#------------------------------------------------------------------------------ #$Date: 2025-07-01 13:47:54 +0300 (Tue, 01 Jul 2025) $ #$Revision: 1124 $ #$URL: svn://localhost/testcod/cif/7/10/00/7100014.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_7100014 loop_ _publ_author_name 'O’Nolan, Daniel' 'Chatterton, Lindsey' 'Bellamy, Timothy' 'Ennis, J. Todd' 'Soukri, Mustapha' _publ_section_title ; Enhanced CO2 sorption properties in a polarizable [WO2F4]2−-pillared physisorbent under direct air capture conditions ; _journal_issue 77 _journal_name_full 'Chemical Communications' _journal_page_first 11540 _journal_page_last 11543 _journal_paper_doi 10.1039/D3CC02749J _journal_volume 59 _journal_year 2023 _chemical_formula_sum 'C8 H8 F4 N4 Ni O6.129 W' _chemical_formula_weight 576.77 _space_group_IT_number 140 _space_group_name_Hall '-I 4 2c' _space_group_name_H-M_alt 'I 4/m c m' _symmetry_cell_setting tetragonal _symmetry_space_group_name_H-M 'I 4/m c m' _audit_creation_date 2022-10-28T14:02 _audit_creation_method 'created in GSAS-II' _audit_update_record ; 2023-06-05 deposited with the CCDC. 2023-08-25 downloaded from the CCDC. ; _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 9.91785(6) _cell_length_b 9.91785(6) _cell_length_c 15.71517(9) _cell_volume 1545.803(16) _computing_structure_refinement 'GSAS-II (Toby & Von Dreele, J. Appl. Cryst. 46, 544-549, 2013)' _diffrn_ambient_pressure 100 _diffrn_ambient_temperature 300 _diffrn_radiation_polarisn_ratio 0.4920 _diffrn_radiation_probe x-ray _diffrn_radiation_type K\a~1,2~ _exptl_crystal_density_diffrn 2.4783 _pd_block_id ; 2022-10-28T14:02|20220422_Round3.bak15.bak0.bak0.bak0|O'NolanDaniel|D8@RTI(JTE) ; _pd_calc_method 'Rietveld Refinement' _pd_instr_location ' ?' _pd_meas_number_of_points 11189 _pd_phase_name I4/mcm _pd_proc_info_datetime 2022-10-28T14:02 _pd_proc_info_excluded_regions ' ?' _pd_proc_ls_background_function ; Background function: "chebyschev-1" function with 20 terms: 11968(27), -3.3(5)e2, 6.5(5)e2, -5.7(4)e2, 1.44(4)e3, -1.12(4)e3, 8.6(4)e2, -6.0(4)e2, 7.3(4)e2, -3.6(4)e2, 4.1(4)e2, -1.7(4)e2, 1.4(4)e2, -7(4)e1, 3.0(3)e2, -2(3)e1, 3(3)e1, 1.2(3)e2, -30(29), 66(29), ; _pd_proc_ls_pref_orient_corr none _pd_proc_ls_profile_function ; Finger-Cox-Jephcoat function parameters U, V, W, X, Y, SH/L: peak variance(Gauss) = Utan(Th)^2^+Vtan(Th)+W: peak HW(Lorentz) = X/cos(Th)+Ytan(Th); SH/L = S/L+H/L U, V, W in (centideg)^2^, X & Y in centideg 27.6(25), -13.2(14), 3.26(19), -0.22(5), 6.24(29), 0.03233(9), Crystallite size in microns with "isotropic" model: parameters: Size, G/L mix 2.133, 1.000, Microstrain, "isotropic" model (10^6^ * delta Q/Q) parameters: Mustrain, G/L mix 1211.075, 1.000, ; _pd_proc_ls_prof_R_factor 0.07182 _pd_proc_ls_prof_wR_expected 0.00663 _pd_proc_ls_prof_wR_factor 0.10616 _pd_spec_mounting ' ?' _refine_diff_density_max 3.579 _refine_diff_density_min -2.176 _refine_ls_goodness_of_fit_all 16.026 _refine_ls_matrix_type full _refine_ls_number_parameters 29 _refine_ls_R_Fsqd_factor 0.12662 _refine_ls_shift/su_max 0.9006 _refine_ls_wR_factor_obs 0.10616 _reflns_d_resolution_high 0.892 _reflns_d_resolution_low 7.858 _reflns_limit_h_max 11 _reflns_limit_h_min 0 _reflns_limit_k_max 7 _reflns_limit_k_min 0 _reflns_limit_l_max 17 _reflns_limit_l_min 0 _reflns_number_total 331 _cod_data_source_file d3cc02749j2.cif _cod_data_source_block START _cod_original_cell_volume 1545.803(22) _cod_database_code 7100014 _refine_ls_r_f_factor 0.06711 _gsas_proc_ls_prof_r_b_factor 0.09796 _gsas_proc_ls_prof_wr_b_factor 0.13648 loop_ _space_group_symop_id _space_group_symop_operation_xyz 1 x,y,z 2 -y,x,z 3 -x,-y,z 4 y,-x,z 5 -x,y,1/2+z 6 -y,-x,1/2+z 7 x,-y,1/2+z 8 y,x,1/2+z 9 -x,-y,-z 10 y,-x,-z 11 x,y,-z 12 -y,x,-z 13 x,-y,1/2-z 14 y,x,1/2-z 15 -x,y,1/2-z 16 -y,-x,1/2-z 17 1/2+x,1/2+y,1/2+z 18 1/2-y,1/2+x,1/2+z 19 1/2-x,1/2-y,1/2+z 20 1/2+y,1/2-x,1/2+z 21 1/2-x,1/2+y,z 22 1/2-y,1/2-x,z 23 1/2+x,1/2-y,z 24 1/2+y,1/2+x,z 25 1/2-x,1/2-y,1/2-z 26 1/2+y,1/2-x,1/2-z 27 1/2+x,1/2+y,1/2-z 28 1/2-y,1/2+x,1/2-z 29 1/2+x,1/2-y,-z 30 1/2+y,1/2+x,-z 31 1/2-x,1/2+y,-z 32 1/2-y,1/2-x,-z loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_site_adp_type _atom_site_U_iso_or_equiv _atom_site_site_symmetry_multiplicity W1 W 0.50000 0.50000 0.50000 1.0000 Uani 0.0448 4 Ni3 Ni 0.50000 0.50000 0.75000 1.0000 Uiso 0.0071 4 F4_ax F 0.50000 0.50000 0.62451 0.5000 Uiso 0.0344 8 C4 C 0.33991 0.73744 0.30105 1.0000 Uiso 0.0791 32 N5 N 0.34657 0.34657 0.75000 1.0000 Uiso 0.0111 16 F7_eq F 0.70229 0.48398 0.50000 0.3750 Uiso 0.0133 16 O8_ax O 0.50000 0.50000 0.61021 0.5000 Uiso 0.0022 8 O9w O 0.60486 0.89084 0.50000 0.9508 Uiso 0.5333 16 F10_eq F 0.67809 0.61304 0.50000 0.3750 Uiso 0.0397 16 O11_eq O 0.65226 0.59277 0.50000 0.1250 Uiso 0.0416 16 O12_eq O 0.67545 0.49698 0.50000 0.1250 Uiso 0.0232 16 O13w O 0.50000 0.00000 0.75000 0.3254 Uiso 0.1284 4 H14 H 0.40615 0.74151 0.35043 1.0000 Uiso 0.0100 32 loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_12 _atom_site_aniso_U_13 _atom_site_aniso_U_23 W1 0.0587 0.0587 0.0171 0.0000 0.0000 0.0000 loop_ _atom_type_symbol _atom_type_number_in_cell _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_length_neutron _atom_type_scat_source _atom_type_scat_dispersion_real _atom_type_scat_dispersion_imag _atom_type_scat_dispersion_source C 32 2.31 1.02 1.5886 0.865 20.8439 10.2075 0.5687 51.6512 0.2156 0.6648 https://subversion.xray.aps.anl.gov/pyGSAS/trunk/atmdata.py 0.018 0.009 https://subversion.xray.aps.anl.gov/pyGSAS/trunk/atmdata.py H 32 0.493 0.3229 0.1402 0.0408 10.5109 26.1257 3.1424 57.7997 0.003 -0.3741 https://subversion.xray.aps.anl.gov/pyGSAS/trunk/atmdata.py 0.000 0.000 https://subversion.xray.aps.anl.gov/pyGSAS/trunk/atmdata.py F 16 3.5392 2.6412 1.517 1.0243 10.2825 4.2944 0.2615 26.1476 0.2776 0.5654 https://subversion.xray.aps.anl.gov/pyGSAS/trunk/atmdata.py 0.073 0.053 https://subversion.xray.aps.anl.gov/pyGSAS/trunk/atmdata.py N 16 12.2126 3.1322 2.0125 1.1663 0.0057 9.8933 28.9975 0.5826 -11.529 0.936 https://subversion.xray.aps.anl.gov/pyGSAS/trunk/atmdata.py 0.031 0.018 https://subversion.xray.aps.anl.gov/pyGSAS/trunk/atmdata.py Ni 4 12.8376 7.292 4.4438 2.38 3.8785 0.2565 12.1763 66.3421 1.0341 1.03 https://subversion.xray.aps.anl.gov/pyGSAS/trunk/atmdata.py -3.004 0.509 https://subversion.xray.aps.anl.gov/pyGSAS/trunk/atmdata.py O 24.514 3.0485 2.2868 1.5463 0.867 13.2771 5.7011 0.3239 32.9089 0.2508 0.5805 https://subversion.xray.aps.anl.gov/pyGSAS/trunk/atmdata.py 0.049 0.032 https://subversion.xray.aps.anl.gov/pyGSAS/trunk/atmdata.py W 4 29.0818 15.43 14.4327 5.1198 1.7203 9.2259 0.3217 57.056 9.8875 0.4755 https://subversion.xray.aps.anl.gov/pyGSAS/trunk/atmdata.py -5.480 5.575 https://subversion.xray.aps.anl.gov/pyGSAS/trunk/atmdata.py loop_ _diffrn_radiation_wavelength _diffrn_radiation_wavelength_wt _diffrn_radiation_wavelength_id 1.54051 1.0 1 1.54433 0.5294 2 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 Ni3 W1 Ni3 180 1_555 1_555 5_654 yes Ni3 W1 F4_ax 0 1_555 1_555 1_555 yes Ni3 W1 F4_ax 180 5_654 1_555 1_555 yes Ni3 W1 F4_ax 180 1_555 1_555 9_666 yes Ni3 W1 F4_ax 0 5_654 1_555 9_666 yes F4_ax W1 F4_ax 180 1_555 1_555 9_666 yes Ni3 W1 F7_eq 90 1_555 1_555 1_555 yes Ni3 W1 F7_eq 90 5_654 1_555 1_555 yes F4_ax W1 F7_eq 90 1_555 1_555 1_555 yes F4_ax W1 F7_eq 90 9_666 1_555 1_555 yes Ni3 