_344 N H32 H15 1.242920(20) . -202_344 N H32 H12 1.741780(30) . -201_454 N H32 H13 1.311200(30) . -201_454 N H32 C13 1.859980(30) . 3_565 N H32 C14 1.184370(30) . 2_665 N H32 C16 1.107970(20) . 1_555 N H32 C18 1.617290(30) . 3_565 N H32 N4 2.02524(5) . 3_565 N H32 H26 1.88176(4) . 3_565 N H32 H27 1.610380(30) . 3_565 N H32 H28 1.582580(30) . 2_665 N H32 H29 0.529130(10) . 2_665 N H32 H33 1.762880(30) . 1_555 N H32 H36 1.683520(30) . 3_565 N H32 H37 1.401180(30) . 3_565 N H33 C2 1.98243(4) . -203_444 N H33 C3 1.628360(30) . -201_454 N H33 C4 1.200830(20) . -202_344 N H33 C5 1.125260(20) . -203_444 N H33 C6 1.908560(30) . -201_454 N H33 C7 1.694620(30) . -202_344 N H33 H6 1.028140(20) . -201_454 N H33 H9 0.762310(20) . -202_344 N H33 H10 0.371250(10) . -203_444 N H33 H11 1.80696(4) . -203_444 N H33 H15 1.62538(4) . -202_344 N H33 H12 1.55591(4) . -201_454 N H33 C14 1.385120(30) . 2_665 N H33 C15 1.326900(30) . 2_665 N H33 C16 1.095810(20) . 1_555 N H33 C18 1.551800(30) . 3_565 N H33 H28 1.239360(30) . 2_665 N H33 H30 1.130860(30) . 2_665 N H33 H32 1.762880(30) . 1_555 N H33 H36 0.499670(10) . 3_565 N H34 C2 1.576900(30) . -203_444 N H34 C3 1.98872(4) . -201_454 N H34 C4 1.55530(4) . -202_344 N H34 H4 1.114080(20) . -203_444 N H34 H5 1.457790(30) . -203_444 N H34 H6 1.40578(4) . -201_454 N H34 H8 1.087110(20) . -202_344 N H34 H9 1.73952(4) . -202_344 N H34 C15 1.223300(30) . 2_665 N H34 C17 1.107210(20) . 1_555 N H34 C18 1.88833(4) . 3_565 N H34 C19 1.55392(4) . 3_565 N H34 N5 1.76076(4) . 2_665 N H34 H30 1.689010(30) . 2_665 N H34 H31 0.841800(20) . 2_665 N H34 H35 1.760020(30) . 1_555 N H34 H38 1.509740(30) . 3_565 N H34 H39 1.544840(30) . 3_565 N H35 C2 1.97646(4) . -203_444 N H35 C3 1.705190(30) . -201_454 N H35 C4 1.91787(4) . -202_344 N H35 H5 1.040250(20) . -203_444 N H35 H7 1.075470(30) . -201_454 N H35 H8 0.941730(20) . -202_344 N H35 C15 2.04935(5) . 2_665 N H35 C17 1.094380(20) . 1_555 N H35 C18 1.89760(4) . 3_565 N H35 H31 1.178250(30) . 2_665 N H35 H34 1.760020(30) . 1_555 N H35 H37 1.031550(20) . 3_565 N H35 H39 1.943620(30) . 3_565 N H36 C2 1.497220(30) . -201_454 N H36 C3 1.209990(30) . -202_344 N H36 C4 0.705910(10) . -203_444 N H36 C5 0.975200(20) . -201_454 N H36 C6 1.88845(4) . -202_344 N H36 C7 1.622640(30) . -203_444 N H36 N2 1.93755(4) . -203_444 N H36 H4 1.61291(4) . -201_454 N H36 H6 0.611920(10) . -202_344 N H36 H8 1.643160(30) . -203_444 N H36 H9 0.661990(10) . -203_444 N H36 H10 0.808560(20) . -201_454 N H36 H11 1.685930(30) . -201_454 N H36 H15 1.86969(5) . -203_444 N H36 H12 1.82272(5) . -202_344 N H36 C14 1.217530(20) . 3_565 N H36 C15 0.857780(20) . 3_565 N H36 C16 0.806300(20) . 2_665 N H36 C17 1.762840(30) . 2_665 N H36 C18 1.098010(20) . 1_555 N H36 N4 2.03226(4) . 2_665 N H36 H28 1.48407(4) . 3_565 N H36 H29 1.907500(30) . 3_565 N H36 H30 1.052940(20) . 3_565 N H36 H31 1.615460(30) . 3_565 N H36 H32 1.683520(30) . 2_665 N H36 H33 0.499670(10) . 2_665 N H36 H37 1.75492(4) . 1_555 N H37 C2 1.522010(30) . -201_454 N H37 C3 0.791970(20) . -202_344 N H37 C4 1.232520(30) . -203_444 N H37 C5 1.596540(30) . -201_454 N H37 C7 1.65412(4) . -203_444 N H37 N2 1.90137(4) . -202_344 N H37 H5 1.156540(30) . -201_454 N H37 H6 1.428490(30) . -202_344 N H37 H7 0.382970(10) . -202_344 N H37 H8 0.910940(20) . -203_444 N H37 H11 1.266840(30) . -201_454 N H37 H14 1.56630(4) . -203_444 N H37 C14 1.654070(30) . 3_565 N H37 C15 1.576440(30) . 3_565 N H37 C16 1.299430(20) . 2_665 N H37 C17 1.042730(20) . 2_665 N H37 C18 1.096300(20) . 1_555 N H37 H29 1.34185(4) . 3_565 N H37 H31 1.217010(20) . 3_565 N H37 H32 1.401180(30) . 2_665 N H37 H35 1.031550(20) . 2_665 N H37 H36 1.75492(4) . 1_555 N H38 C2 1.652150(30) . -201_454 N H38 C2 2.05862(4) . -202_344 N H38 C4 2.06808(4) . -203_444 N H38 N2 1.548680(30) . -203_444 N H38 H4 0.770230(20) . -201_454 N H38 H5 1.444400(30) . -202_344 N H38 C15 1.633580(30) . 3_565 N H38 C17 1.97952(4) . 2_665 N H38 C17 1.874960(30) . 3_565 N H38 C19 1.099390(20) . 1_555 N H38 C19 1.68875(4) . 2_665 N H38 N5 0.797560(10) . 3_565 N H38 H30 1.92555(4) . 3_565 N H38 H34 1.509740(30) . 2_665 N H38 H39 1.75534(4) . 1_555 N H38 H39 1.100000(20) . 2_665 N H39 C2 1.69286(4) . -201_454 N H39 N2 1.68020(4) . -202_344 N H39 N2 1.97538(4) . -203_444 N H39 H4 1.790230(30) . -201_454 N H39 H4 1.713340(30) . -203_444 N H39 H5 1.212430(30) . -201_454 N H39 H8 1.87081(4) . -203_444 N H39 C17 1.405100(30) . 2_665 N H39 C19 1.106850(20) . 1_555 N H39 C19 2.04206(4) . 2_665 N H39 C19 1.455030(30) . 3_565 N H39 N5 1.040290(20) . 2_665 N H39 N5 1.560110(30) . 3_565 N H39 H31 1.901130(30) . 3_565 N H39 H34 1.544840(30) . 2_665 N H39 H35 1.943620(30) . 2_665 N H39 H38 1.75534(4) . 1_555 N H39 H38 1.100000(20) . 3_565 N C20 C1 0.873600(20) . 1_555 N C20 N1 1.471310(30) . 1_555 N C20 N1 1.466070(30) . 2_445 N C20 N1 1.477420(30) . 3_545 N C20 H1 1.123960(20) . 1_555 N C20 H2 1.163790(20) . 1_555 N C20 H3 1.98976(6) . 1_555 N C20 H40 1.112860(20) . 1_555 N C20 H41 1.096970(20) . 1_555 N C20 H42 1.117270(30) . 1_555 N H40 C1 1.109280(20) . 1_555 N H40 H1 0.0273 . 1_555 N H40 H2 1.76628(4) . 1_555 N H40 H3 1.82091(4) . 1_555 N H40 C20 1.112860(20) . 1_555 N H40 H41 1.76672(4) . 1_555 N H40 H42 1.82865(4) . 1_555 N H41 C1 1.163790(20) . 1_555 N H41 H1 1.76834(4) . 1_555 N H41 H2 0.1729 . 1_555 N H41 H3 1.93690(4) . 1_555 N H41 C20 1.096970(20) . 1_555 N H41 H40 1.76672(4) . 1_555 N H41 H42 1.79306(4) . 1_555 N H42 Al3 2.521(13) . 203_555 N H42 C1 1.98976(6) . 1_555 N H42 O11 1.732(18) . 203_445 N H42 Si3 2.470(8) . -202_335 N H42 H1 1.85194(4) . 1_555 N H42 H2 1.93690(4) . 1_555 N H42 C20 1.117270(30) . 1_555 N H42 H40 1.82865(4) . 1_555 N H42 H41 1.79306(4) . 