W1 F7_eq 90 1_555 1_555 2_655 yes Ni3 W1 F7_eq 90 5_654 1_555 2_655 yes F4_ax W1 F7_eq 90 1_555 1_555 2_655 yes F4_ax W1 F7_eq 90 9_666 1_555 2_655 yes F7_eq W1 F7_eq 90 1_555 1_555 2_655 yes Ni3 W1 F7_eq 90 1_555 1_555 3_665 yes Ni3 W1 F7_eq 90 5_654 1_555 3_665 yes F4_ax W1 F7_eq 90 1_555 1_555 3_665 yes F4_ax W1 F7_eq 90 9_666 1_555 3_665 yes F7_eq W1 F7_eq 180 1_555 1_555 3_665 yes F7_eq W1 F7_eq 90 2_655 1_555 3_665 yes Ni3 W1 F7_eq 90 1_555 1_555 4_565 yes Ni3 W1 F7_eq 90 5_654 1_555 4_565 yes F4_ax W1 F7_eq 90 1_555 1_555 4_565 yes F4_ax W1 F7_eq 90 9_666 1_555 4_565 yes F7_eq W1 F7_eq 90 1_555 1_555 4_565 yes F7_eq W1 F7_eq 180 2_655 1_555 4_565 yes F7_eq W1 F7_eq 90 3_665 1_555 4_565 yes Ni3 W1 O8_ax 0 1_555 1_555 1_555 yes Ni3 W1 O8_ax 180 5_654 1_555 1_555 yes F4_ax W1 O8_ax 0 1_555 1_555 1_555 yes F4_ax W1 O8_ax 180 9_666 1_555 1_555 yes F7_eq W1 O8_ax 90 1_555 1_555 1_555 yes F7_eq W1 O8_ax 90 2_655 1_555 1_555 yes F7_eq W1 O8_ax 90 3_665 1_555 1_555 yes F7_eq W1 O8_ax 90 4_565 1_555 1_555 yes Ni3 W1 O8_ax 180 1_555 1_555 9_666 yes Ni3 W1 O8_ax 0 5_654 1_555 9_666 yes F4_ax W1 O8_ax 180 1_555 1_555 9_666 yes F4_ax W1 O8_ax 0 9_666 1_555 9_666 yes F7_eq W1 O8_ax 90 1_555 1_555 9_666 yes F7_eq W1 O8_ax 90 2_655 1_555 9_666 yes F7_eq W1 O8_ax 90 3_665 1_555 9_666 yes F7_eq W1 O8_ax 90 4_565 1_555 9_666 yes O8_ax W1 O8_ax 180 1_555 1_555 9_666 yes Ni3 W1 F10_eq 90 1_555 1_555 1_555 yes Ni3 W1 F10_eq 90 5_654 1_555 1_555 yes F4_ax W1 F10_eq 90 1_555 1_555 1_555 yes F4_ax W1 F10_eq 90 9_666 1_555 1_555 yes F7_eq W1 F10_eq 36.934 1_555 1_555 1_555 yes F7_eq W1 F10_eq 53.066 2_655 1_555 1_555 yes F7_eq W1 F10_eq 143.066 3_665 1_555 1_555 yes F7_eq W1 F10_eq 126.934 4_565 1_555 1_555 yes O8_ax W1 F10_eq 90 1_555 1_555 1_555 yes O8_ax W1 F10_eq 90 9_666 1_555 1_555 yes Ni3 W1 F10_eq 90 1_555 1_555 2_655 yes Ni3 W1 F10_eq 90 5_654 1_555 2_655 yes F4_ax W1 F10_eq 90 1_555 1_555 2_655 yes F4_ax W1 F10_eq 90 9_666 1_555 2_655 yes F7_eq W1 F10_eq 126.934 1_555 1_555 2_655 yes F7_eq W1 F10_eq 36.934 2_655 1_555 2_655 yes F7_eq W1 F10_eq 53.066 3_665 1_555 2_655 yes F7_eq W1 F10_eq 143.066 4_565 1_555 2_655 yes O8_ax W1 F10_eq 90 1_555 1_555 2_655 yes O8_ax W1 F10_eq 90 9_666 1_555 2_655 yes F10_eq W1 F10_eq 90 1_555 1_555 2_655 yes Ni3 W1 F10_eq 90 1_555 1_555 3_665 yes Ni3 W1 F10_eq 90 5_654 1_555 3_665 yes F4_ax W1 F10_eq 90 1_555 1_555 3_665 yes F4_ax W1 F10_eq 90 9_666 1_555 3_665 yes F7_eq W1 F10_eq 143.066 1_555 1_555 3_665 yes F7_eq W1 F10_eq 126.934 2_655 1_555 3_665 yes F7_eq W1 F10_eq 36.934 3_665 1_555 3_665 yes F7_eq W1 F10_eq 53.066 4_565 1_555 3_665 yes O8_ax W1 F10_eq 90 1_555 1_555 3_665 yes O8_ax W1 F10_eq 90 9_666 1_555 3_665 yes F10_eq W1 F10_eq 180 1_555 1_555 3_665 yes F10_eq W1 F10_eq 90 2_655 1_555 3_665 yes Ni3 W1 F10_eq 90 1_555 1_555 4_565 yes Ni3 W1 F10_eq 90 5_654 1_555 4_565 yes F4_ax W1 F10_eq 90 1_555 1_555 4_565 yes F4_ax W1 F10_eq 90 9_666 1_555 4_565 yes F7_eq W1 F10_eq 53.066 1_555 1_555 4_565 yes F7_eq W1 F10_eq 143.066 2_655 1_555 4_565 yes F7_eq W1 F10_eq 126.934 3_665 1_555 4_565 yes F7_eq W1 F10_eq 36.934 4_565 1_555 4_565 yes O8_ax W1 F10_eq 90 1_555 1_555 4_565 yes O8_ax W1 F10_eq 90 9_666 1_555 4_565 yes F10_eq W1 F10_eq 90 1_555 1_555 4_565 yes F10_eq W1 F10_eq 180 2_655 1_555 4_565 yes F10_eq W1 F10_eq 90 3_665 1_555 4_565 yes Ni3 W1 O11_eq 90 1_555 1_555 1_555 yes Ni3 W1 O11_eq 90 5_654 1_555 1_555 yes F4_ax W1 O11_eq 90 1_555 1_555 1_555 yes F4_ax W1 O11_eq 90 9_666 1_555 1_555 yes F7_eq W1 O11_eq 35.882 1_555 1_555 1_555 yes F7_eq W1 O11_eq 54.118 2_655 1_555 1_555 yes F7_eq W1 O11_eq 144.118 3_665 1_555 1_555 yes F7_eq W1 O11_eq 125.882 4_565 1_555 1_555 yes O8_ax W1 O11_eq 90 1_555 1_555 1_555 yes O8_ax W1 O11_eq 90 9_666 1_555 1_555 yes F10_eq W1 O11_eq 1.052 1_555 1_555 1_555 yes F10_eq W1 O11_eq 91.052 2_655 1_555 1_555 yes F10_eq W1 O11_eq 178.948 3_665 1_555 1_555 yes F10_eq W1 O11_eq 88.948 4_565 1_555 1_555 yes Ni3 W1 O11_eq 90 1_555 1_555 2_655 yes Ni3 W1 O11_eq 90 5_654 1_555 2_655 yes F4_ax W1 O11_eq 90 1_555 1_555 2_655 yes F4_ax W1 O11_eq 90 9_666 1_555 2_655 yes F7_eq W1 O11_eq 125.882 1_555 1_555 2_655 yes F7_eq W1 O11_eq 35.882 2_655 1_555 2_655 yes F7_eq W1 O11_eq 54.118 3_665 1_555 2_655 yes F7_eq W1 O11_eq 144.118 4_565 1_555 2_655 yes O8_ax W1 O11_eq 90 1_555 1_555 2_655 yes O8_ax W1 O11_eq 90 9_666 1_555 2_655 yes F10_eq W1 O11_eq 88.948 1_555 1_555 2_655 yes F10_eq W1 O11_eq 1.052 2_655 1_555 2_655 yes F10_eq W1 O11_eq 91.052 3_665 1_555 2_655 yes F10_eq W1 O11_eq 178.948 4_565 1_555 2_655 yes O11_eq W1 O11_eq 90 1_555 1_555 2_655 yes Ni3 W1 O11_eq 90 1_555 1_555 3_665 yes Ni3 W1 O11_eq 90 5_654 1_555 3_665 yes F4_ax W1 O11_eq 90 1_555 1_555 3_665 yes F4_ax W1 O11_eq 90 9_666 1_555 3_665 yes F7_eq W1 O11_eq 144.118 1_555 1_555 3_665 yes F7_eq W1 O11_eq 125.882 2_655 1_555 3_665 yes F7_eq W1 O11_eq 35.882 3_665 1_555 3_665 yes F7_eq W1 O11_eq 54.118 4_565 1_555 3_665 yes O8_ax W1 O11_eq 90 1_555 1_555 3_665 yes O8_ax W1 O11_eq 90 9_666 1_555 3_665 yes F10_eq W1 O11_eq 178.948 1_555 1_555 3_665 yes F10_eq W1 O11_eq 88.948 2_655 1_555 3_665 yes F10_eq W1 O11_eq 1.052 3_665 1_555 3_665 yes F10_eq W1 O11_eq 91.052 4_565 1_555 3_665 yes O11_eq W1 O11_eq 180 1_555 1_555 3_665 yes O11_eq W1 O11_eq 90 2_655 1_555 3_665 yes Ni3 W1 O11_eq 90 1_555 1_555 4_565 yes Ni3 W1 O11_eq 90 5_654 1_555 4_565 yes F4_ax W1 O11_eq 90 1_555 1_555 4_565 yes F4_ax W1 O11_eq 90 9_666 1_555 4_565 yes F7_eq W1 O11_eq 54.118 1_555 1_555 4_565 yes F7_eq W1 O11_eq 144.118 2_655 1_555 4_565 yes F7_eq W1 O11_eq 125.882 3_665 1_555 4_565 yes F7_eq W1 O11_eq 35.882 4_565 1_555 4_565 yes O8_ax W1 O11_eq 90 1_555 1_555 4_565 yes O8_ax W1 O11_eq 90 9_666 1_555 4_565 yes F10_eq W1 O11_eq 91.052 1_555 1_555 4_565 yes F10_eq W1 O11_eq 178.948 2_655 1_555 4_565 yes F10_eq W1 O11_eq 88.948 3_665 1_555 4_565 yes F10_eq W1 O11_eq 1.052 4_565 1_555 4_565 yes O11_eq W1 O11_eq 90 1_555 1_555 4_565 yes O11_eq W1 O11_eq 180 2_655 1_555 4_565 yes O11_eq W1 O11_eq 90 3_665 1_555 4_565 yes Ni3 W1 O12_eq 90 1_555 1_555 1_555 yes Ni3 W1 O12_eq 90 5_654 1_555 1_555 yes F4_ax W1 O12_eq 90 1_555 1_555 1_555 yes F4_ax W1 O12_eq 90 9_666 1_555 1_555 yes F7_eq W1 O12_eq 3.542 1_555 1_555 1_555 yes F7_eq W1 O12_eq 86.458 2_655 1_555 1_555 yes F7_eq W1 O12_eq 176.458 3_665 1_555 1_555 yes F7_eq W1 O12_eq 93.542 4_565 1_555 1_555 yes O8_ax W1 O12_eq 90 1_555 1_555 1_555 yes O8_ax W1 O12_eq 90 9_666 1_555 1_555 yes F10_eq W1 O12_eq 33.392 1_555 1_555 1_555 yes F10_eq W1 O12_eq 123.392 2_655 1_555 1_555 yes F10_eq W1 O12_eq 146.608 3_665 1_555 1_555 yes F10_eq W1 O12_eq 56.608 4_565 1_555 1_555 yes O11_eq W1 O12_eq 32.341 1_555 1_555 1_555 yes O11_eq W1 O12_eq 122.341 2_655 1_555 1_555 yes O11_eq W1 O12_eq 147.659 3_665 1_555 1_555 yes O11_eq W1 O12_eq 57.659 4_565 1_555 1_555 yes Ni3 W1 O12_eq 90 1_555 1_555 2_655 yes Ni3 W1 O12_eq 90 5_654 1_555 2_655 yes F4_ax W1 O12_eq 90 1_555 1_555 2_655 yes F4_ax W1 O12_eq 90 9_666 1_555 2_655 yes F7_eq W1 O12_eq 93.542 1_555 1_555 2_655 yes F7_eq W1 O12_eq 3.542 2_655 1_555 2_655 yes F7_eq W1 O12_eq 86.458 3_665 1_555 2_655 yes F7_eq W1 O12_eq 176.458 4_565 1_555 2_655 yes O8_ax W1 O12_eq 90 1_555 1_555 2_655 yes O8_ax W1 O12_eq 90 9_666 1_555 2_655 yes F10_eq W1 O12_eq 56.608 1_555 1_555 2_655 yes F10_eq W1 O12_eq 33.392 2_655 1_555 2_655 yes F10_eq W1 O12_eq 123.392 3_665 1_555 2_655 yes F10_eq W1 O12_eq 146.608 4_565 1_555 2_655 yes O11_eq W1 O12_eq 57.659 1_555 1_555 2_655 yes O11_eq W1 O12_eq 32.341 2_655 1_555 2_655 yes O11_eq W1 O12_eq 122.341 3_665 1_555 2_655 yes O11_eq W1 O12_eq 147.659 4_565 1_555 2_655 yes O12_eq W1 O12_eq 90 1_555 1_555 2_655 yes Ni3 W1 O12_eq 90 1_555 1_555 3_665 yes Ni3 W1 O12_eq 90 5_654 1_555 3_665 yes F4_ax W1 O12_eq 90 1_555 1_555 3_665 yes F4_ax W1 O12_eq 90 9_666 1_555 3_665 yes F7_eq W1 O12_eq 176.458 1_555 1_555 3_665 yes F7_eq W1 O12_eq 93.542 2_655 1_555 3_665 yes F7_eq W1 O12_eq 3.542 3_665 1_555 3_665 yes F7_eq W1 O12_eq 86.458 4_565 1_555 3_665 yes O8_ax W1 O12_eq 90 1_555 1_555 3_665 yes O8_ax W1 O12_eq 90 9_666 1_555 3_665 yes F10_eq W1 O12_eq 146.608 1_555 1_555 3_665 yes F10_eq W1 O12_eq 56.608 2_655 1_555 3_665 yes F10_eq W1 O12_eq 33.392 3_665 1_555 3_665 yes F10_eq W1 O12_eq 123.392 4_565 1_555 3_665 yes O11_eq W1 O12_eq 147.659 1_555 1_555 3_665 yes O11_eq W1 O12_eq 57.659 2_655 1_555 3_665 yes O11_eq W1 O12_eq 32.341 3_665 1_555 3_665 yes O11_eq W1 O12_eq 122.341 4_565 1_555 3_665 yes O12_eq W1 O12_eq 180 1_555 1_555 3_665 yes O12_eq W1 O12_eq 90 2_655 1_555 3_665 yes Ni3 W1 O12_eq 90 1_555 1_555 4_565 yes Ni3 W1 O12_eq 90 5_654 1_555 4_565 yes F4_ax W1 O12_eq 90 1_555 1_555 4_565 yes F4_ax W1 O12_eq 90 9_666 1_555 4_565 yes F7_eq W1 O12_eq 86.458 1_555 1_555 4_565 yes F7_eq W1 O12_eq 176.458 2_655 1_555 4_565 yes F7_eq W1 O12_eq 93.542 3_665 1_555 4_565 yes F7_eq W1 O12_eq 3.542 4_565 1_555 4_565 yes O8_ax W1 O12_eq 90 1_555 1_555 4_565 yes O8_ax W1 O12_eq 90 9_666 1_555 4_565 yes F10_eq W1 O12_eq 123.392 1_555 1_555 4_565 yes F10_eq W1 O12_eq 146.608 2_655 1_555 4_565 yes F10_eq W1 O12_eq 56.608 3_665 1_555 4_565 yes F10_eq W1 O12_eq 33.392 4_565 1_555 4_565 yes O11_eq W1 O12_eq 122.341 1_555 1_555 4_565 yes O11_eq W1 O12_eq 147.659 2_655 1_555 4_565 yes O11_eq W1 O12_eq 57.659 3_665 1_555 4_565 yes O11_eq W1 O12_eq 32.341 4_565 1_555 4_565 yes O12_eq W1 O12_eq 90 1_555 1_555 4_565 yes O12_eq W1 O12_eq 180 2_655 1_555 4_565 yes O12_eq W1 O12_eq 90 3_665 1_555 4_565 yes W1 Ni3 W1 180 1_555 1_555 5_655 yes W1 Ni3 F4_ax 0 1_555 1_555 1_555 yes W1 Ni3 F4_ax 180 5_655 1_555 1_555 yes W1 Ni3 F4_ax 180 1_555 1_555 13_567 yes W1 Ni3 F4_ax 0 5_655 1_555 13_567 yes F4_ax Ni3 F4_ax 180 1_555 1_555 13_567 yes W1 Ni3 C4 105.773 1_555 1_555 5_655 yes W1 Ni3 C4 74.227 5_655 1_555 5_655 yes F4_ax Ni3 C4 105.773 1_555 1_555 5_655 yes F4_ax Ni3 C4 74.227 13_567 1_555 5_655 yes W1 Ni3 C4 105.773 1_555 1_555 6_665 yes W1 Ni3 C4 74.227 5_655 1_555 6_665 yes F4_ax Ni3 C4 105.773 1_555 1_555 6_665 yes F4_ax Ni3 C4 74.227 13_567 1_555 6_665 yes C4 Ni3 C4 85.762 5_655 1_555 6_665 yes W1 Ni3 C4 105.773 1_555 1_555 7_565 yes W1 Ni3 C4 74.227 5_655 1_555 7_565 yes F4_ax Ni3 C4 105.773 1_555 1_555 7_565 yes F4_ax Ni3 C4 74.227 13_567 1_555 7_565 yes C4 Ni3 C4 148.453 5_655 1_555 7_565 yes C4 Ni3 C4 85.762 6_665 1_555 7_565 yes W1 Ni3 C4 105.773 1_555 1_555 8_555 yes W1 Ni3 C4 74.227 5_655 1_555 8_555 yes F4_ax Ni3 C4 105.773 1_555 1_555 8_555 yes F4_ax Ni3 C4 74.227 13_567 1_555 8_555 yes C4 Ni3 C4 85.762 5_655 1_555 8_555 yes C4 Ni3 C4 148.453 6_665 1_555 8_555 yes C4 Ni3 C4 85.762 7_565 1_555 8_555 yes W1 Ni3 C4 74.227 1_555 1_555 9_666 yes W1 Ni3 C4 105.773 5_655 1_555 9_666 yes F4_ax Ni3 C4 74.227 1_555 1_555 9_666 yes F4_ax Ni3 C4 105.773 13_567 1_555 9_666 yes C4 Ni3 C4 114.907 5_655 1_555 9_666 yes C4 Ni3 C4 158.817 6_665 1_555 9_666 yes C4 Ni3 C4 74.136 7_565 1_555 9_666 yes C4 Ni3 C4 38.312 8_555 1_555 9_666 yes W1 Ni3 C4 74.227 1_555 1_555 10_566 yes W1 Ni3 C4 105.773 5_655 1_555 10_566 yes F4_ax Ni3 C4 74.227 1_555 1_555 10_566 yes F4_ax Ni3 C4 105.773 13_567 1_555 10_566 yes C4 Ni3 C4 38.312 5_655 1_555 10_566 yes C4 Ni3 C4 114.907 6_665 1_555 10_566 yes C4 Ni3 C4 158.817 7_565 1_555 10_566 yes C4 Ni3 C4 74.136 8_555 1_555 10_566 yes C4 Ni3 C4 85.762 9_666 1_555 10_566 yes W1 Ni3 C4 74.227 1_555 1_555 11_556 yes W1 Ni3 C4 105.773 5_655 1_555 11_556 yes F4_ax Ni3 C4 74.227 1_555 1_555 11_556 yes F4_ax Ni3 C4 105.773 13_567 1_555 11_556 yes C4 Ni3 C4 74.136 5_655 1_555 11_556 yes C4 Ni3 C4 38.312 6_665 1_555 11_556 yes C4 Ni3 C4 114.907 7_565 1_555 11_556 yes C4 Ni3 C4 158.817 8_555 1_555 11_556 yes C4 Ni3 C4 148.453 9_666 1_555 11_556 yes C4 Ni3 C4 85.762 10_566 1_555 11_556 yes W1 Ni3 C4 74.227 1_555 1_555 12_656 yes W1 Ni3 C4 105.773 5_655 1_555 12_656 yes F4_ax Ni3 C4 74.227 1_555 1_555 12_656 yes F4_ax Ni3 C4 105.773 13_567 1_555 12_656 yes C4 Ni3 C4 158.817 5_655 1_555 12_656 yes C4 Ni3 C4 74.136 6_665 1_555 12_656 yes C4 Ni3 C4 38.312 7_565 1_555 12_656 yes C4 Ni3 C4 114.907 8_555 1_555 12_656 yes C4 Ni3 C4 85.762 9_666 1_555 12_656 yes C4 Ni3 C4 148.453 10_566 1_555 12_656 yes C4 Ni3 C4 85.762 11_556 1_555 12_656 yes W1 Ni3 N5 90 1_555 1_555 1_555 yes W1 Ni3 N5 90 5_655 1_555 1_555 yes F4_ax Ni3 N5 90 1_555 1_555 1_555 yes F4_ax Ni3 N5 90 13_567 1_555 1_555 yes C4 Ni3 N5 160.844 5_655 1_555 1_555 yes C4 Ni3 N5 79.409 6_665 1_555 1_555 yes C4 Ni3 N5 19.156 7_565 1_555 1_555 yes C4 Ni3 N5 100.591 8_555 1_555 1_555 yes C4 Ni3 N5 79.409 9_666 1_555 1_555 yes C4 Ni3 N5 160.844 10_566 1_555 1_555 yes C4 Ni3 N5 100.591 11_556 1_555 1_555 yes C4 Ni3 N5 19.156 12_656 1_555 1_555 yes W1 Ni3 N5 90 1_555 1_555 2_655 yes W1 Ni3 N5 90 5_655 1_555 2_655 yes F4_ax Ni3 N5 90 1_555 1_555 2_655 yes F4_ax Ni3 N5 90 13_567 1_555 2_655 yes C4 Ni3 N5 100.591 5_655 1_555 2_655 yes C4 Ni3 N5 160.844 6_665 1_555 2_655 yes C4 Ni3 N5 79.409 7_565 1_555 2_655 yes C4 Ni3 N5 19.156 8_555 1_555 2_655 yes C4 Ni3 N5 19.156 9_666 1_555 2_655 yes C4 Ni3 N5 79.409 10_566 1_555 2_655 yes C4 Ni3 N5 160.844 11_556 1_555 2_655 yes C4 Ni3 N5 100.591 12_656 1_555 2_655 yes N5 Ni3 N5 90 1_555 1_555 2_655 yes W1 Ni3 N5 90 1_555 1_555 3_665 yes W1 Ni3 N5 90 5_655 1_555 3_665 yes F4_ax Ni3 N5 90 1_555 1_555 3_665 yes F4_ax Ni3 N5 90 13_567 1_555 3_665 yes C4 Ni3 N5 19.156 5_655 1_555 3_665 yes C4 Ni3 N5 100.591 6_665 1_555 3_665 yes C4 Ni3 N5 160.844 7_565 1_555 3_665 yes C4 Ni3 N5 79.409 8_555 1_555 3_665 yes C4 Ni3 N5 100.591 9_666 1_555 3_665 yes C4 Ni3 N5 19.156 10_566 1_555 3_665 yes C4 Ni3 N5 79.409 11_556 1_555 3_665 yes C4 Ni3 N5 160.844 12_656 1_555 3_665 yes N5 Ni3 N5 180 1_555 1_555 3_665 yes N5 Ni3 N5 90 2_655 1_555 3_665 yes W1 Ni3 N5 90 1_555 1_555 4_565 yes W1 Ni3 N5 90 5_655 1_555 4_565 yes F4_ax Ni3 N5 90 1_555 1_555 4_565 yes F4_ax Ni3 N5 90 13_567 1_555 4_565 yes C4 Ni3 N5 79.409 5_655 1_555 4_565 yes C4 Ni3 N5 19.156 6_665 1_555 4_565 yes C4 Ni3 N5 100.591 7_565 1_555 4_565 yes C4 Ni3 N5 160.844 8_555 1_555 4_565 yes C4 Ni3 N5 160.844 9_666 1_555 4_565 yes C4 Ni3 N5 100.591 10_566 1_555 4_565 yes C4 Ni3 N5 19.156 11_556 1_555 4_565 yes C4 Ni3 N5 79.409 12_656 1_555 4_565 yes N5 Ni3 N5 90 1_555 1_555 4_565 yes N5 Ni3 N5 180 2_655 1_555 4_565 yes N5 Ni3 N5 90 3_665 1_555 4_565 yes W1 Ni3 O8_ax 0 1_555 1_555 1_555 yes W1 Ni3 O8_ax 180 5_655 1_555 1_555 yes F4_ax Ni3 O8_ax 0 1_555 1_555 1_555 yes F4_ax Ni3 O8_ax 180 13_567 1_555 1_555 yes C4 Ni3 O8_ax 105.773 5_655 1_555 1_555 yes C4 Ni3 O8_ax 105.773 6_665 1_555 1_555 yes C4 Ni3 O8_ax 105.773 7_565 1_555 1_555 yes C4 Ni3 O8_ax 105.773 8_555 1_555 1_555 yes C4 Ni3 O8_ax 74.227 9_666 1_555 1_555 yes C4 Ni3 O8_ax 74.227 10_566 1_555 1_555 yes C4 Ni3 O8_ax 74.227 11_556 1_555 1_555 yes C4 Ni3 O8_ax 74.227 12_656 1_555 