1_555 N loop_ _pd_meas_counts_total _pd_proc_ls_weight _pd_proc_intensity_bkg_calc _pd_calc_intensity_total 2069.0 0.000483 2191.45435 2191.45435 2184.0 0.000458 2156.49805 2156.49805 2109.0 0.000474 2122.56689 2122.56689 2075.0 0.000482 2089.62573 2089.62573 2040.0 0.000490 2057.64063 2057.64063 1997.0 0.000501 2026.58154 2026.58154 1911.0 0.000523 1996.41602 1996.41602 1937.0 0.000516 1967.11475 1967.11475 1942.0 0.000515 1938.64709 1938.64709 1885.0 0.000531 1910.98865 1910.98865 1863.0 0.000537 1884.10901 1884.10901 1834.0 0.000545 1857.98279 1857.98279 1827.0 0.000547 1832.58459 1832.58459 1763.0 0.000567 1807.88904 1807.88904 1854.0 0.000539 1783.87366 1783.87366 1745.0 0.000573 1760.51563 1760.51563 1682.0 0.000595 1737.79187 1737.79187 1696.0 0.000590 1715.68018 1715.68018 1725.0 0.000580 1694.16101 1694.16101 1706.0 0.000586 1673.21411 1673.21411 1656.0 0.000604 1652.81921 1652.81921 1677.0 0.000596 1632.95764 1632.95764 1614.0 0.000620 1613.61292 1613.61292 1634.0 0.000612 1594.76575 1594.76575 1586.0 0.000631 1576.39832 1576.39832 1593.0 0.000628 1558.49719 1558.49719 1582.0 0.000632 1541.04431 1541.04431 1550.0 0.000645 1524.02490 1524.02490 1569.0 0.000637 1507.42432 1507.42432 1497.0 0.000668 1491.22961 1491.22961 1485.0 0.000673 1475.42505 1475.42505 1468.0 0.000681 1459.99805 1459.99805 1486.0 0.000673 1444.93713 1444.93713 1527.0 0.000655 1430.22791 1430.22791 1487.0 0.000672 1415.85950 1415.85950 1438.0 0.000695 1401.82068 1401.82068 1416.0 0.000706 1388.10022 1388.10022 1387.0 0.000721 1374.68689 1374.68689 1367.0 0.000732 1361.57056 1361.57056 1333.0 0.000750 1348.74219 1348.74219 1359.0 0.000736 1336.19177 1336.19177 1337.0 0.000748 1323.90930 1323.90930 1300.0 0.000769 1311.88770 1311.88770 1328.0 0.000753 1300.11670 1300.11670 1304.0 0.000767 1288.58838 1288.58838 1262.0 0.000792 1277.29565 1277.29565 1290.0 0.000775 1266.23010 1266.23010 1371.0 0.000729 1255.38440 1255.38440 1275.0 0.000784 1244.75256 1244.75256 1267.0 0.000789 1234.32568 1234.32568 1231.0 0.000812 1224.09900 1224.09900 1231.0 0.000812 1214.06531 1214.06531 1232.0 0.000812 1204.21960 1204.21960 1230.0 0.000813 1194.55493 1194.55493 1226.0 0.000816 1185.06580 1185.06580 1185.0 0.000844 1175.74744 1175.74744 1175.0 0.000851 1166.59399 1166.59399 1170.0 0.000855 1157.60059 1157.60059 1227.0 0.000815 1148.76331 1148.76331 1216.0 0.000822 1140.07581 1140.07581 1126.0 0.000888 1131.53503 1131.53503 1113.0 0.000898 1123.13672 1123.13672 1102.0 0.000907 1114.87598 1114.87598 1119.0 0.000894 1106.74890 1106.74890 1126.0 0.000888 1098.75244 1098.75244 1107.0 0.000903 1090.88281 1090.88281 1079.0 0.000927 1083.13611 1083.13611 1063.0 0.000941 1075.50903 1075.50903 1044.0 0.000958 1067.99866 1067.99866 1066.0 0.000938 1060.60132 1060.60132 1103.0 0.000907 1053.31470 1053.31470 1066.0 0.000938 1046.13574 1046.13574 1035.0 0.000966 1039.06165 1039.06165 1028.0 0.000973 1032.08984 1032.08984 1066.0 0.000938 1025.21741 1025.21741 1013.0 0.000987 1018.44287 1018.44287 1052.0 0.000951 1011.76257 1011.76257 1014.0 0.000986 1005.17554 1005.17554 1037.0 0.000964 998.67889 998.67889 991.0 0.001009 992.27026 992.27026 1022.0 0.000978 985.94873 985.94873 973.0 0.001028 979.71167 979.71167 965.0 0.001036 973.55725 973.55725 915.0 0.001093 967.48413 967.48413 958.0 0.001044 961.48975 961.48975 983.0 0.001017 955.57422 955.57422 943.0 0.001060 949.73370 949.73370 940.0 0.001064 943.96851 943.96851 966.0 0.001035 938.27649 938.27649 973.0 0.001028 932.65576 932.65576 967.0 0.001034 927.10645 927.10645 947.0 0.001056 921.62622 921.62622 916.0 0.001092 916.21356 916.21356 924.0 0.001082 910.86774 910.86774 901.0 0.001110 905.58813 905.58813 900.0 0.001111 900.37305 900.37305 911.0 0.001098 895.22119 895.22119 925.0 0.001081 890.13220 890.13220 842.0 0.001188 885.10492 885.10492 861.0 0.001161 880.13788 880.13788 873.0 0.001145 875.23053 875.23053 835.0 0.001198 870.38190 870.38190 835.0 0.001198 865.59204 865.59204 878.0 0.001139 860.85870 860.85870 838.0 0.001193 856.18182 856.18182 854.0 0.001171 851.56073 851.56073 879.0 0.001138 846.99438 846.99438 829.0 0.001206 842.48199 842.48199 809.0 0.001236 838.02338 838.02338 812.0 0.001232 833.61707 833.61707 803.0 0.001245 829.26337 829.26337 779.0 0.001284 824.96075 824.96075 753.0 0.001328 820.70923 820.70923 832.0 0.001202 816.50769 816.50769 829.0 0.001206 812.35620 812.35620 833.0 0.001200 808.25323 808.48785 831.0 0.001203 804.19928 804.43719 735.0 0.001361 800.19281 800.43402 756.0 0.001323 796.23431 796.47894 776.0 0.001289 792.32233 792.57043 766.0 0.001305 788.45703 788.70874 763.0 0.001311 784.63739 784.89270 793.0 0.001261 780.86322 781.12225 784.0 0.001276 777.13385 777.39673 815.0 0.001227 773.44934 773.71606 802.0 0.001247 769.80823 770.07898 757.0 0.001321 766.21088 766.48566 729.0 0.001372 762.65668 762.93567 737.0 0.001357 759.14514 759.42841 754.0 0.001326 755.67590 755.96350 717.0 0.001395 752.24792 752.54004 731.0 0.001368 748.86212 749.15881 754.0 0.001326 745.51636 745.81775 757.0 0.001321 742.21155 742.51776 728.0 0.001374 738.94684 739.25800 767.0 0.001304 735.72186 736.03809 743.0 0.001346 732.53583 732.85724 752.0 0.001330 729.38904 729.71582 701.0 0.001427 726.28058 726.61285 719.0 0.001391 723.21008 723.54797 721.0 0.001387 720.17737 720.52100 708.0 0.001412 717.18213 717.53168 688.0 0.001453 714.22363 714.57928 751.0 0.001332 711.30139 711.66333 731.0 0.001368 708.41577 708.78412 697.0 0.001435 705.56580 705.94080 713.0 0.001403 702.75092 703.13275 668.0 0.001497 699.97144 700.36029 666.0 0.001502 697.22632 697.62238 666.0 0.001502 694.51550 694.91901 682.0 0.001466 691.83868 692.24988 660.0 0.001515 689.19525 689.61432 715.0 0.001399 686.58508 687.01233 704.0 0.001420 684.00751 684.44312 666.0 0.001502 681.46277 681.90710 712.0 0.001404 678.94971 679.40302 662.0 0.001511 676.46838 676.93091 699.0 0.001431 674.01831 674.49042 694.0 0.001441 671.59955 672.08160 656.0 0.001524 669.21100 669.70325 701.0 0.001427 666.85266 667.35553 675.0 0.001481 664.52454 665.03839 648.0 0.001543 662.22565 662.75092 661.0 0.001513 659.95605 660.49316 664.0 0.001506 657.71533 658.26471 671.0 0.001490 655.50275 656.06488 681.0 0.001468 653.31848 653.89386 675.0 0.001481 651.16187 651.75104 643.0 0.001555 649.03278 649.63635 624.0 0.001603 646.93036 647.54889 631.0 0.001585 644.85504 645.48920 645.0 0.001550 642.80579 643.45630 680.0 0.001471 640.78265 641.45026 678.0 0.001475 638.78479 639.47028 641.0 0.001560 636.81268 637.51691 646.0 0.001548 634.86523 635.58911 633.0 0.001580 632.94244 633.68701 587.0 0.001704 631.04395 631.81030 638.0 0.001567 629.16937 629.95874 674.0 0.001484 627.31836 628.13202 638.0 0.001567 625.49023 626.32965 639.0 0.001565 623.68555 624.55231 621.0 0.001610 621.90314 622.79913 628.0 0.001592 620.14294 621.07031 616.0 0.001623 618.40472 619.36597 626.0 0.001597 616.68805 617.68634 663.0 0.001508 614.99249 616.03180 640.0 0.001563 613.31799 614.40350 638.0 0.001567 611.66406 612.80280 602.0 0.001661 610.03021 611.23157 570.0 0.001754 608.41650 609.69299 599.0 0.001669 606.82239 608.19043 641.0 0.001560 605.24744 606.72827 613.0 0.001631 603.69171 605.31171 620.0 0.001613 602.15442 603.94543 642.0 0.001558 600.63562 602.63452 601.0 0.001664 599.13489 601.38269 621.0 0.001610 597.65210 600.19214 581.0 0.001721 596.18646 599.06256 637.0 0.001570 594.73798 597.99316 606.0 0.001650 593.30646 596.98157 603.0 0.001658 591.89136 596.02325 583.0 0.001715 590.49268 595.11346 609.0 0.001642 589.10986 594.24805 579.0 0.001727 587.74280 593.42377 642.0 0.001558 586.39117 592.63654 601.0 0.001664 585.05450 591.88318 594.0 0.001684 583.73297 591.16345 616.0 0.001623 582.42566 590.47510 562.0 0.001779 581.13275 589.81635 641.0 0.001560 579.85400 589.18793 621.0 0.001610 578.58875 588.58984 613.0 0.001631 577.33704 588.02075 564.0 0.001773 576.09851 587.48065 618.0 0.001618 574.87311 586.97168 605.0 0.001653 573.66028 586.49255 600.0 0.001667 572.45984 586.04242 585.0 0.001709 571.27167 585.62366 566.0 0.001767 570.09552 585.23682 605.0 0.001653 568.93097 584.87976 578.0 0.001730 567.77783 584.55457 605.0 0.001653 566.63599 584.26318 595.0 0.001681 565.50513 584.00372 616.0 0.001623 564.38477 583.77667 626.0 0.001597 563.27521 583.58575 647.0 0.001546 562.17590 583.42938 579.0 0.001727 561.08643 583.30713 609.0 0.001642 560.00714 583.22327 643.0 0.001555 558.93719 583.17712 606.0 0.001650 557.87671 583.16797 614.0 0.001629 556.82562 583.19977 623.0 0.001605 555.78333 583.27325 599.0 0.001669 554.74982 583.38739 590.0 0.001695 553.72504 583.54602 632.0 0.001582 552.70844 583.75098 622.0 0.001608 551.70013 584.00153 598.0 0.001672 550.69983 584.30121 641.0 0.001560 549.70746 584.65326 601.0 0.001664 548.72247 585.05664 632.0 0.001582 547.74506 585.51581 617.0 0.001621 546.77502 586.03424 629.0 0.001590 545.81177 586.61194 626.0 0.001597 544.85553 587.25391 599.0 0.001669 543.90619 587.96423 599.0 0.001669 542.96332 588.74414 634.0 0.001577 542.02679 589.59943 636.0 0.001572 541.09644 590.53467 625.0 0.001600 540.17242 591.55341 583.0 0.001715 539.25415 592.66229 612.0 0.001634 538.34174 593.86707 652.0 0.001534 537.43506 595.17346 639.0 0.001565 536.53357 596.59003 607.0 0.001647 535.63757 598.12421 583.0 0.001715 534.74670 599.78528 609.0 0.001642 533.86108 601.58447 660.0 0.001515 532.98022 603.53210 642.0 0.001558 532.10437 605.64282 635.0 0.001575 531.23297 607.93085 590.0 0.001695 530.36615 610.41382 650.0 0.001538 529.50372 613.11212 612.0 0.001634 528.64569 616.04883 646.0 0.001548 527.79175 619.25183 668.0 0.001497 526.94189 622.75360 686.0 0.001458 526.09607 626.59393 634.0 0.001577 525.25397 630.82123 698.0 0.001433 524.41559 635.49609 611.0 0.001637 523.58099 640.69543 642.0 0.001558 522.74982 646.51727 656.0 0.001524 521.92206 653.08765 666.0 0.001502 521.09760 660.56512 668.0 0.001497 520.27661 669.14270 670.0 0.001493 519.45856 679.03876 640.0 0.001563 518.64362 690.47400 667.0 0.001499 517.83173 703.62256 669.0 0.001495 517.02258 718.53625 627.0 0.001595 516.21625 735.04486 686.0 0.001458 515.41272 752.64642 702.0 0.001425 514.61194 770.41504 705.0 0.001418 513.81348 786.95721 707.0 0.001414 513.01770 800.44818 672.0 0.001488 512.22437 808.76270 708.0 0.001412 511.43320 809.73297 708.0 0.001412 510.64444 801.59229 735.0 0.001361 509.85803 783.63617 690.0 0.001449 509.07352 756.86072 661.0 0.001513 508.29141 723.96863 702.0 0.001425 507.51120 688.48621 671.0 0.001490 506.73303 653.66266 682.0 0.001466 505.95673 621.86005 661.0 0.001513 505.18240 594.45959 683.0 0.001464 504.40985 571.99579 677.0 0.001477 503.63901 554.35614 652.0 0.001534 502.87000 540.99701 718.0 0.001393 502.10269 531.15100 697.0 0.001435 501.33701 524.00220 641.0 0.001560 500.57294 518.80762 635.0 0.001575 499.81052 514.96155 665.0 0.001504 499.04953 512.01117 674.0 0.001484 498.28998 509.64224 667.0 0.001499 497.53201 507.64938 622.0 0.001608 496.77533 505.90393 655.0 0.001527 496.02020 504.32834 654.0 0.001529 495.26636 502.87546 658.0 0.001520 494.51389 501.51645 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168.75310 223.34081 209.0 0.00478 168.76732 220.13110 230.0 0.00435 168.78285 217.24466 217.0 0.00461 168.79968 214.70561 220.0 0.00455 168.81778 212.53427 227.0 0.00441 168.83720 210.72873 214.0 0.00467 168.85788 209.30728 230.0 0.00435 168.87981 208.27888 187.0 0.00535 168.90297 207.65068 207.0 0.00483 168.92738 207.42851 185.0 0.00541 168.95303 207.61899 193.0 0.00518 168.97986 208.22069 178.0 0.00562 169.00790 209.23813 187.0 0.00535 169.03714 210.67247 183.0 0.00546 169.06755 212.52260 220.0 0.00455 169.09909 214.78856 191.0 0.00524 169.13181 217.46655 181.0 0.00552 169.16565 220.55171 205.0 0.00488 169.20058 224.03699 216.0 0.00463 169.23663 227.89662 209.0 0.00478 169.27379 232.17847 225.0 0.00444 169.31198 236.79648 209.0 0.00478 169.35121 241.75844 248.0 0.00403 169.39151 247.04201 204.0 0.00490 169.43282 252.61923 207.0 0.00483 169.47513 258.45911 235.0 0.00426 169.51839 264.52545 243.0 0.00412 169.56265 270.77786 260.0 0.00385 169.60785 277.17072 268.0 0.00373 169.65395 283.65442 257.0 0.00389 169.70097 290.17538 232.0 0.00431 169.74892 296.67657 268.0 0.00373 169.79770 303.09784 276.0 0.00362 169.84731 309.37741 313.0 0.003195 169.89778 315.45477 330.0 0.003030 169.94905 321.26746 282.0 0.00355 170.00108 326.75589 278.0 0.00360 170.05391 331.86313 318.0 0.003145 170.10748 336.53226 290.0 0.003448 170.16177 340.71942 317.0 0.003155 170.21674 344.37482 328.0 0.003049 170.27240 347.45767 338.0 0.002959 170.32874 349.93024 339.0 0.002950 170.38565 351.76038 332.0 0.003012 170.44321 352.92529 334.0 0.002994 170.50137 