1_555 yes N5 Ni3 O8_ax 90 1_555 1_555 1_555 yes N5 Ni3 O8_ax 90 2_655 1_555 1_555 yes N5 Ni3 O8_ax 90 3_665 1_555 1_555 yes N5 Ni3 O8_ax 90 4_565 1_555 1_555 yes W1 Ni3 O8_ax 180 1_555 1_555 13_567 yes W1 Ni3 O8_ax 0 5_655 1_555 13_567 yes F4_ax Ni3 O8_ax 180 1_555 1_555 13_567 yes F4_ax Ni3 O8_ax 0 13_567 1_555 13_567 yes C4 Ni3 O8_ax 74.227 5_655 1_555 13_567 yes C4 Ni3 O8_ax 74.227 6_665 1_555 13_567 yes C4 Ni3 O8_ax 74.227 7_565 1_555 13_567 yes C4 Ni3 O8_ax 74.227 8_555 1_555 13_567 yes C4 Ni3 O8_ax 105.773 9_666 1_555 13_567 yes C4 Ni3 O8_ax 105.773 10_566 1_555 13_567 yes C4 Ni3 O8_ax 105.773 11_556 1_555 13_567 yes C4 Ni3 O8_ax 105.773 12_656 1_555 13_567 yes N5 Ni3 O8_ax 90 1_555 1_555 13_567 yes N5 Ni3 O8_ax 90 2_655 1_555 13_567 yes N5 Ni3 O8_ax 90 3_665 1_555 13_567 yes N5 Ni3 O8_ax 90 4_565 1_555 13_567 yes O8_ax Ni3 O8_ax 180 1_555 1_555 13_567 yes W1 Ni3 H14 121.558 1_555 1_555 5_655 yes W1 Ni3 H14 58.442 5_655 1_555 5_655 yes F4_ax Ni3 H14 121.558 1_555 1_555 5_655 yes F4_ax Ni3 H14 58.442 13_567 1_555 5_655 yes C4 Ni3 H14 19.599 5_655 1_555 5_655 yes C4 Ni3 H14 71.139 6_665 1_555 5_655 yes C4 Ni3 H14 131.112 7_565 1_555 5_655 yes C4 Ni3 H14 92.22 8_555 1_555 5_655 yes C4 Ni3 H14 127.587 9_666 1_555 5_655 yes C4 Ni3 H14 57.906 10_566 1_555 5_655 yes C4 Ni3 H14 71.009 11_556 1_555 5_655 yes C4 Ni3 H14 144.671 12_656 1_555 5_655 yes N5 Ni3 H14 141.249 1_555 1_555 5_655 yes N5 Ni3 H14 110.082 2_655 1_555 5_655 yes N5 Ni3 H14 38.751 3_665 1_555 5_655 yes N5 Ni3 H14 69.918 4_565 1_555 5_655 yes O8_ax Ni3 H14 121.558 1_555 1_555 5_655 yes O8_ax Ni3 H14 58.442 13_567 1_555 5_655 yes W1 Ni3 H14 121.558 1_555 1_555 6_665 yes W1 Ni3 H14 58.442 5_655 1_555 6_665 yes F4_ax Ni3 H14 121.558 1_555 1_555 6_665 yes F4_ax Ni3 H14 58.442 13_567 1_555 6_665 yes C4 Ni3 H14 92.22 5_655 1_555 6_665 yes C4 Ni3 H14 19.599 6_665 1_555 6_665 yes C4 Ni3 H14 71.139 7_565 1_555 6_665 yes C4 Ni3 H14 131.112 8_555 1_555 6_665 yes C4 Ni3 H14 144.671 9_666 1_555 6_665 yes C4 Ni3 H14 127.587 10_566 1_555 6_665 yes C4 Ni3 H14 57.906 11_556 1_555 6_665 yes C4 Ni3 H14 71.009 12_656 1_555 6_665 yes N5 Ni3 H14 69.918 1_555 1_555 6_665 yes N5 Ni3 H14 141.249 2_655 1_555 6_665 yes N5 Ni3 H14 110.082 3_665 1_555 6_665 yes N5 Ni3 H14 38.751 4_565 1_555 6_665 yes O8_ax Ni3 H14 121.558 1_555 1_555 6_665 yes O8_ax Ni3 H14 58.442 13_567 1_555 6_665 yes H14 Ni3 H14 74.103 5_655 1_555 6_665 yes W1 Ni3 H14 121.558 1_555 1_555 7_565 yes W1 Ni3 H14 58.442 5_655 1_555 7_565 yes F4_ax Ni3 H14 121.558 1_555 1_555 7_565 yes F4_ax Ni3 H14 58.442 13_567 1_555 7_565 yes C4 Ni3 H14 131.112 5_655 1_555 7_565 yes C4 Ni3 H14 92.22 6_665 1_555 7_565 yes C4 Ni3 H14 19.599 7_565 1_555 7_565 yes C4 Ni3 H14 71.139 8_555 1_555 7_565 yes C4 Ni3 H14 71.009 9_666 1_555 7_565 yes C4 Ni3 H14 144.671 10_566 1_555 7_565 yes C4 Ni3 H14 127.587 11_556 1_555 7_565 yes C4 Ni3 H14 57.906 12_656 1_555 7_565 yes N5 Ni3 H14 38.751 1_555 1_555 7_565 yes N5 Ni3 H14 69.918 2_655 1_555 7_565 yes N5 Ni3 H14 141.249 3_665 1_555 7_565 yes N5 Ni3 H14 110.082 4_565 1_555 7_565 yes O8_ax Ni3 H14 121.558 1_555 1_555 7_565 yes O8_ax Ni3 H14 58.442 13_567 1_555 7_565 yes H14 Ni3 H14 116.884 5_655 1_555 7_565 yes H14 Ni3 H14 74.103 6_665 1_555 7_565 yes W1 Ni3 H14 121.558 1_555 1_555 8_555 yes W1 Ni3 H14 58.442 5_655 1_555 8_555 yes F4_ax Ni3 H14 121.558 1_555 1_555 8_555 yes F4_ax Ni3 H14 58.442 13_567 1_555 8_555 yes C4 Ni3 H14 71.139 5_655 1_555 8_555 yes C4 Ni3 H14 131.112 6_665 1_555 8_555 yes C4 Ni3 H14 92.22 7_565 1_555 8_555 yes C4 Ni3 H14 19.599 8_555 1_555 8_555 yes C4 Ni3 H14 57.906 9_666 1_555 8_555 yes C4 Ni3 H14 71.009 10_566 1_555 8_555 yes C4 Ni3 H14 144.671 11_556 1_555 8_555 yes C4 Ni3 H14 127.587 12_656 1_555 8_555 yes N5 Ni3 H14 110.082 1_555 1_555 8_555 yes N5 Ni3 H14 38.751 2_655 1_555 8_555 yes N5 Ni3 H14 69.918 3_665 1_555 8_555 yes N5 Ni3 H14 141.249 4_565 1_555 8_555 yes O8_ax Ni3 H14 121.558 1_555 1_555 8_555 yes O8_ax Ni3 H14 58.442 13_567 1_555 8_555 yes H14 Ni3 H14 74.103 5_655 1_555 8_555 yes H14 Ni3 H14 116.884 6_665 1_555 8_555 yes H14 Ni3 H14 74.103 7_565 1_555 8_555 yes W1 Ni3 H14 58.442 1_555 1_555 9_666 yes W1 Ni3 H14 121.558 5_655 1_555 9_666 yes F4_ax Ni3 H14 58.442 1_555 1_555 9_666 yes F4_ax Ni3 H14 121.558 13_567 1_555 9_666 yes C4 Ni3 H14 127.587 5_655 1_555 9_666 yes C4 Ni3 H14 144.671 6_665 1_555 9_666 yes C4 Ni3 H14 71.009 7_565 1_555 9_666 yes C4 Ni3 H14 57.906 8_555 1_555 9_666 yes C4 Ni3 H14 19.599 9_666 1_555 9_666 yes C4 Ni3 H14 92.22 10_566 1_555 9_666 yes C4 Ni3 H14 131.112 11_556 1_555 9_666 yes C4 Ni3 H14 71.139 12_656 1_555 9_666 yes N5 Ni3 H14 69.918 1_555 1_555 9_666 yes N5 Ni3 H14 38.751 2_655 1_555 9_666 yes N5 Ni3 H14 110.082 3_665 1_555 9_666 yes N5 Ni3 H14 141.249 4_565 1_555 9_666 yes O8_ax Ni3 H14 58.442 1_555 1_555 9_666 yes O8_ax Ni3 H14 121.558 13_567 1_555 9_666 yes H14 Ni3 H14 144.043 5_655 1_555 9_666 yes H14 Ni3 H14 139.836 6_665 1_555 9_666 yes H14 Ni3 H14 74.832 7_565 1_555 9_666 yes H14 Ni3 H14 77.503 8_555 1_555 9_666 yes W1 Ni3 H14 58.442 1_555 1_555 10_566 yes W1 Ni3 H14 121.558 5_655 1_555 10_566 yes F4_ax Ni3 H14 58.442 1_555 1_555 10_566 yes F4_ax Ni3 H14 121.558 13_567 1_555 10_566 yes C4 Ni3 H14 57.906 5_655 1_555 10_566 yes C4 Ni3 H14 127.587 6_665 1_555 10_566 yes C4 Ni3 H14 144.671 7_565 1_555 10_566 yes C4 Ni3 H14 71.009 8_555 1_555 10_566 yes C4 Ni3 H14 71.139 9_666 1_555 10_566 yes C4 Ni3 H14 19.599 10_566 1_555 10_566 yes C4 Ni3 H14 92.22 11_556 1_555 10_566 yes C4 Ni3 H14 131.112 12_656 1_555 10_566 yes N5 Ni3 H14 141.249 1_555 1_555 10_566 yes N5 Ni3 H14 69.918 2_655 1_555 10_566 yes N5 Ni3 H14 38.751 3_665 1_555 10_566 yes N5 Ni3 H14 110.082 4_565 1_555 10_566 yes O8_ax Ni3 H14 58.442 1_555 1_555 10_566 yes O8_ax Ni3 H14 121.558 13_567 1_555 10_566 yes H14 Ni3 H14 77.503 5_655 1_555 10_566 yes H14 Ni3 H14 144.043 6_665 1_555 10_566 yes H14 Ni3 H14 139.836 7_565 1_555 10_566 yes H14 Ni3 H14 74.832 8_555 1_555 10_566 yes H14 Ni3 H14 74.103 9_666 1_555 10_566 yes W1 Ni3 H14 58.442 1_555 1_555 11_556 yes W1 Ni3 H14 121.558 5_655 1_555 11_556 yes F4_ax Ni3 H14 58.442 1_555 1_555 11_556 yes F4_ax Ni3 H14 121.558 13_567 1_555 11_556 yes C4 Ni3 H14 71.009 5_655 1_555 11_556 yes C4 Ni3 H14 57.906 6_665 1_555 11_556 yes C4 Ni3 H14 127.587 7_565 1_555 11_556 yes C4 Ni3 H14 144.671 8_555 1_555 11_556 yes C4 Ni3 H14 131.112 9_666 1_555 11_556 yes C4 Ni3 H14 71.139 10_566 1_555 11_556 yes C4 Ni3 H14 19.599 11_556 1_555 11_556 yes C4 Ni3 H14 92.22 12_656 1_555 11_556 yes N5 Ni3 H14 110.082 1_555 1_555 11_556 yes N5 Ni3 H14 141.249 2_655 1_555 11_556 yes N5 Ni3 H14 69.918 3_665 1_555 11_556 yes N5 Ni3 H14 38.751 4_565 1_555 11_556 yes O8_ax Ni3 H14 58.442 1_555 1_555 11_556 yes O8_ax Ni3 H14 121.558 13_567 1_555 11_556 yes H14 Ni3 H14 74.832 5_655 1_555 11_556 yes H14 Ni3 H14 77.503 6_665 1_555 11_556 yes H14 Ni3 H14 144.043 7_565 1_555 11_556 yes H14 Ni3 H14 139.836 8_555 1_555 11_556 yes H14 Ni3 H14 116.884 9_666 1_555 11_556 yes H14 Ni3 H14 74.103 10_566 1_555 11_556 yes W1 Ni3 H14 58.442 1_555 1_555 12_656 yes W1 Ni3 H14 121.558 5_655 1_555 12_656 yes F4_ax Ni3 H14 58.442 1_555 1_555 12_656 yes F4_ax Ni3 H14 121.558 13_567 1_555 12_656 yes C4 Ni3 H14 144.671 5_655 1_555 12_656 yes C4 Ni3 H14 71.009 6_665 1_555 12_656 yes C4 Ni3 H14 57.906 7_565 1_555 12_656 yes C4 Ni3 H14 127.587 8_555 1_555 12_656 yes C4 Ni3 H14 92.22 9_666 1_555 12_656 yes C4 Ni3 H14 131.112 10_566 1_555 12_656 yes C4 Ni3 H14 71.139 11_556 1_555 12_656 yes C4 Ni3 H14 19.599 12_656 1_555 12_656 yes N5 Ni3 H14 38.751 1_555 1_555 12_656 yes N5 Ni3 H14 110.082 2_655 1_555 12_656 yes N5 Ni3 H14 141.249 3_665 1_555 12_656 yes N5 Ni3 H14 69.918 4_565 1_555 12_656 yes O8_ax Ni3 H14 58.442 1_555 1_555 12_656 yes O8_ax Ni3 H14 121.558 13_567 1_555 12_656 yes H14 Ni3 H14 139.836 5_655 1_555 12_656 yes H14 Ni3 H14 74.832 6_665 1_555 12_656 yes H14 Ni3 H14 77.503 7_565 1_555 12_656 yes H14 Ni3 H14 144.043 8_555 1_555 12_656 yes H14 Ni3 H14 74.103 9_666 1_555 12_656 yes H14 Ni3 H14 116.884 10_566 1_555 12_656 yes H14 Ni3 H14 74.103 11_556 1_555 12_656 yes W1 F4_ax Ni3 180 1_555 1_555 1_555 yes W1 F4_ax N5 132.503 1_555 1_555 1_555 yes Ni3 F4_ax N5 47.497 1_555 1_555 1_555 yes W1 F4_ax N5 132.503 1_555 1_555 2_655 yes Ni3 F4_ax N5 47.497 1_555 1_555 2_655 yes N5 F4_ax N5 62.84 1_555 1_555 2_655 yes W1 F4_ax N5 132.503 1_555 1_555 3_665 yes Ni3 F4_ax N5 47.497 1_555 1_555 3_665 yes N5 F4_ax N5 94.993 1_555 1_555 3_665 yes N5 F4_ax N5 62.84 2_655 1_555 3_665 yes W1 F4_ax N5 132.503 1_555 1_555 4_565 yes Ni3 F4_ax N5 47.497 1_555 1_555 4_565 yes N5 F4_ax N5 62.84 1_555 1_555 4_565 yes N5 F4_ax N5 94.993 2_655 1_555 4_565 yes N5 F4_ax N5 62.84 3_665 1_555 4_565 yes W1 F4_ax F7_eq 45.808 1_555 1_555 1_555 yes Ni3 F4_ax F7_eq 134.192 1_555 1_555 1_555 yes N5 F4_ax F7_eq 144.494 1_555 1_555 1_555 yes N5 F4_ax F7_eq 93.947 2_655 1_555 1_555 yes N5 F4_ax F7_eq 97.346 3_665 1_555 1_555 yes N5 F4_ax F7_eq 150.82 4_565 1_555 1_555 yes W1 F4_ax F7_eq 45.808 1_555 1_555 2_655 yes Ni3 F4_ax F7_eq 134.192 1_555 1_555 2_655 yes N5 F4_ax F7_eq 150.82 1_555 1_555 2_655 yes N5 F4_ax F7_eq 144.494 2_655 1_555 2_655 yes N5 F4_ax F7_eq 93.947 3_665 1_555 2_655 yes N5 F4_ax F7_eq 97.346 4_565 1_555 2_655 yes F7_eq F4_ax F7_eq 60.928 1_555 1_555 2_655 yes W1 F4_ax F7_eq 45.808 1_555 1_555 3_665 yes Ni3 F4_ax F7_eq 134.192 1_555 1_555 3_665 yes N5 F4_ax F7_eq 97.346 1_555 1_555 3_665 yes N5 F4_ax F7_eq 150.82 2_655 1_555 3_665 yes N5 F4_ax F7_eq 144.494 3_665 1_555 3_665 yes N5 F4_ax F7_eq 93.947 4_565 1_555 3_665 yes F7_eq F4_ax F7_eq 91.615 1_555 1_555 3_665 yes F7_eq F4_ax F7_eq 60.928 2_655 1_555 3_665 yes W1 F4_ax F7_eq 45.808 1_555 1_555 4_565 yes Ni3 F4_ax F7_eq 134.192 1_555 1_555 4_565 yes N5 F4_ax F7_eq 93.947 1_555 1_555 4_565 yes N5 F4_ax F7_eq 97.346 2_655 1_555 4_565 yes N5 F4_ax F7_eq 150.82 3_665 1_555 4_565 yes N5 F4_ax F7_eq 144.494 4_565 1_555 4_565 yes F7_eq F4_ax F7_eq 60.928 1_555 1_555 4_565 yes F7_eq F4_ax F7_eq 91.615 2_655 1_555 4_565 yes F7_eq F4_ax F7_eq 60.928 3_665 1_555 4_565 yes W1 F4_ax F10_eq 46.916 1_555 1_555 1_555 yes Ni3 F4_ax F10_eq 133.084 1_555 1_555 1_555 yes N5 F4_ax F10_eq 170.748 1_555 1_555 1_555 yes N5 F4_ax F10_eq 110.126 2_655 1_555 1_555 yes N5 F4_ax F10_eq 86.332 3_665 1_555 1_555 yes N5 F4_ax F10_eq 125.375 4_565 1_555 1_555 yes F7_eq F4_ax F10_eq 26.526 1_555 1_555 1_555 yes F7_eq F4_ax F10_eq 37.738 2_655 1_555 1_555 yes F7_eq F4_ax F10_eq 86.7 3_665 1_555 1_555 yes F7_eq F4_ax F10_eq 80.707 4_565 1_555 1_555 yes W1 F4_ax F10_eq 46.916 1_555 1_555 2_655 yes Ni3 F4_ax F10_eq 133.084 1_555 1_555 2_655 yes N5 F4_ax F10_eq 125.375 1_555 1_555 2_655 yes N5 F4_ax F10_eq 170.748 2_655 1_555 2_655 yes N5 F4_ax F10_eq 110.126 3_665 1_555 2_655 yes N5 F4_ax F10_eq 86.332 4_565 1_555 2_655 yes F7_eq F4_ax F10_eq 80.707 1_555 1_555 2_655 yes F7_eq F4_ax F10_eq 26.526 2_655 1_555 2_655 yes F7_eq F4_ax F10_eq 37.738 3_665 1_555 2_655 yes F7_eq F4_ax F10_eq 86.7 4_565 1_555 2_655 yes F10_eq F4_ax F10_eq 62.187 1_555 1_555 2_655 yes W1 F4_ax F10_eq 46.916 1_555 1_555 3_665 yes Ni3 F4_ax F10_eq 133.084 1_555 1_555 3_665 yes N5 F4_ax F10_eq 86.332 1_555 1_555 3_665 yes N5 F4_ax F10_eq 125.375 2_655 1_555 3_665 yes N5 F4_ax F10_eq 170.748 3_665 1_555 3_665 yes N5 F4_ax F10_eq 110.126 4_565 1_555 3_665 yes F7_eq F4_ax F10_eq 86.7 1_555 1_555 3_665 yes F7_eq F4_ax F10_eq 80.707 2_655 1_555 3_665 yes F7_eq F4_ax F10_eq 26.526 3_665 1_555 3_665 yes F7_eq F4_ax F10_eq 37.738 4_565 1_555 3_665 yes F10_eq F4_ax F10_eq 93.832 1_555 1_555 3_665 yes F10_eq F4_ax F10_eq 62.187 2_655 1_555 3_665 yes W1 F4_ax F10_eq 46.916 1_555 1_555 4_565 yes Ni3 F4_ax F10_eq 133.084 1_555 1_555 4_565 yes N5 F4_ax F10_eq 110.126 1_555 1_555 4_565 yes N5 F4_ax F10_eq 86.332 2_655 1_555 4_565 yes N5 F4_ax F10_eq 125.375 3_665 1_555 4_565 yes N5 F4_ax F10_eq 170.748 4_565 1_555 4_565 yes F7_eq F4_ax F10_eq 37.738 1_555 1_555 4_565 yes F7_eq F4_ax F10_eq 86.7 2_655 1_555 4_565 yes F7_eq F4_ax F10_eq 80.707 3_665 1_555 4_565 yes F7_eq F4_ax F10_eq 26.526 4_565 1_555 4_565 yes F10_eq F4_ax F10_eq 62.187 1_555 1_555 4_565 yes F10_eq F4_ax F10_eq 93.832 2_655 1_555 4_565 yes F10_eq F4_ax F10_eq 62.187 3_665 1_555 4_565 yes W1 F4_ax O11_eq 42.105 1_555 1_555 1_555 yes Ni3 F4_ax O11_eq 137.895 1_555 1_555 1_555 yes N5 F4_ax O11_eq 168.998 1_555 1_555 1_555 yes N5 F4_ax O11_eq 112.621 2_655 1_555 1_555 yes N5 F4_ax O11_eq 91.198 3_665 1_555 1_555 yes N5 F4_ax O11_eq 128.162 4_565 1_555 1_555 yes F7_eq F4_ax O11_eq 24.95 1_555 1_555 1_555 yes F7_eq F4_ax O11_eq 36.971 2_655 1_555 1_555 yes F7_eq F4_ax O11_eq 82.666 3_665 1_555 1_555 yes F7_eq F4_ax O11_eq 76.385 4_565 1_555 1_555 yes F10_eq F4_ax O11_eq 4.867 1_555 1_555 1_555 yes F10_eq F4_ax O11_eq 60.146 2_655 1_555 1_555 yes F10_eq F4_ax O11_eq 89.016 3_665 1_555 1_555 yes F10_eq F4_ax O11_eq 58.951 4_565 1_555 1_555 yes W1 F4_ax O11_eq 42.105 1_555 1_555 2_655 yes Ni3 F4_ax O11_eq 137.895 1_555 1_555 2_655 yes N5 F4_ax O11_eq 128.162 1_555 1_555 2_655 yes N5 F4_ax O11_eq 168.998 2_655 1_555 2_655 yes N5 F4_ax O11_eq 112.621 3_665 1_555 2_655 yes N5 F4_ax O11_eq 91.198 4_565 1_555 2_655 yes F7_eq F4_ax O11_eq 76.385 1_555 1_555 2_655 yes F7_eq F4_ax O11_eq 24.95 2_655 1_555 2_655 yes F7_eq F4_ax O11_eq 36.971 3_665 1_555 2_655 yes F7_eq F4_ax O11_eq 82.666 4_565 1_555 2_655 yes F10_eq F4_ax O11_eq 58.951 1_555 1_555 2_655 yes F10_eq F4_ax O11_eq 4.867 2_655 1_555 2_655 yes F10_eq F4_ax O11_eq 60.146 3_665 1_555 2_655 yes F10_eq F4_ax O11_eq 89.016 4_565 1_555 2_655 yes O11_eq F4_ax O11_eq 56.603 1_555 1_555 2_655 yes W1 F4_ax O11_eq 42.105 1_555 1_555 3_665 yes Ni3 F4_ax O11_eq 137.895 1_555 1_555 3_665 yes N5 F4_ax O11_eq 91.198 1_555 1_555 3_665 yes N5 F4_ax O11_eq 128.162 2_655 1_555 3_665 yes N5 F4_ax O11_eq 168.998 3_665 1_555 3_665 yes N5 F4_ax O11_eq 112.621 4_565 1_555 3_665 yes F7_eq F4_ax O11_eq 82.666 1_555 1_555 3_665 yes F7_eq F4_ax O11_eq 76.385 2_655 1_555 3_665 yes F7_eq F4_ax O11_eq 24.95 3_665 1_555 3_665 yes F7_eq F4_ax O11_eq 36.971 4_565 1_555 3_665 yes F10_eq F4_ax O11_eq 89.016 1_555 1_555 3_665 yes F10_eq F4_ax O11_eq 58.951 2_655 1_555 3_665 yes F10_eq F4_ax O11_eq 4.867 3_665 1_555 3_665 yes F10_eq F4_ax O11_eq 60.146 4_565 1_555 3_665 yes O11_eq F4_ax O11_eq 84.21 1_555 1_555 3_665 yes O11_eq F4_ax O11_eq 56.603 2_655 1_555 3_665 yes W1 F4_ax O11_eq 42.105 1_555 1_555 4_565 yes Ni3 F4_ax O11_eq 137.895 1_555 1_555 4_565 yes N5 F4_ax O11_eq 112.621 1_555 1_555 4_565 yes N5 F4_ax O11_eq 91.198 2_655 1_555 4_565 yes N5 F4_ax O11_eq 128.162 3_665 1_555 4_565 yes N5 F4_ax O11_eq 168.998 4_565 1_555 4_565 yes F7_eq F4_ax O11_eq 36.971 1_555 1_555 4_565 yes F7_eq F4_ax O11_eq 82.666 2_655 1_555 4_565 yes F7_eq F4_ax O11_eq 76.385 