353.39621 331.0 0.003021 170.56007 353.16238 329.0 0.003040 170.61929 352.22189 339.0 0.002950 170.67906 350.57819 332.0 0.003012 170.73932 348.25040 331.0 0.003021 170.80003 345.25571 338.0 0.002959 170.86115 341.68024 347.0 0.002882 170.92273 337.47809 315.0 0.003175 170.98470 332.74783 330.0 0.003030 171.04698 327.54974 338.0 0.002959 171.10966 321.94598 350.0 0.002857 171.17265 316.00708 310.0 0.003226 171.23593 309.79904 318.0 0.003145 171.29942 303.38907 294.0 0.003401 171.36322 296.84286 303.0 0.003300 171.42720 290.22284 268.0 0.00373 171.49133 283.58823 263.0 0.00380 171.55566 276.99396 260.0 0.00385 171.62013 270.49045 278.0 0.00360 171.68471 264.12292 299.0 0.003344 171.74931 257.93219 281.0 0.00356 171.81401 251.95323 256.0 0.00391 171.87875 246.21667 238.0 0.00420 171.94344 240.74628 204.0 0.00490 172.00813 235.56232 217.0 0.00461 172.07278 230.67940 236.0 0.00424 172.13736 226.10759 222.0 0.00450 172.20177 221.85252 216.0 0.00463 172.26610 217.91602 202.0 0.00495 172.33025 214.29576 182.0 0.00549 172.39423 210.98676 199.0 0.00503 172.45795 207.98096 218.0 0.00459 172.52145 205.26962 208.0 0.00481 172.58470 202.83788 190.0 0.00526 172.64760 200.67412 205.0 0.00488 172.71022 198.76366 170.0 0.00588 172.77251 197.09212 162.0 0.00617 172.83441 195.64473 206.0 0.00485 172.89587 194.40701 202.0 0.00495 172.95694 193.36478 194.0 0.00515 173.01756 192.50900 194.0 0.00515 173.07765 191.82008 197.0 0.00508 173.13728 191.29050 189.0 0.00529 173.19638 190.91183 195.0 0.00513 173.25493 190.67198 174.0 0.00575 173.31284 190.56451 185.0 0.00541 173.37018 190.58330 188.0 0.00532 173.42690 190.72255 208.0 0.00481 173.48291 190.97205 180.0 0.00556 173.53828 191.33942 199.0 0.00503 173.59296 191.82123 195.0 0.00513 173.64690 192.40533 184.0 0.00543 173.70003 193.09476 183.0 0.00546 173.75244 193.89322 175.0 0.00571 173.80403 194.79057 158.0 0.00633 173.85480 195.79056 189.0 0.00529 173.90468 196.89238 193.0 0.00518 173.95374 198.09503 192.0 0.00521 174.00189 199.39725 202.0 0.00495 174.04910 200.79741 188.0 0.00532 174.09540 202.29317 172.0 0.00581 174.14076 203.88164 218.0 0.00459 174.18513 205.55945 198.0 0.00505 174.22845 207.30835 202.0 0.00495 174.27081 209.15077 195.0 0.00513 174.31212 211.06673 178.0 0.00562 174.35234 213.04916 207.0 0.00483 174.39151 215.08675 226.0 0.00442 174.42960 217.17662 236.0 0.00424 174.46655 219.30467 198.0 0.00505 174.50235 221.45912 194.0 0.00515 174.53703 223.62607 207.0 0.00483 174.57054 225.79056 196.0 0.00510 174.60286 227.93600 224.0 0.00446 174.63399 230.01572 235.0 0.00426 174.66391 232.06786 243.0 0.00412 174.69260 234.04337 219.0 0.00457 174.72002 235.92137 230.0 0.00435 174.74622 237.68083 223.0 0.00448 174.77113 239.30077 246.0 0.00407 174.79477 240.76102 234.0 0.00427 174.81709 242.04271 212.0 0.00472 174.83812 243.12762 234.0 0.00427 174.85785 244.00243 225.0 0.00444 174.87622 244.65373 252.0 0.00397 174.89326 245.07262 241.0 0.00415 174.90897 245.25291 241.0 0.00415 174.92331 245.19194 256.0 0.00391 174.93626 244.89214 263.0 0.00380 174.94788 244.35817 240.0 0.00417 174.95810 243.61198 257.0 0.00389 174.96692 242.63831 261.0 0.00383 174.97437 241.46519 249.0 0.00402 174.98041 240.10947 227.0 0.00441 174.98505 238.53258 247.0 0.00405 174.98827 236.86859 208.0 0.00481 174.99010 235.08028 252.0 0.00397 174.99051 233.23911 251.0 0.00398 174.98950 231.26288 263.0 0.00380 174.98709 229.22173 232.0 0.00431 174.98325 227.13382 258.0 0.00388 174.97798 225.01657 248.0 0.00403 174.97131 222.88588 269.0 0.00372 174.96323 220.75592 228.0 0.00439 174.95372 218.63947 241.0 0.00415 174.94281 216.54346 210.0 0.00476 174.93050 214.48308 219.0 0.00457 174.91676 212.46915 199.0 0.00503 174.90164 210.50114 211.0 0.00474 174.88513 208.59114 193.0 0.00518 174.86722 206.75549 200.0 0.00500 174.84792 204.97339 204.0 0.00490 174.82727 203.25996 187.0 0.00535 174.80525 201.61845 198.0 0.00505 174.78186 200.05148 197.0 0.00508 174.75713 198.56116 186.0 0.00538 174.73106 197.14977 184.0 0.00543 174.70367 195.80948 195.0 0.00513 174.67496 194.56059 181.0 0.00552 174.64493 193.39468 182.0 0.00549 174.61365 192.31914 201.0 0.00498 174.58105 191.32083 181.0 0.00552 174.54721 190.40868 182.0 0.00549 174.51213 189.58673 179.0 0.00559 174.47580 188.84604 181.0 0.00552 174.43825 188.20638 181.0 0.00552 174.39951 187.58647 185.0 0.00541 174.35960 187.10512 159.0 0.00629 174.31851 186.71014 187.0 0.00535 174.27628 186.40131 192.0 0.00521 174.23289 186.17851 175.0 0.00571 174.18846 186.04153 173.0 0.00578 174.14290 185.94139 145.0 0.00690 174.09628 185.97513 160.0 0.00625 174.04865 186.09300 205.0 0.00488 173.99997 186.29413 158.0 0.00633 173.95029 186.58209 168.0 0.00595 173.89963 186.94603 162.0 0.00617 173.84807 187.38931 178.0 0.00562 173.79552 187.90973 154.0 0.00649 173.74211 188.50551 163.0 0.00613 173.68784 189.17413 175.0 0.00571 173.63269 189.90685 189.0 0.00529 173.57672 190.71260 168.0 0.00595 173.51996 191.58192 174.0 0.00575 173.46246 192.51100 187.0 0.00535 173.40421 193.49532 183.0 0.00546 173.34521 194.53008 202.0 0.00495 173.28561 195.61000 188.0 0.00532 173.22530 196.73064 202.0 0.00495 173.16438 197.88350 183.0 0.00546 173.10286 199.06187 183.0 0.00546 173.04083 200.25920 204.0 0.00490 172.97823 201.46797 195.0 0.00513 172.91512 202.68097 209.0 0.00478 172.85156 203.89059 198.0 0.00505 172.78760 205.08939 187.0 0.00535 172.72321 206.27002 199.0 0.00503 172.65843 207.42542 214.0 0.00467 172.59338 208.54900 219.0 0.00457 172.52797 209.63474 197.0 0.00508 172.46230 210.67653 196.0 0.00510 172.39638 211.66942 203.0 0.00493 172.33032 212.60603 207.0 0.00483 172.26404 213.48799 228.0 0.00439 172.19762 214.30943 211.0 0.00474 172.13116 215.07269 206.0 0.00485 172.06456 215.77040 216.0 0.00463 171.99796 216.40456 246.0 0.00407 171.93134 216.97919 220.0 0.00455 171.86482 217.49910 210.0 0.00476 171.79831 217.97282 209.0 0.00478 171.73190 218.40256 219.0 0.00457 171.66570 218.80138 242.0 0.00413 171.59959 219.18050 221.0 0.00452 171.53371 219.55257 226.0 0.00442 171.46806 219.92990 190.0 0.00526 171.40274 220.32573 215.0 0.00465 171.33768 220.75163 227.0 