3_665 1_555 4_565 yes F7_eq F4_ax O11_eq 24.95 4_565 1_555 4_565 yes F10_eq F4_ax O11_eq 60.146 1_555 1_555 4_565 yes F10_eq F4_ax O11_eq 89.016 2_655 1_555 4_565 yes F10_eq F4_ax O11_eq 58.951 3_665 1_555 4_565 yes F10_eq F4_ax O11_eq 4.867 4_565 1_555 4_565 yes O11_eq F4_ax O11_eq 56.603 1_555 1_555 4_565 yes O11_eq F4_ax O11_eq 84.21 2_655 1_555 4_565 yes O11_eq F4_ax O11_eq 56.603 3_665 1_555 4_565 yes W1 F4_ax O12_eq 41.652 1_555 1_555 1_555 yes Ni3 F4_ax O12_eq 138.348 1_555 1_555 1_555 yes N5 F4_ax O12_eq 147.701 1_555 1_555 1_555 yes N5 F4_ax O12_eq 98.769 2_655 1_555 1_555 yes N5 F4_ax O12_eq 99.462 3_665 1_555 1_555 yes N5 F4_ax O12_eq 149.005 4_565 1_555 1_555 yes F7_eq F4_ax O12_eq 4.822 1_555 1_555 1_555 yes F7_eq F4_ax O12_eq 56.613 2_655 1_555 1_555 yes F7_eq F4_ax O12_eq 87.407 3_665 1_555 1_555 yes F7_eq F4_ax O12_eq 60.566 4_565 1_555 1_555 yes F10_eq F4_ax O12_eq 23.701 1_555 1_555 1_555 yes F10_eq F4_ax O12_eq 75.922 2_655 1_555 1_555 yes F10_eq F4_ax O12_eq 83.965 3_665 1_555 1_555 yes F10_eq F4_ax O12_eq 38.965 4_565 1_555 1_555 yes O11_eq F4_ax O12_eq 21.433 1_555 1_555 1_555 yes O11_eq F4_ax O12_eq 71.58 2_655 1_555 1_555 yes O11_eq F4_ax O12_eq 79.754 3_665 1_555 1_555 yes O11_eq F4_ax O12_eq 37.558 4_565 1_555 1_555 yes W1 F4_ax O12_eq 41.652 1_555 1_555 2_655 yes Ni3 F4_ax O12_eq 138.348 1_555 1_555 2_655 yes N5 F4_ax O12_eq 149.005 1_555 1_555 2_655 yes N5 F4_ax O12_eq 147.701 2_655 1_555 2_655 yes N5 F4_ax O12_eq 98.769 3_665 1_555 2_655 yes N5 F4_ax O12_eq 99.462 4_565 1_555 2_655 yes F7_eq F4_ax O12_eq 60.566 1_555 1_555 2_655 yes F7_eq F4_ax O12_eq 4.822 2_655 1_555 2_655 yes F7_eq F4_ax O12_eq 56.613 3_665 1_555 2_655 yes F7_eq F4_ax O12_eq 87.407 4_565 1_555 2_655 yes F10_eq F4_ax O12_eq 38.965 1_555 1_555 2_655 yes F10_eq F4_ax O12_eq 23.701 2_655 1_555 2_655 yes F10_eq F4_ax O12_eq 75.922 3_665 1_555 2_655 yes F10_eq F4_ax O12_eq 83.965 4_565 1_555 2_655 yes O11_eq F4_ax O12_eq 37.558 1_555 1_555 2_655 yes O11_eq F4_ax O12_eq 21.433 2_655 1_555 2_655 yes O11_eq F4_ax O12_eq 71.58 3_665 1_555 2_655 yes O11_eq F4_ax O12_eq 79.754 4_565 1_555 2_655 yes O12_eq F4_ax O12_eq 56.061 1_555 1_555 2_655 yes W1 F4_ax O12_eq 41.652 1_555 1_555 3_665 yes Ni3 F4_ax O12_eq 138.348 1_555 1_555 3_665 yes N5 F4_ax O12_eq 99.462 1_555 1_555 3_665 yes N5 F4_ax O12_eq 149.005 2_655 1_555 3_665 yes N5 F4_ax O12_eq 147.701 3_665 1_555 3_665 yes N5 F4_ax O12_eq 98.769 4_565 1_555 3_665 yes F7_eq F4_ax O12_eq 87.407 1_555 1_555 3_665 yes F7_eq F4_ax O12_eq 60.566 2_655 1_555 3_665 yes F7_eq F4_ax O12_eq 4.822 3_665 1_555 3_665 yes F7_eq F4_ax O12_eq 56.613 4_565 1_555 3_665 yes F10_eq F4_ax O12_eq 83.965 1_555 1_555 3_665 yes F10_eq F4_ax O12_eq 38.965 2_655 1_555 3_665 yes F10_eq F4_ax O12_eq 23.701 3_665 1_555 3_665 yes F10_eq F4_ax O12_eq 75.922 4_565 1_555 3_665 yes O11_eq F4_ax O12_eq 79.754 1_555 1_555 3_665 yes O11_eq F4_ax O12_eq 37.558 2_655 1_555 3_665 yes O11_eq F4_ax O12_eq 21.433 3_665 1_555 3_665 yes O11_eq F4_ax O12_eq 71.58 4_565 1_555 3_665 yes O12_eq F4_ax O12_eq 83.303 1_555 1_555 3_665 yes O12_eq F4_ax O12_eq 56.061 2_655 1_555 3_665 yes W1 F4_ax O12_eq 41.652 1_555 1_555 4_565 yes Ni3 F4_ax O12_eq 138.348 1_555 1_555 4_565 yes N5 F4_ax O12_eq 98.769 1_555 1_555 4_565 yes N5 F4_ax O12_eq 99.462 2_655 1_555 4_565 yes N5 F4_ax O12_eq 149.005 3_665 1_555 4_565 yes N5 F4_ax O12_eq 147.701 4_565 1_555 4_565 yes F7_eq F4_ax O12_eq 56.613 1_555 1_555 4_565 yes F7_eq F4_ax O12_eq 87.407 2_655 1_555 4_565 yes F7_eq F4_ax O12_eq 60.566 3_665 1_555 4_565 yes F7_eq F4_ax O12_eq 4.822 4_565 1_555 4_565 yes F10_eq F4_ax O12_eq 75.922 1_555 1_555 4_565 yes F10_eq F4_ax O12_eq 83.965 2_655 1_555 4_565 yes F10_eq F4_ax O12_eq 38.965 3_665 1_555 4_565 yes F10_eq F4_ax O12_eq 23.701 4_565 1_555 4_565 yes O11_eq F4_ax O12_eq 71.58 1_555 1_555 4_565 yes O11_eq F4_ax O12_eq 79.754 2_655 1_555 4_565 yes O11_eq F4_ax O12_eq 37.558 3_665 1_555 4_565 yes O11_eq F4_ax O12_eq 21.433 4_565 1_555 4_565 yes O12_eq F4_ax O12_eq 56.061 1_555 1_555 4_565 yes O12_eq F4_ax O12_eq 83.303 2_655 1_555 4_565 yes O12_eq F4_ax O12_eq 56.061 3_665 1_555 4_565 yes W1 F4_ax H14 98.714 1_555 1_555 9_666 yes Ni3 F4_ax H14 81.286 1_555 1_555 9_666 yes N5 F4_ax H14 66.671 1_555 1_555 9_666 yes N5 F4_ax H14 39.708 2_655 1_555 9_666 yes N5 F4_ax H14 101.028 3_665 1_555 9_666 yes N5 F4_ax H14 124.374 4_565 1_555 9_666 yes F7_eq F4_ax H14 78.318 1_555 1_555 9_666 yes F7_eq F4_ax H14 138.062 2_655 1_555 9_666 yes F7_eq F4_ax H14 114.437 3_665 1_555 9_666 yes F7_eq F4_ax H14 57.815 4_565 1_555 9_666 yes F10_eq F4_ax H14 104.082 1_555 1_555 9_666 yes F10_eq F4_ax H14 144.266 2_655 1_555 9_666 yes F10_eq F4_ax H14 87.918 3_665 1_555 9_666 yes F10_eq F4_ax H14 52.788 4_565 1_555 9_666 yes O11_eq F4_ax H14 103.227 1_555 1_555 9_666 yes O11_eq F4_ax H14 139.894 2_655 1_555 9_666 yes O11_eq F4_ax H14 89.771 3_665 1_555 9_666 yes O11_eq F4_ax H14 57.313 4_565 1_555 9_666 yes O12_eq F4_ax H14 82.226 1_555 1_555 9_666 yes O12_eq F4_ax H14 136.164 2_655 1_555 9_666 yes O12_eq F4_ax H14 111.203 3_665 1_555 9_666 yes O12_eq F4_ax H14 60.336 4_565 1_555 9_666 yes W1 F4_ax H14 98.714 1_555 1_555 10_566 yes Ni3 F4_ax H14 81.286 1_555 1_555 10_566 yes N5 F4_ax H14 124.374 1_555 1_555 10_566 yes N5 F4_ax H14 66.671 2_655 1_555 10_566 yes N5 F4_ax H14 39.708 3_665 1_555 10_566 yes N5 F4_ax H14 101.028 4_565 1_555 10_566 yes F7_eq F4_ax H14 57.815 1_555 1_555 10_566 yes F7_eq F4_ax H14 78.318 2_655 1_555 10_566 yes F7_eq F4_ax H14 138.062 3_665 1_555 10_566 yes F7_eq F4_ax H14 114.437 4_565 1_555 10_566 yes F10_eq F4_ax H14 52.788 1_555 1_555 10_566 yes F10_eq F4_ax H14 104.082 2_655 1_555 10_566 yes F10_eq F4_ax H14 144.266 3_665 1_555 10_566 yes F10_eq F4_ax H14 87.918 4_565 1_555 10_566 yes O11_eq F4_ax H14 57.313 1_555 1_555 10_566 yes O11_eq F4_ax H14 103.227 2_655 1_555 10_566 yes O11_eq F4_ax H14 139.894 3_665 1_555 10_566 yes O11_eq F4_ax H14 89.771 4_565 1_555 10_566 yes O12_eq F4_ax H14 60.336 1_555 1_555 10_566 yes O12_eq F4_ax H14 82.226 2_655 1_555 10_566 yes O12_eq F4_ax H14 136.164 3_665 1_555 10_566 yes O12_eq F4_ax H14 111.203 4_565 1_555 10_566 yes H14 F4_ax H14 88.685 9_666 1_555 10_566 yes W1 F4_ax H14 98.714 1_555 1_555 11_556 yes Ni3 F4_ax H14 81.286 1_555 1_555 11_556 yes N5 F4_ax H14 101.028 1_555 1_555 11_556 yes N5 F4_ax H14 124.374 2_655 1_555 11_556 yes N5 F4_ax H14 66.671 3_665 1_555 11_556 yes N5 F4_ax H14 39.708 4_565 1_555 11_556 yes F7_eq F4_ax H14 114.437 1_555 1_555 11_556 yes F7_eq F4_ax H14 57.815 2_655 1_555 11_556 yes F7_eq F4_ax H14 78.318 3_665 1_555 11_556 yes F7_eq F4_ax H14 138.062 4_565 1_555 11_556 yes F10_eq F4_ax H14 87.918 1_555 1_555 11_556 yes F10_eq F4_ax H14 52.788 2_655 1_555 11_556 yes F10_eq F4_ax H14 104.082 3_665 1_555 11_556 yes F10_eq F4_ax H14 144.266 4_565 1_555 11_556 yes O11_eq F4_ax H14 89.771 1_555 1_555 11_556 yes O11_eq F4_ax H14 57.313 2_655 1_555 11_556 yes O11_eq F4_ax H14 103.227 3_665 1_555 11_556 yes O11_eq F4_ax H14 139.894 4_565 1_555 11_556 yes O12_eq F4_ax H14 111.203 1_555 1_555 11_556 yes O12_eq F4_ax H14 60.336 2_655 1_555 11_556 yes O12_eq F4_ax H14 82.226 3_665 1_555 11_556 yes O12_eq F4_ax H14 136.164 4_565 1_555 11_556 yes H14 F4_ax H14 162.572 9_666 1_555 11_556 yes H14 F4_ax H14 88.685 10_566 1_555 11_556 yes W1 F4_ax H14 98.714 1_555 1_555 12_656 yes Ni3 F4_ax H14 81.286 1_555 1_555 12_656 yes N5 F4_ax H14 39.708 1_555 1_555 12_656 yes N5 F4_ax H14 101.028 2_655 1_555 12_656 yes N5 F4_ax H14 124.374 3_665 1_555 12_656 yes N5 F4_ax H14 66.671 4_565 1_555 12_656 yes F7_eq F4_ax H14 138.062 1_555 1_555 12_656 yes F7_eq F4_ax H14 114.437 2_655 1_555 12_656 yes F7_eq F4_ax H14 57.815 3_665 1_555 12_656 yes F7_eq F4_ax H14 78.318 4_565 1_555 12_656 yes F10_eq F4_ax H14 144.266 1_555 1_555 12_656 yes F10_eq F4_ax H14 87.918 2_655 1_555 12_656 yes F10_eq F4_ax H14 52.788 3_665 1_555 12_656 yes F10_eq F4_ax H14 104.082 4_565 1_555 12_656 yes O11_eq F4_ax H14 139.894 1_555 1_555 12_656 yes O11_eq F4_ax H14 89.771 2_655 1_555 12_656 yes O11_eq F4_ax H14 57.313 3_665 1_555 12_656 yes O11_eq F4_ax H14 103.227 4_565 1_555 12_656 yes O12_eq F4_ax H14 136.164 1_555 1_555 12_656 yes O12_eq F4_ax H14 111.203 2_655 1_555 12_656 yes O12_eq F4_ax H14 60.336 3_665 1_555 12_656 yes O12_eq F4_ax H14 82.226 4_565 1_555 12_656 yes H14 F4_ax H14 88.685 9_666 1_555 12_656 yes H14 F4_ax H14 162.572 10_566 1_555 12_656 yes H14 F4_ax H14 88.685 11_556 1_555 12_656 yes Ni3 C4 C4 70.844 5_654 1_555 16_666 yes Ni3 C4 C4 160.844 5_654 1_555 24_454 yes C4 C4 C4 90 16_666 1_555 24_454 yes Ni3 C4 C4 107.423 5_654 1_555 25_565 yes C4 C4 C4 36.579 16_666 1_555 25_565 yes C4 C4 C4 53.421 24_454 1_555 25_565 yes Ni3 C4 N5 37.557 5_654 1_555 7_564 yes C4 C4 N5 33.287 16_666 1_555 7_564 yes C4 C4 N5 123.287 24_454 1_555 7_564 yes C4 C4 N5 69.866 25_565 1_555 7_564 yes Ni3 C4 N5 135.806 5_654 1_555 18_554 yes C4 C4 N5 64.962 16_666 1_555 18_554 yes C4 C4 N5 25.038 24_454 1_555 18_554 yes C4 C4 N5 28.382 25_565 1_555 18_554 yes N5 C4 N5 98.249 7_564 1_555 18_554 yes Ni3 C4 H14 83.781 5_654 1_555 1_555 yes C4 C4 H14 154.583 16_666 1_555 1_555 yes C4 C4 H14 115.368 24_454 1_555 1_555 yes C4 C4 H14 168.702 25_565 1_555 1_555 yes N5 C4 H14 121.324 7_564 1_555 1_555 yes N5 C4 H14 140.392 18_554 1_555 1_555 yes Ni3 C4 H14 172.986 5_654 1_555 24_454 yes C4 C4 H14 116.131 16_666 1_555 24_454 yes C4 C4 H14 26.142 24_454 1_555 24_454 yes C4 C4 H14 79.555 25_565 1_555 24_454 yes N5 C4 H14 149.413 7_564 1_555 24_454 yes N5 C4 H14 51.175 18_554 1_555 24_454 yes H14 C4 H14 89.226 1_555 1_555 24_454 yes Ni3 N5 F4_ax 42.503 1_555 1_555 1_555 yes Ni3 N5 F4_ax 42.503 1_555 1_555 13_567 yes F4_ax N5 F4_ax 85.007 1_555 1_555 13_567 yes Ni3 N5 C4 123.287 1_555 1_555 7_565 yes F4_ax N5 C4 150.749 1_555 1_555 7_565 yes F4_ax N5 C4 86.374 13_567 1_555 7_565 yes Ni3 N5 C4 123.287 1_555 1_555 12_656 yes F4_ax N5 C4 86.374 1_555 1_555 12_656 yes F4_ax N5 C4 150.749 13_567 1_555 12_656 yes C4 N5 C4 113.426 7_565 1_555 12_656 yes Ni3 N5 C4 154.962 1_555 1_555 20_455 yes F4_ax N5 C4 154.801 1_555 1_555 20_455 yes F4_ax N5 C4 115.536 13_567 1_555 20_455 yes C4 N5 C4 31.675 7_565 1_555 20_455 yes C4 N5 C4 81.751 12_656 1_555 20_455 yes Ni3 N5 C4 154.962 1_555 1_555 31_546 yes F4_ax N5 C4 115.536 1_555 1_555 31_546 yes F4_ax N5 C4 154.801 13_567 1_555 31_546 yes C4 N5 C4 81.751 7_565 1_555 31_546 yes C4 N5 C4 31.675 12_656 1_555 31_546 yes C4 N5 C4 50.077 20_455 1_555 31_546 yes Ni3 N5 H14 96.044 1_555 1_555 7_565 yes F4_ax N5 H14 129.747 1_555 1_555 7_565 yes F4_ax N5 H14 61.044 13_567 1_555 7_565 yes C4 N5 H14 27.253 7_565 1_555 7_565 yes C4 N5 H14 140.662 12_656 1_555 7_565 yes C4 N5 H14 58.92 20_455 1_555 7_565 yes C4 N5 H14 108.992 31_546 1_555 7_565 yes Ni3 N5 H14 96.044 1_555 1_555 12_656 yes F4_ax N5 H14 61.044 1_555 1_555 12_656 yes F4_ax N5 H14 129.747 13_567 1_555 12_656 yes C4 N5 H14 140.662 7_565 1_555 12_656 yes C4 N5 H14 27.253 12_656 1_555 12_656 yes C4 N5 H14 108.992 20_455 1_555 12_656 yes C4 N5 H14 58.92 31_546 1_555 12_656 yes H14 N5 H14 167.912 7_565 1_555 12_656 yes W1 F7_eq F4_ax 44.192 1_555 1_555 1_555 yes W1 F7_eq F4_ax 44.192 1_555 1_555 9_666 yes F4_ax F7_eq F4_ax 88.385 1_555 1_555 9_666 yes W1 F7_eq F7_eq 45 1_555 1_555 2_655 yes F4_ax F7_eq F7_eq 59.536 1_555 1_555 2_655 yes F4_ax F7_eq F7_eq 59.536 9_666 1_555 2_655 yes W1 F7_eq F7_eq 45 1_555 1_555 4_565 yes F4_ax F7_eq F7_eq 59.536 1_555 1_555 4_565 yes F4_ax F7_eq F7_eq 59.536 9_666 1_555 4_565 yes F7_eq F7_eq F7_eq 90 2_655 1_555 4_565 yes W1 F7_eq O8_ax 40.714 1_555 1_555 1_555 yes F4_ax F7_eq O8_ax 3.479 1_555 1_555 1_555 yes F4_ax F7_eq O8_ax 84.906 9_666 1_555 1_555 yes F7_eq F7_eq O8_ax 57.59 2_655 1_555 1_555 yes F7_eq F7_eq O8_ax 57.59 4_565 1_555 1_555 yes W1 F7_eq O8_ax 40.714 1_555 1_555 9_666 yes F4_ax F7_eq O8_ax 84.906 1_555 1_555 9_666 yes F4_ax F7_eq O8_ax 3.479 9_666 1_555 9_666 yes F7_eq F7_eq O8_ax 57.59 2_655 1_555 9_666 yes F7_eq F7_eq O8_ax 57.59 4_565 1_555 9_666 yes O8_ax F7_eq O8_ax 81.427 1_555 1_555 9_666 yes W1 F7_eq O9w 159.302 1_555 1_555 4_565 yes F4_ax F7_eq O9w 132.123 1_555 1_555 4_565 yes F4_ax F7_eq O9w 132.123 9_666 1_555 4_565 yes F7_eq F7_eq O9w 155.698 2_655 1_555 4_565 yes F7_eq F7_eq O9w 114.302 4_565 1_555 4_565 yes O8_ax F7_eq O9w 135.158 1_555 1_555 4_565 yes O8_ax F7_eq O9w 135.158 9_666 1_555 4_565 yes W1 F7_eq O9w 158.751 1_555 1_555 21_644 yes F4_ax F7_eq O9w 131.933 1_555 1_555 21_644 yes F4_ax F7_eq O9w 131.933 9_666 1_555 21_644 yes F7_eq F7_eq O9w 156.249 2_655 1_555 21_644 yes F7_eq F7_eq O9w 113.751 4_565 1_555 21_644 yes O8_ax F7_eq O9w 134.947 1_555 1_555 21_644 yes O8_ax F7_eq O9w 134.947 9_666 1_555 21_644 yes O9w F7_eq O9w 0.551 4_565 1_555 21_644 yes W1 F7_eq F10_eq 74.851 1_555 1_555 1_555 yes F4_ax F7_eq F10_eq 79.2 1_555 1_555 1_555 yes F4_ax F7_eq F10_eq 79.2 9_666 1_555 1_555 yes F7_eq F7_eq F10_eq 29.851 2_655 1_555 1_555 yes F7_eq F7_eq F10_eq 119.851 4_565 1_555 1_555 yes O8_ax F7_eq F10_eq 78.575 1_555 1_555 1_555 yes O8_ax F7_eq F10_eq 78.575 9_666 1_555 1_555 yes O9w F7_eq F10_eq 125.847 4_565 1_555 1_555 yes O9w F7_eq F10_eq 126.398 21_644 1_555 1_555 yes W1 F7_eq F10_eq 65.687 1_555 1_555 4_565 yes F4_ax F7_eq F10_eq 72.83 1_555 1_555 4_565 yes F4_ax F7_eq F10_eq 72.83 9_666 1_555 4_565 yes F7_eq F7_eq F10_eq 110.687 2_655 1_555 4_565 yes F7_eq F7_eq F10_eq 20.687 4_565 1_555 4_565 yes O8_ax F7_eq F10_eq 71.816 1_555 1_555 4_565 yes O8_ax F7_eq F10_eq 71.816 9_666 1_555 4_565 yes O9w F7_eq F10_eq 93.615 4_565 1_555 4_565 yes O9w F7_eq F10_eq 93.064 21_644 1_555 4_565 yes F10_eq F7_eq F10_eq 140.538 1_555 1_555 4_565 yes W1 F7_eq O11_eq 60.772 1_555 1_555 1_555 yes F4_ax F7_eq O11_eq 69.506 1_555 1_555 1_555 yes F4_ax F7_eq O11_eq 69.506 9_666 1_555 1_555 yes F7_eq F7_eq O11_eq 15.772 2_655 1_555 1_555 yes F7_eq F7_eq O11_eq 105.772 4_565 1_555 1_555 yes O8_ax F7_eq O11_eq 68.277 1_555 1_555 1_555 yes O8_ax F7_eq O11_eq 68.277 9_666 1_555 1_555 yes O9w F7_eq O11_eq 139.926 4_565 1_555 1_555 yes O9w F7_eq O11_eq 140.477 21_644 1_555 1_555 yes F10_eq F7_eq O11_eq 14.079 1_555 1_555 1_555 yes F10_eq F7_eq O11_eq 126.459 4_565 1_555 1_555 yes W1 F7_eq O11_eq 55.731 1_555 1_555 4_565 yes F4_ax F7_eq O11_eq 66.188 1_555 1_555 4_565 yes F4_ax F7_eq O11_eq 66.188 9_666 1_555 4_565 yes F7_eq F7_eq O11_eq 100.731 2_655 1_555 4_565 yes F7_eq F7_eq O11_eq 10.731 4_565 1_555 4_565 yes O8_ax F7_eq O11_eq 64.735 1_555 1_555 4_565 yes O8_ax F7_eq O11_eq 64.735 9_666 1_555 4_565 yes O9w F7_eq O11_eq 103.571 4_565 1_555 4_565 yes O9w F7_eq O11_eq 103.02 21_644 1_555 4_565 yes F10_eq F7_eq O11_eq 130.582 1_555 1_555 4_565 yes F10_eq F7_eq O11_eq 9.956 4_565 1_555 4_565 yes O11_eq F7_eq O11_eq 116.503 1_555 1_555 4_565 