0.00441 171.27293 221.21872 225.0 0.00444 171.20859 221.73621 219.0 0.00457 171.14468 222.31119 232.0 0.00431 171.08115 222.95161 235.0 0.00426 171.01811 223.65349 239.0 0.00418 170.95560 224.42035 234.0 0.00427 170.89360 225.24629 239.0 0.00418 170.83214 226.12579 220.0 0.00455 170.77127 227.01015 223.0 0.00448 170.71107 227.96681 217.0 0.00461 170.65149 228.94063 225.0 0.00444 170.59258 229.91431 219.0 0.00457 170.53441 230.86874 232.0 0.00431 170.47693 231.78331 240.0 0.00417 170.42023 232.63496 257.0 0.00389 170.36430 233.40137 246.0 0.00407 170.30923 234.05963 242.0 0.00413 170.25497 234.58745 258.0 0.00388 170.20157 234.96353 272.0 0.00368 170.14909 235.16701 257.0 0.00389 170.09747 235.08220 241.0 0.00415 170.04680 234.89810 258.0 0.00388 169.99706 234.51370 249.0 0.00402 169.94833 233.91472 272.0 0.00368 169.90054 233.10464 249.0 0.00402 169.85378 232.08891 253.0 0.00395 169.80804 230.87585 271.0 0.00369 169.76337 229.48340 262.0 0.00382 169.71971 227.92587 249.0 0.00402 169.67712 226.22388 256.0 0.00391 169.63567 224.39919 244.0 0.00410 169.59525 222.47496 259.0 0.00386 169.55594 220.47499 245.0 0.00408 169.51775 218.42323 261.0 0.00383 169.48070 216.33823 244.0 0.00410 169.44475 214.25832 244.0 0.00410 169.40993 212.18839 254.0 0.00394 169.37627 210.15421 229.0 0.00437 169.34373 208.17413 211.0 0.00474 169.31233 206.26164 221.0 0.00452 169.28206 204.43626 222.0 0.00450 169.25296 202.70731 208.0 0.00481 169.22496 201.08430 202.0 0.00495 169.19810 199.57460 204.0 0.00490 169.17239 198.18303 200.0 0.00500 169.14778 196.91202 192.0 0.00521 169.12428 195.76231 184.0 0.00543 169.10188 194.73222 203.0 0.00493 169.08058 193.81813 183.0 0.00546 169.06035 193.01515 209.0 0.00478 169.04115 192.31670 195.0 0.00513 169.02301 191.71503 178.0 0.00562 169.00592 191.20149 209.0 0.00478 168.98981 190.76680 210.0 0.00476 168.97469 190.40100 183.0 0.00546 168.96054 190.09132 200.0 0.00500 168.94731 189.83380 174.0 0.00575 168.93498 189.61589 197.0 0.00508 168.92355 189.42827 187.0 0.00535 168.91296 189.26230 168.0 0.00595 168.90321 189.11050 203.0 0.00493 168.89421 188.96582 204.0 0.00490 168.88600 188.82262 167.0 0.00599 168.87848 188.67593 169.0 0.00592 168.87164 188.52263 193.0 0.00518 168.86543 188.36034 203.0 0.00493 168.85982 188.18810 188.0 0.00532 168.85475 188.00696 189.0 0.00529 168.85019 187.81943 196.0 0.00510 168.84608 187.62872 189.0 0.00529 168.84239 187.43994 188.0 0.00532 168.83907 187.25970 183.0 0.00546 168.83603 187.09636 179.0 0.00559 168.83325 186.95708 184.0 0.00543 168.83066 186.85249 175.0 0.00571 168.82822 186.79330 156.0 0.00641 168.82585 186.79036 160.0 0.00625 168.82350 186.85539 172.0 0.00581 168.82111 187.00180 187.0 0.00535 168.81860 187.23773 175.0 0.00571 168.81593 187.57733 171.0 0.00585 168.81302 188.02274 187.0 0.00535 168.80980 188.59731 160.0 0.00625 168.80620 189.30762 177.0 0.00565 168.80217 190.16048 176.0 0.00568 168.79759 191.16435 191.0 0.00524 168.79245 192.32251 176.0 0.00568 168.78662 193.64047 186.0 0.00538 168.78004 195.12097 187.0 0.00535 168.77264 196.76456 184.0 0.00543 168.76434 198.56990 163.0 0.00613 168.75507 200.53304 180.0 0.00556 168.74474 202.64812 177.0 0.00565 168.73325 204.90672 196.0 0.00510 168.72054 207.29799 209.0 0.00478 168.70650 209.80980 189.0 0.00529 168.69107 212.41953 223.0 0.00448 168.67416 215.12120 205.0 0.00488 168.65570 217.89288 216.0 0.00463 168.63557 220.69128 206.0 0.00485 168.61369 223.52574 189.0 0.00529 168.59000 226.35670 219.0 0.00457 168.56438 229.15816 225.0 0.00444 168.53674 231.90358 226.0 0.00442 168.50702 234.56578 226.0 0.00442 168.47513 237.08635 256.0 0.00391 168.44093 239.50325 242.0 0.00413 168.40437 241.75938 246.0 0.00407 168.36539 243.83170 278.0 0.00360 168.32385 245.69943 270.0 0.00370 168.27969 247.34492 262.0 0.00382 168.23279 248.75340 253.0 0.00395 168.18312 249.91437 251.0 0.00398 168.13054 250.82124 237.0 0.00422 168.07497 251.47160 290.0 0.003448 168.01633 251.86394 265.0 0.00377 167.95461 252.01207 283.0 0.00353 167.88959 251.92188 280.0 0.00357 167.82124 251.60643 273.0 0.00366 167.74959 251.08760 268.0 0.00373 167.67439 250.36961 303.0 0.003300 167.59564 249.47691 259.0 0.00386 167.51326 248.42831 258.0 0.00388 167.42725 247.24265 259.0 0.00386 167.33739 245.97044 255.0 0.00392 167.24370 244.56422 275.0 0.00364 167.14607 243.06256 259.0 0.00386 167.04457 241.50067 243.0 0.00412 166.93892 239.88188 246.0 0.00407 166.82919 238.21867 249.0 0.00402 166.71539 236.52145 270.0 0.00370 166.59729 234.79909 242.0 0.00413 166.47491 233.05888 233.0 0.00429 166.34822 231.30646 245.0 0.00408 166.21729 229.54590 219.0 0.00457 166.08183 227.77937 240.0 0.00417 165.94196 226.00853 223.0 0.00448 165.79773 224.23695 222.0 0.00450 165.64888 222.45763 230.0 0.00435 165.49550 220.67569 225.0 0.00444 165.33759 218.88596 241.0 0.00415 165.17523 217.09052 208.0 0.00481 165.00819 215.28934 199.0 0.00503 164.83655 213.48328 199.0 0.00503 164.66048 211.67416 223.0 0.00448 164.47969 209.86400 208.0 0.00481 164.29434 208.05600 217.0 0.00461 164.10443 206.25377 198.0 0.00505 163.91016 204.47624 193.0 0.00518 163.71120 202.69884 196.0 0.00510 163.50778 200.94084 202.0 0.00495 163.29994 199.20802 221.0 0.00452 163.08784 197.50661 198.0 0.00505 162.87129 195.83961 191.0 0.00524 162.65042 194.21394 211.0 0.00474 162.42552 192.63559 202.0 0.00495 162.19630 191.10965 196.0 0.00510 161.96303 189.65260 182.0 0.00549 161.72578 188.24786 179.0 0.00559 161.48483 186.92285 218.0 0.00459 161.23990 185.65862 203.0 0.00493 160.99132 184.47073 196.0 0.00510 160.73936 183.36269 161.0 0.00621 160.48380 182.46779 169.0 0.00592 160.22493 181.52864 167.0 0.00599 159.96291 180.67630 185.0 0.00541 159.69809 179.91214 188.0 0.00532 159.43021 179.23656 180.0 0.00556 159.15967 178.64977 187.0 0.00535 158.88681 178.15552 188.0 0.00532 158.61143 177.74509 200.0 0.00500 158.33394 177.41357 167.0 0.00599 158.05450 177.17938 164.0 0.00610 157.77357 177.02213 165.0 0.00606 157.49095 176.94420 172.0 0.00581 157.20705 176.94220 155.0 0.00645 156.92210 177.01233 160.0 0.00625 156.63661 177.14835 166.0 0.00602 156.35037 177.34949 164.0 0.00610 156.06387 177.60878 169.0 0.00592 155.77760 177.92064 178.0 0.00562 155.49141 178.27910 191.0 0.00524 155.20581 178.67802 172.0 0.00581 154.92108 179.11150 196.0 0.00510 154.63779 179.58136 194.0 0.00515 154.35579 180.06415 173.0 0.00578 154.07561 180.56183 153.0 0.00654 153.79784 181.04063 191.0 0.00524 153.52235 181.54825 190.0 0.00526 153.24976 182.05075 178.0 0.00562 152.98038 182.54138 189.0 0.00529 152.71478 183.01317 183.0 0.00546 152.45297 183.45950 189.0 0.00529 152.19551 183.88071 186.0 0.00538 151.94298 184.25586 177.0 0.00565 151.69537 184.58482 182.0 0.00549 151.45331 184.86101 144.0 0.00694 151.21716 185.07806 182.0 0.00549 150.98755 185.23050 167.0 0.00599 150.76453 185.31216 182.0 0.00549 150.54869 185.31868 200.0 0.00500 150.34047 185.24660 202.0 0.00495 150.14043 185.09320 199.0 0.00503 149.94870 184.85716 194.0 0.00515 149.76587 184.53868 192.0 0.00521 149.59250 184.13953 193.0 0.00518 149.42876 183.66246 185.0 0.00541 149.27525 183.11162 230.0 0.00435 149.13235 182.49333 186.0 0.00538 149.00064 181.82533 181.0 0.00552 148.88033 181.09137 196.0 0.00510 148.77193 180.30658 217.0 0.00461 148.67596 179.48730 182.0 0.00549 148.59270 178.63713 208.0 0.00481 148.52260 177.76395 188.0 0.00532 148.46608 176.87541 169.0 0.00592 148.42358 175.97456 182.0 0.00549 148.39539 175.07671 189.0 0.00529 148.38196 174.13817 176.0 0.00568 148.38361 173.25667 196.0 0.00510 148.40070 172.39142 185.0 0.00541 148.43356 171.54712 177.0 0.00565 148.48251 170.72842 175.0 0.00571 148.54779 169.93748 198.0 0.00505 148.62978 169.17824 185.0 0.00541 148.72867 168.45268 170.0 0.00588 148.84470 167.76283 148.0 0.00676 148.97797 167.11003 156.0 0.00641 149.12883 166.54243 163.0 0.00613 149.29738 165.97807 159.0 0.00629 149.48354 165.44199 190.0 0.00526 149.68765 164.94580 160.0 0.00625 149.90965 164.48984 169.0 0.00592 150.14955 164.07411 166.0 0.00602 150.40707 163.70381 173.0 0.00578 150.68254 163.37029 161.0 0.00621 150.97560 163.07898 166.0 0.00602 151.28586 162.82924 167.0 0.00599 151.61353 162.62270 162.0 0.00617 151.95808 162.46504 171.0 0.00585 152.31915 162.35172 174.0 0.00575 152.69603 162.27695 182.0 0.00549 153.08881 162.24713 161.0 0.00621 153.49664 162.26270 177.0 0.00565 153.91856 162.32320 180.0 0.00556 154.35451 162.42824 159.0 0.00629 154.80338 162.58005 168.0 0.00595 155.26425 162.77667 168.0 0.00595 155.73581 163.01794 163.0 0.00613 156.21771 163.30356 154.0 0.00649 156.70842 163.63251 161.0 0.00621 157.20668 164.00342 140.0 0.00714 157.71069 164.41100 163.0 0.00613 158.21974 164.86359 171.0 0.00585 158.73181 165.35092 159.0 0.00629 159.24477 165.87981 180.0 0.00556 159.75751 166.44031 151.0 0.00662 160.26764 167.02437 172.0 0.00581 160.77299 167.63478 167.0 0.00599 161.27086 168.26765 181.0 0.00552 161.75955 168.92014 175.0 0.00571 162.23605 169.58791 157.0 0.00637 162.69720 170.26820 167.0 0.00599 163.14072 170.95726 171.0 0.00585 163.56310 171.64468 154.0 0.00649 163.96097 172.32463 172.0 0.00581 164.33049 173.00063 156.0 0.00641 164.66849 173.66351 156.0 0.00641 164.97064 174.30751 170.0 0.00588 165.23259 174.92688 159.0 0.00629 165.45026 175.51654 191.0 0.00524 165.61876 176.07036 172.0 0.00581 165.73314 176.58263 171.0 0.00585 165.78816 177.04759 178.0 0.00562 165.77847 177.45940 177.0 0.00565 165.69818 177.81218 149.0 0.00671 165.54128 178.10019 155.0 0.00645 165.30161 178.31802 176.0 0.00568 164.97211 178.45901 149.0 0.00671 164.54590 178.51813 177.0 0.00565 164.01611 178.48920 171.0 0.00585 163.37424 178.36607 160.0 0.00625 162.61255 178.14272 193.0 0.00518 161.72266 177.81296 189.0 0.00529 160.69646 177.37125 172.0 0.00581 159.52322 176.80922 162.0 0.00617 158.19398 176.12048 194.0 0.00515 156.69986 175.29903 195.0 0.00513 155.02805 174.33459 182.0 0.00549 153.16859 173.22003 184.0 0.0 151.10997 . loop_ _refln_index_h _refln_index_k _refln_index_l _refln_observed_status _refln_F_squared_meas _refln_F_squared_calc _refln_phase_calc _refln_d_spacing _gsas_i100_meas 0 0 3 o 25132.785 12957.381 0.00 15.16663 14.06 1 0 1 o 101660.72 104241.96 0.00 11.43414 100.00 1 0 -2 o 39113.92 39556.67 180.00 10.48405 32.28 1 0 4 o 124801.77 120494.69 0.00 8.19388 62.91 0 0 6 o 1611.232 9262.644 180.00 7.58331 0.23 1 0 -5 o 115401.98 142926.08 0.00 7.20906 44.64 1 1 0 o 73538.47 75256.52 180.00 6.82037 25.92 1 1 -3 o 827.674 2397.590 0.00 6.22035 0.24 1 1 3 o 1176.606 3367.540 0.00 6.22035 0.34 2 0 -1 o 197424.59 189565.91 180.00 5.85747 49.32 2 0 2 o 48117.25 48985.69 0.00 5.71707 11.46 1 0 7 o 17264.334 19593.963 180.00 5.69484 4.03 2 0 -4 o 289203.31 293098.47 180.00 5.24203 57.71 1 0 -8 o 1109.452 1374.250 0.00 5.12450 0.20 1 1 6 o 4700.702 5083.824 180.00 5.07108 0.87 1 1 -6 o 4296.368 4641.295 180.00 5.07108 0.79 0 0 9 o 732825.1 766290.9 180.00 5.05554 45.50 2 0 5 o 122047.11 109690.09 180.00 4.95445 21.67 3 -1 1 o 293506.47 278301.78 180.00 4.44364 41.64 2 1 1 o 223405.02 211836.33 180.00 4.44364 31.68 3 -1 -2 o 58999.49 62029.44 0.00 4.38140 8.16 2 1 -2 o 129274.66 135897.70 0.00 4.38140 17.83 2 0 -7 o 87.027 85.515 180.00 4.37137 0.01 1 0 10 o 54706.01 34620.133 180.00 4.24594 7.05 3 -1 4 o 527335.4 462602.8 180.00 4.15626 65.26 2 1 4 o 209489.34 183931.78 180.00 4.15626 25.77 2 0 8 o 5770.779 4314.900 0.00 4.09694 0.69 1 1 -9 o 1645.912 1345.203 0.00 4.06144 0.19 1 1 9 o 159681.52 129828.57 0.00 4.06144 18.79 2 1 -5 o 250734.45 218338.80 180.00 4.00847 28.86 3 -1 -5 o 67138.72 58561.24 180.00 4.00847 7.64 3 0 0 o 214237.17 192750.56 0.00 3.93774 23.49 1 0 -11 o 44874.64 75435.12 0.00 3.90395 4.93 3 0 3 o 7797.755 4290.490 180.00 3.81138 0.79 3 0 -3 o 604.980 336.589 0.00 3.81138 0.06 0 0 12 o 3733.196 874.072 0.00 3.79166 0.12 3 -1 7 o 3225.989 1379.260 0.00 3.68033 0.31 2 1 7 o 5379.246 2283.737 180.00 3.68033 0.51 2 0 -10 o 21357.010 11564.596 0.00 3.60453 1.95 2 1 -8 o 586.917 746.958 0.00 3.51202 0.05 3 -1 -8 o 14022.750 18174.172 0.00 3.51202 1.25 3 0 -6 o 762.057 1437.825 180.00 3.49468 0.06 3 0 6 o 605.869 1167.028 0.00 3.49468 0.05 2 2 0 o 428823.9 375089.5 180.00 3.41019 35.12 2 0 11 o 227.617 198.383 180.00 3.38817 0.02 1 0 13 o 493889.4 459324.5 180.00 3.35580 39.05 2 2 -3 o 2558.870 3390.885 180.00 3.32712 0.20 2 2 3 o 1869.632 2478.836 0.00 3.32712 0.15 1 1 12 o 1579.316 2424.160 0.00 3.31398 0.12 1 1 -12 o 1113.007 1724.020 0.00 3.31398 0.09 4 -1 -1 o 12055.236 20316.727 0.00 3.26794 0.92 3 1 -1 o 2417.709 4211.375 0.00 3.26794 0.20 3 1 2 o 8203.602 13571.294 180.00 3.24294 0.61 4 -1 2 o 204.235 387.886 180.00 3.24294 0.02 2 1 10 o 51427.59 61948.33 0.00 3.18685 3.68 3 -1 10 o 30860.090 37133.30 0.00 3.18685 2.19 4 -1 -4 o 48770.91 44280.27 0.00 3.14840 3.37 3 1 -4 o 41333.99 37531.09 0.00 3.14840 2.85 1 0 -14 o 428621.4 419018.7 180.00 3.13357 29.35 2 2 6 o 4382.181 6950.445 0.00 3.11018 0.30 2 2 -6 o 2825.711 4484.813 180.00 3.11018 0.19 3 0 -9 o 1523.401 2421.652 0.00 3.10658 0.10 3 0 9 o 5226.216 8404.819 0.00 3.10658 0.34 3 1 5 o 33771.363 28187.252 0.00 3.08268 2.24 4 -1 5 o 38694.73 32386.291 0.00 3.08268 2.53 2 1 -11 o 8323.122 7902.985 180.00 3.03438 0.53 3 -1 -11 o 28598.289 27141.813 180.00 3.03438 1.84 0 0 15 o 167.270 163.526 180.00 3.03333 0.00 2 0 -13 o 56223.55 76839.17 0.00 3.01106 3.65 4 0 1 o 403905.9 321053.31 0.00 2.94711 24.23 4 0 -2 o 93344.05 64270.88 180.00 2.92873 5.55 3 1 -7 o 146.377 101.518 180.00 2.92573 0.01 4 -1 -7 o 15209.455 10514.063 180.00 2.92573 0.88 4 0 4 o 513226.4 512463.9 0.00 2.85853 29.04 2 0 14 o 54281.39 53305.22 0.00 2.84742 3.09 4 -1 8 o 2109.169 2118.041 180.00 2.83902 0.12 3 1 8 o 7824.547 7855.689 0.00 2.83902 0.43 2 2 9 o 58541.41 66800.70 0.00 2.82713 3.26 2 2 -9 o 11855.528 13498.646 0.00 2.82713 0.65 4 0 -5 o 188702.36 215465.78 0.00 2.80908 10.38 1 1 -15 o 102.737 88.586 0.00 2.77158 0.01 1 1 15 o 318.631 274.297 180.00 2.77158 0.02 1 0 16 o 8133.335 7097.110 0.00 2.76476 0.44 2 1 13 o 198326.36 193127.91 0.00 2.75457 10.39 3 -1 13 o 177431.20 172802.48 0.00 2.75457 9.25 3 0 12 o 574.525 1266.248 0.00 2.73129 0.03 3 0 -12 o 1261.252 2812.614 0.00 2.73129 0.06 3 2 1 o -9.422 34.398 180.00 2.70535 0.00 5 -2 1 o 3647.873 11641.719 180.00 2.70535 0.20 3 2 -2 o 6871.170 32400.021 0.00 2.69111 0.37 5 -2 -2 o -8.413 13.686 0.00 2.69111 0.00 4 0 7 o 815.094 3951.519 180.00 2.68878 0.05 4 -1 -10 o 3299.329 2601.282 0.00 2.65880 0.16 3 1 -10 o 13.389 10.415 0.00 2.65880 0.00 3 2 4 o 23029.008 23049.152 180.00 2.63635 1.10 5 -2 4 o 24905.746 24927.377 180.00 2.63635 1.19 3 -1 -14 o 141955.39 155393.53 0.00 2.62762 6.75 2 1 -14 o 125038.47 136862.45 0.00 2.62762 5.94 4 0 -8 o 3122.359 3701.520 180.00 2.62101 0.15 1 0 -17 o 33509.477 41479.09 180.00 2.61031 1.58 5 -2 -5 o 26270.615 21394.070 180.00 2.59740 1.20 3 2 -5 o 3522.972 2862.935 180.00 2.59740 0.16 5 -1 0 o 139661.36 151280.36 0.00 2.57786 6.46 4 1 0 o 160998.14 174424.33 0.00 2.57786 7.47 4 -1 11 o 262.589 350.775 180.00 2.56831 0.01 3 1 11 o 343.731 476.507 180.00 2.56831 0.01 2 0 -16 o 11636.403 21993.299 180.00 2.56225 0.53 5 -1 -3 o 910.371 1447.825 0.00 2.54141 0.04 5 -1 3 o 8857.299 14640.919 180.00 2.54141 0.39 4 1 3 o 491.534 768.100 180.00 2.54141 0.02 4 1 -3 o 6304.650 10537.994 0.00 2.54141 0.28 2 2 12 o 71.824 98.202 180.00 2.53554 0.00 2 2 -12 o 54.693 75.341 0.00 2.53554 0.00 0 0 18 o 34042.563 39454.46 180.00 2.52777 0.56 3 2 7 o 5772.469 3205.774 0.00 2.50142 0.24 5 -2 7 o 5301.269 3052.031 0.00 2.50142 0.21 4 0 10 o 10875.060 3637.560 180.00 2.47722 0.45 3 2 -8 o 5802.790 11632.562 180.00 2.44658 0.22 5 -2 -8 o 11305.411 23357.232 180.00 2.44658 0.46 5 -1 6 o 1014.899 2282.119 0.00 2.44069 0.04 4 1 6 o 986.553 2092.816 0.00 2.44069 0.04 4 1 -6 o 4059.844 9045.610 180.00 2.44069 0.17 5 -1 -6 o 50.601 111.283 180.00 2.44069 0.00 2 0 17 o 3642.819 8767.014 0.00 2.43786 0.16 4 0 -11 o 3293.443 6659.105 0.00 2.40354 0.15 3 0 15 o 121.514 232.595 0.00 2.40302 0.00 3 0 -15 o 16.878 32.270 0.00 2.40302 0.00 3 -1 16 o 6427.318 12309.140 180.00 2.39857 0.25 2 1 16 o 12736.959 24591.078 180.00 2.39857 0.51 4 -1 -13 o 450.262 938.503 180.00 2.39191 0.02 3 1 -13 o 685.399 1472.956 180.00 2.39191 0.04 1 1 18 o 5364.910 6984.076 180.00 2.37022 0.19 1 1 -18 o 471.518 716.092 0.00 2.37022 0.03 5 0 -1 o 889.118 1030.988 0.00 2.35947 0.05 5 0 2 o 10657.499 17626.910 180.00 2.35001 0.41 1 0 19 o 338.747 501.997 180.00 2.34699 0.02 3 2 10 o 16199.958 12520.762 180.00 2.32840 0.56 5 -2 10 o 17.447 13.557 180.00 2.32840 0.00 5 0 -4 o 74522.26 56037.72 0.00 2.31327 2.68 3 1 14 o 4385.839 3549.813 180.00 2.30737 0.16 4 -1 14 o 3548.254 2880.807 180.00 2.30737 0.13 5 -1 -9 o 14.968 15.993 0.00 2.29653 0.00 5 -1 9 o 239.684 246.391 0.00 2.29653 0.01 4 1 9 o 13281.885 13742.472 0.00 2.29653 0.42 4 1 -9 o 11617.364 12070.350 180.00 2.29653 0.42 2 1 -17 o 13475.817 14031.378 0.00 2.29562 0.49 3 -1 -17 o 8102.528 8431.224 0.00 2.29562 0.29 5 0 5 o 124163.78 122615.17 0.00 2.28683 4.30 3 3 0 o 62899.45 65054.88 0.00 2.27346 1.97 3 2 -11 o 1381.447 1760.617 180.00 2.26690 0.05 5 -2 -11 o 2455.151 3040.353 0.00 2.26690 0.08 2 2 -15 o 12.493 16.023 180.00 2.26646 0.00 2 2 15 o 63.440 81.170 180.00 2.26646 0.00 4 0 13 o 58117.60 103405.15 180.00 2.25713 2.20 3 3 3 o -0.256 0.107 180.00 2.24834 0.00 3 3 -3 o 1526.243 2662.600 180.00 2.24834 0.05 1 0 -20 o 870.945 5525.796 0.00 2.23395 0.03 6 -2 -1 o 258.219 439.799 0.00 2.22981 0.01 4 2 -1 o 292.108 691.139 180.00 2.22981 0.01 4 2 2 o 2296.412 1747.205 180.00 2.22182 0.07 6 -2 2 o 4242.627 3107.293 0.00 2.22182 0.14 5 0 -7 o 2107.901 1525.273 180.00 2.22051 0.07 2 0 -19 o 3400.590 2399.048 0.00 2.21927 0.11 6 -2 -4 o 10153.039 7419.976 180.00 2.19070 0.33 4 2 -4 o 674.410 494.211 180.00 2.19070 0.02 4 0 -14 o 72952.43 71923.75 180.00 2.18568 2.44 5 0 8 o 42402.20 47733.99 0.00 2.18188 1.29 3 3 6 o 4553.135 5389.729 0.00 2.17770 0.14 3 3 -6 o 292.939 344.942 180.00 2.17770 0.01 6 -2 5 o 6378.292 8017.565 180.00 2.16820 0.20 4 2 5 o 20125.098 25403.514 180.00 2.16820 0.64 0 0 21 o 261.273 320.839 0.00 2.16666 0.00 4 -1 -16 o 694.844 1372.379 180.00 2.14762 0.02 3 1 -16 o 4212.325 8869.084 180.00 2.14762 0.12 3 2 13 o 13396.447 20066.373 180.00 2.14283 0.37 5 -2 13 o 873.146 1225.950 180.00 2.14283 0.02 4 1 -12 o 4362.251 4266.943 180.00 2.13182 0.13 4 1 12 o 4159.187 4070.132 0.00 2.13182 0.12 5 -1 -12 o 151.530 148.207 180.00 2.13182 0.00 5 -1 12 o 349.472 341.776 0.00 2.13182 0.01 3 0 18 o 121968.86 122695.59 0.00 2.12720 3.47 3 0 -18 o 105327.38 105955.73 0.00 2.12720 3.00 2 0 20 o 1398.328 1467.577 0.00 2.12297 0.04 6 -1 1 o 13047.508 15027.557 180.00 2.11942 0.38 5 1 1 o 4299.237 4938.408 180.00 2.11942 0.12 5 1 -2 o 12940.365 16880.244 0.00 2.11255 0.37 6 -1 -2 o 4425.675 5743.970 0.00 2.11255 0.12 4 2 -7 o 1306.086 1659.264 0.00 2.11142 0.04 6 -2 -7 o 32.922 45.097 180.00 2.11142 0.00 3 -1 19 o 545.562 709.046 0.00 2.11036 0.02 2 1 19 o -0.376 0.022 0.00 2.11036 0.00 5 0 -10 o 3765.301 2735.930 0.00 2.09681 0.10 5 1 4 o 28438.441 25340.475 180.00 2.08575 0.77 6 -1 4 o 22480.934 19988.150 180.00 2.08575 0.62 5 -2 -14 o 7330.424 6959.987 180.00 2.08142 0.18 3 2 -14 o 14580.484 13818.903 180.00 2.08142 0.38 6 -2 8 o 5786.636 5672.976 180.00 2.07813 0.15 4 2 8 o 5896.660 5777.300 180.00 2.07813 0.16 3 3 -9 o 127767.20 129920.32 180.00 2.07345 3.35 3 3 9 o 160543.52 163333.27 180.00 2.07345 4.35 4 -1 17 o 16487.152 16854.844 0.00 2.07278 0.44 3 1 17 o 77.762 80.886 180.00 2.07278 0.00 6 -1 -5 o 33159.203 36197.87 180.00 2.06630 0.89 5 1 -5 o 27228.018 29759.213 180.00 2.06630 0.74 1 1 -21 o 10.110 10.963 180.00 2.06497 0.00 1 1 21 o 202.878 220.739 0.00 2.06497 0.01 5 0 11 o 317.978 281.834 180.00 2.05156 0.01 4 0 16 o 16577.488 14701.805 0.00 2.04847 0.46 1 0 22 o 56192.99 60256.90 0.00 2.03719 1.46 2 2 -18 o 7764.605 8357.750 0.00 2.03072 0.23 2 2 18 o 3204.986 3446.071 0.00 2.03072 0.09 3 -1 -20 o 3194.136 3997.007 0.00 2.02704 0.08 2 1 -20 o 451.469 552.577 0.00 2.02704 0.01 6 -1 7 o 2349.430 3742.716 0.00 2.01698 0.06 5 1 7 o 845.002 1309.779 0.00 2.01698 0.02 4 2 -10 o 186.750 158.301 180.00 2.00423 0.00 6 -2 -10 o 8220.335 6861.369 180.00 2.00423 0.20 4 0 -17 o 27555.822 32092.473 180.00 1.98322 0.73 6 -1 -8 o 3881.880 4677.687 180.00 1.98790 0.09 5 1 -8 o 2193.542 2633.414 180.00 1.98790 0.05 6 0 0 o 44000.63 39341.66 180.00 1.96887 1.08 4 2 11 o 822.333 720.336 0.00 1.96461 0.02 6 -2 11 o 2028.604 1764.393 0.00 1.96461 0.05 5 -1 -15 o 6011.976 5196.043 0.00 1.96432 0.15 5 -1 15 o 506.642 442.574 180.00 1.96432 0.01 4 1 15 o 5702.301 4935.559 180.00 1.96432 0.14 4 1 -15 o 2097.992 1823.324 0.00 1.96432 0.05 3 2 16 o 15.467 13.689 0.00 1.96189 0.00 5 -2 16 o 311.225 267.901 180.00 1.96189 0.01 5 0 -13 o 106784.96 101699.05 180.00 1.95824 2.67 6 0 -3 o 5538.056 7011.532 0.00 1.95249 0.13 6 0 3 o 2943.214 3703.611 180.00 1.95249 0.07 2 0 -22 o 22044.729 28492.482 180.00 1.95198 0.52 1 0 -23 o 74321.58 100102.04 0.00 1.95109 1.78 3 3 12 o 463.652 655.013 0.00 1.94982 0.01 3 3 -12 o 0.194 0.277 0.00 1.94982 0.00 4 3 1 o 21824.078 34881.395 0.00 1.94032 0.51 7 -3 1 o 13877.165 22287.266 0.00 1.94032 0.33 4 3 -2 o 2316.438 3627.683 180.00 1.93505 0.06 7 -3 -2 o 18766.473 29076.744 180.00 1.93505 0.44 4 -1 -19 o 239.328 336.191 0.00 1.93336 0.00 3 1 -19 o 1743.232 2587.808 0.00 1.93336 0.04 5 1 10 o 7131.195 6660.813 180.00 1.92293 0.17 6 -1 10 o 279.317 261.974 180.00 1.92293 0.01 4 3 4 o 12506.280 12910.229 0.00 1.91438 0.27 7 -3 4 o 55607.34 57472.09 0.00 1.91438 1.25 5 0 14 o 250823.33 263050.22 180.00 1.91103 5.84 6 0 -6 o 73.275 72.621 180.00 1.90569 0.00 6 0 6 o 1884.427 1864.894 180.00 1.90569 0.04 3 2 -17 o 254.542 253.254 180.00 1.90434 0.01 5 -2 -17 o 57.766 57.519 180.00 1.90434 0.00 4 3 -5 o 60481.79 61741.70 0.00 1.89931 1.35 7 -3 -5 o 12018.392 12261.673 0.00 1.89931 0.26 3 0 21 o 1222.450 1238.883 0.00 1.89828 0.03 3 0 -21 o 591.626 599.400 180.00 1.89828 0.01 0 0 24 o 10333.477 10153.834 180.00 1.89583 0.08 7 -2 0 o 202372.44 185488.91 180.00 1.89163 4.53 5 2 0 o 265551.66 243442.73 180.00 1.89163 5.94 5 1 -11 o 5518.740 4893.505 0.00 1.88785 0.12 6 -1 -11 o 367.288 328.943 0.00 1.88785 0.01 6 -2 -13 o 8481.434 8531.500 180.00 1.88219 0.17 4 2 -13 o 2849.385 2865.423 180.00 1.88219 0.05 7 -2 -3 o 2899.897 2662.741 0.00 1.87709 0.06 5 2 3 o 198.348 180.888 180.00 1.87709 0.00 5 2 -3 o 2783.886 2550.597 180.00 1.87709 0.06 7 -2 3 o 1888.763 1725.381 0.00 1.87709 0.04 3 -1 22 o 19900.625 17805.252 180.00 1.87663 0.41 2 1 22 o 30709.184 27291.186 180.00 1.87663 0.68 2 0 23 o 41121.21 34672.898 180.00 1.87584 0.89 3 1 20 o 812.404 469.547 180.00 1.86869 0.02 4 -1 20 o 3.283 1.999 180.00 1.86869 0.00 4 3 7 o 4950.772 4347.392 180.00 1.86080 0.10 7 -3 7 o 5611.607 4914.595 0.00 1.86080 0.12 4 0 19 o 33471.668 29064.746 180.00 1.86007 0.73 6 -2 14 o 4766.792 2587.444 180.00 1.84016 0.09 4 2 14 o 11757.266 6163.009 180.00 1.84016 0.23 4 3 -8 o 1472.190 960.736 180.00 1.83789 0.03 7 -3 -8 o 724.019 453.813 180.00 1.83789 0.02 5 2 6 o 2843.083 2090.435 0.00 1.83539 0.06 5 2 -6 o 2466.175 1825.307 180.00 1.83539 0.05 7 -2 6 o 10424.400 7716.517 180.00 1.83539 0.21 7 -2 -6 o 1274.571 920.400 180.00 1.83539 0.03 6 0 9 o 489.460 354.928 0.00 1.83465 0.01 6 0 -9 o 19629.199 14743.275 180.00 1.83465 0.40 2 2 21 o 92.975 73.210 0.00 1.82877 0.00 2 2 -21 o 6424.197 4910.342 0.00 1.82877 0.13 1 1 24 o 2134.886 1467.705 0.00 1.82658 0.04 1 1 -24 o 3750.323 2609.358 180.00 1.82658 0.08 3 3 15 o 121.065 57.503 180.00 1.81921 0.00 3 3 -15 o 257.432 108.794 180.00 1.81921 0.01 5 0 -16 o 19713.385 9192.078 0.00 1.81728 0.40 5 1 13 o 749.915 422.546 0.00 1.81437 0.02 6 -1 13 o 308.842 179.987 180.00 1.81437 0.01 2 1 -23 o 69261.56 54144.47 180.00 1.80868 1.35 3 -1 -23 o 30575.463 23672.934 180.00 1.80868 0.62 5 -1 -18 o 147897.58 116898.40 180.00 1.80485 2.97 4 1 -18 o 133337.14 105200.87 180.00 1.80485 2.69 5 -1 18 o 149586.92 118169.16 180.00 1.80485 3.01 4 1 18 o 287513.59 227556.22 180.00 1.80485 5.74 4 0 -20 o 2138.264 1709.946 0.00 1.80227 0.04 7 -1 -1 o 7890.387 6768.204 180.00 1.80009 0.16 6 1 -1 o 28916.920 24902.104 180.00 1.80009 0.58 1 0 25 o 35405.78 32386.209 180.00 1.79877 0.69 7 -1 2 o 4000.731 3986.268 0.00 1.79588 0.08 6 1 2 o 6104.505 6082.749 0.00 1.79588 0.12 3 2 19 o 3158.027 3100.940 180.00 1.79453 0.06 5 -2 19 o 57.043 55.796 0.00 1.79453 0.00 4 3 10 o 1384.264 1010.094 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