yes W1 F7_eq O12_eq 39.328 1_555 1_555 2_655 yes F4_ax F7_eq O12_eq 56.315 1_555 1_555 2_655 yes F4_ax F7_eq O12_eq 56.315 9_666 1_555 2_655 yes F7_eq F7_eq O12_eq 5.672 2_655 1_555 2_655 yes F7_eq F7_eq O12_eq 84.328 4_565 1_555 2_655 yes O8_ax F7_eq O12_eq 54.104 1_555 1_555 2_655 yes O8_ax F7_eq O12_eq 54.104 9_666 1_555 2_655 yes O9w F7_eq O12_eq 161.37 4_565 1_555 2_655 yes O9w F7_eq O12_eq 161.921 21_644 1_555 2_655 yes F10_eq F7_eq O12_eq 35.523 1_555 1_555 2_655 yes F10_eq F7_eq O12_eq 105.015 4_565 1_555 2_655 yes O11_eq F7_eq O12_eq 21.444 1_555 1_555 2_655 yes O11_eq F7_eq O12_eq 95.059 4_565 1_555 2_655 yes W1 F7_eq O12_eq 42.358 1_555 1_555 4_565 yes F4_ax F7_eq O12_eq 58.006 1_555 1_555 4_565 yes F4_ax F7_eq O12_eq 58.006 9_666 1_555 4_565 yes F7_eq F7_eq O12_eq 87.358 2_655 1_555 4_565 yes F7_eq F7_eq O12_eq 2.642 4_565 1_555 4_565 yes O8_ax F7_eq O12_eq 55.937 1_555 1_555 4_565 yes O8_ax F7_eq O12_eq 55.937 9_666 1_555 4_565 yes O9w F7_eq O12_eq 116.945 4_565 1_555 4_565 yes O9w F7_eq O12_eq 116.393 21_644 1_555 4_565 yes F10_eq F7_eq O12_eq 117.209 1_555 1_555 4_565 yes F10_eq F7_eq O12_eq 23.33 4_565 1_555 4_565 yes O11_eq F7_eq O12_eq 103.129 1_555 1_555 4_565 yes O11_eq F7_eq O12_eq 13.373 4_565 1_555 4_565 yes O12_eq F7_eq O12_eq 81.686 2_655 1_555 4_565 yes W1 F7_eq H14 96.612 1_555 1_555 4_565 yes F4_ax F7_eq H14 135.069 1_555 1_555 4_565 yes F4_ax F7_eq H14 57.123 9_666 1_555 4_565 yes F7_eq F7_eq H14 77.286 2_655 1_555 4_565 yes F7_eq F7_eq H14 112.515 4_565 1_555 4_565 yes O8_ax F7_eq H14 132.26 1_555 1_555 4_565 yes O8_ax F7_eq H14 60.136 9_666 1_555 4_565 yes O9w F7_eq H14 92.464 4_565 1_555 4_565 yes O9w F7_eq H14 92.706 21_644 1_555 4_565 yes F10_eq F7_eq H14 67.575 1_555 1_555 4_565 yes F10_eq F7_eq H14 115.847 4_565 1_555 4_565 yes O11_eq F7_eq H14 71.586 1_555 1_555 4_565 yes O11_eq F7_eq H14 114.658 4_565 1_555 4_565 yes O12_eq F7_eq H14 79.563 2_655 1_555 4_565 yes O12_eq F7_eq H14 111.862 4_565 1_555 4_565 yes W1 F7_eq H14 96.612 1_555 1_555 10_566 yes F4_ax F7_eq H14 57.123 1_555 1_555 10_566 yes F4_ax F7_eq H14 135.069 9_666 1_555 10_566 yes F7_eq F7_eq H14 77.286 2_655 1_555 10_566 yes F7_eq F7_eq H14 112.515 4_565 1_555 10_566 yes O8_ax F7_eq H14 60.136 1_555 1_555 10_566 yes O8_ax F7_eq H14 132.26 9_666 1_555 10_566 yes O9w F7_eq H14 92.464 4_565 1_555 10_566 yes O9w F7_eq H14 92.706 21_644 1_555 10_566 yes F10_eq F7_eq H14 67.575 1_555 1_555 10_566 yes F10_eq F7_eq H14 115.847 4_565 1_555 10_566 yes O11_eq F7_eq H14 71.586 1_555 1_555 10_566 yes O11_eq F7_eq H14 114.658 4_565 1_555 10_566 yes O12_eq F7_eq H14 79.563 2_655 1_555 10_566 yes O12_eq F7_eq H14 111.862 4_565 1_555 10_566 yes H14 F7_eq H14 127.58 4_565 1_555 10_566 yes W1 O8_ax Ni3 180 1_555 1_555 1_555 yes W1 O8_ax F7_eq 49.286 1_555 1_555 1_555 yes Ni3 O8_ax F7_eq 130.714 1_555 1_555 1_555 yes W1 O8_ax F7_eq 49.286 1_555 1_555 2_655 yes Ni3 O8_ax F7_eq 130.714 1_555 1_555 2_655 yes F7_eq O8_ax F7_eq 64.82 1_555 1_555 2_655 yes W1 O8_ax F7_eq 49.286 1_555 1_555 3_665 yes Ni3 O8_ax F7_eq 130.714 1_555 1_555 3_665 yes F7_eq O8_ax F7_eq 98.573 1_555 1_555 3_665 yes F7_eq O8_ax F7_eq 64.82 2_655 1_555 3_665 yes W1 O8_ax F7_eq 49.286 1_555 1_555 4_565 yes Ni3 O8_ax F7_eq 130.714 1_555 1_555 4_565 yes F7_eq O8_ax F7_eq 64.82 1_555 1_555 4_565 yes F7_eq O8_ax F7_eq 98.573 2_655 1_555 4_565 yes F7_eq O8_ax F7_eq 64.82 3_665 1_555 4_565 yes W1 O8_ax F10_eq 50.38 1_555 1_555 1_555 yes Ni3 O8_ax F10_eq 129.62 1_555 1_555 1_555 yes F7_eq O8_ax F10_eq 28.036 1_555 1_555 1_555 yes F7_eq O8_ax F10_eq 39.933 2_655 1_555 1_555 yes F7_eq O8_ax F10_eq 92.909 3_665 1_555 1_555 yes F7_eq O8_ax F10_eq 86.266 4_565 1_555 1_555 yes W1 O8_ax F10_eq 50.38 1_555 1_555 2_655 yes Ni3 O8_ax F10_eq 129.62 1_555 1_555 2_655 yes F7_eq O8_ax F10_eq 86.266 1_555 1_555 2_655 yes F7_eq O8_ax F10_eq 28.036 2_655 1_555 2_655 yes F7_eq O8_ax F10_eq 39.933 3_665 1_555 2_655 yes F7_eq O8_ax F10_eq 92.909 4_565 1_555 2_655 yes F10_eq O8_ax F10_eq 66.005 1_555 1_555 2_655 yes W1 O8_ax F10_eq 50.38 1_555 1_555 3_665 yes Ni3 O8_ax F10_eq 129.62 1_555 1_555 3_665 yes F7_eq O8_ax F10_eq 92.909 1_555 1_555 3_665 yes F7_eq O8_ax F10_eq 86.266 2_655 1_555 3_665 yes F7_eq O8_ax F10_eq 28.036 3_665 1_555 3_665 yes F7_eq O8_ax F10_eq 39.933 4_565 1_555 3_665 yes F10_eq O8_ax F10_eq 100.76 1_555 1_555 3_665 yes F10_eq O8_ax F10_eq 66.005 2_655 1_555 3_665 yes W1 O8_ax F10_eq 50.38 1_555 1_555 4_565 yes Ni3 O8_ax F10_eq 129.62 1_555 1_555 4_565 yes F7_eq O8_ax F10_eq 39.933 1_555 1_555 4_565 yes F7_eq O8_ax F10_eq 92.909 2_655 1_555 4_565 yes F7_eq O8_ax F10_eq 86.266 3_665 1_555 4_565 yes F7_eq O8_ax F10_eq 28.036 4_565 1_555 4_565 yes F10_eq O8_ax F10_eq 66.005 1_555 1_555 4_565 yes F10_eq O8_ax F10_eq 100.76 2_655 1_555 4_565 yes F10_eq O8_ax F10_eq 66.005 3_665 1_555 4_565 yes W1 O8_ax O11_eq 45.595 1_555 1_555 1_555 yes Ni3 O8_ax O11_eq 134.405 1_555 1_555 1_555 yes F7_eq O8_ax O11_eq 26.471 1_555 1_555 1_555 yes F7_eq O8_ax O11_eq 39.303 2_655 1_555 1_555 yes F7_eq O8_ax O11_eq 88.987 3_665 1_555 1_555 yes F7_eq O8_ax O11_eq 82.008 4_565 1_555 1_555 yes F10_eq O8_ax O11_eq 4.849 1_555 1_555 1_555 yes F10_eq O8_ax O11_eq 64.144 2_655 1_555 1_555 yes F10_eq O8_ax O11_eq 95.969 3_665 1_555 1_555 yes F10_eq O8_ax O11_eq 62.85 4_565 1_555 1_555 yes W1 O8_ax O11_eq 45.595 1_555 1_555 2_655 yes Ni3 O8_ax O11_eq 134.405 1_555 1_555 2_655 yes F7_eq O8_ax O11_eq 82.008 1_555 1_555 2_655 yes F7_eq O8_ax O11_eq 26.471 2_655 1_555 2_655 yes F7_eq O8_ax O11_eq 39.303 3_665 1_555 2_655 yes F7_eq O8_ax O11_eq 88.987 4_565 1_555 2_655 yes F10_eq O8_ax O11_eq 62.85 1_555 1_555 2_655 yes F10_eq O8_ax O11_eq 4.849 2_655 1_555 2_655 yes F10_eq O8_ax O11_eq 64.144 3_665 1_555 2_655 yes F10_eq O8_ax O11_eq 95.969 4_565 1_555 2_655 yes O11_eq O8_ax O11_eq 60.684 1_555 1_555 2_655 yes W1 O8_ax O11_eq 45.595 1_555 1_555 3_665 yes Ni3 O8_ax O11_eq 134.405 1_555 1_555 3_665 yes F7_eq O8_ax O11_eq 88.987 1_555 1_555 3_665 yes F7_eq O8_ax O11_eq 82.008 2_655 1_555 3_665 yes F7_eq O8_ax O11_eq 26.471 3_665 1_555 3_665 yes F7_eq O8_ax O11_eq 39.303 4_565 1_555 3_665 yes F10_eq O8_ax O11_eq 95.969 1_555 1_555 3_665 yes F10_eq O8_ax O11_eq 62.85 2_655 1_555 3_665 yes F10_eq O8_ax O11_eq 4.849 3_665 1_555 3_665 yes F10_eq O8_ax O11_eq 64.144 4_565 1_555 3_665 yes O11_eq O8_ax O11_eq 91.189 1_555 1_555 3_665 yes O11_eq O8_ax O11_eq 60.684 2_655 1_555 3_665 yes W1 O8_ax O11_eq 45.595 1_555 1_555 4_565 yes Ni3 O8_ax O11_eq 134.405 1_555 1_555 4_565 yes F7_eq O8_ax O11_eq 39.303 1_555 1_555 4_565 yes F7_eq O8_ax O11_eq 88.987 2_655 1_555 4_565 yes F7_eq O8_ax O11_eq 82.008 3_665 1_555 4_565 yes F7_eq O8_ax O11_eq 26.471 4_565 1_555 4_565 yes F10_eq O8_ax O11_eq 64.144 1_555 1_555 4_565 yes F10_eq O8_ax O11_eq 95.969 2_655 1_555 4_565 yes F10_eq O8_ax O11_eq 62.85 3_665 1_555 4_565 yes F10_eq O8_ax O11_eq 4.849 4_565 1_555 4_565 yes O11_eq O8_ax O11_eq 60.684 1_555 1_555 4_565 yes O11_eq O8_ax O11_eq 91.189 2_655 1_555 4_565 yes O11_eq O8_ax O11_eq 60.684 3_665 1_555 4_565 yes W1 O8_ax O12_eq 45.138 1_555 1_555 1_555 yes Ni3 O8_ax O12_eq 134.862 1_555 1_555 1_555 yes F7_eq O8_ax O12_eq 4.894 1_555 1_555 1_555 yes F7_eq O8_ax O12_eq 60.442 2_655 1_555 1_555 yes F7_eq O8_ax O12_eq 94.366 3_665 1_555 1_555 yes F7_eq O8_ax O12_eq 64.727 4_565 1_555 1_555 yes F10_eq O8_ax O12_eq 25.084 1_555 1_555 1_555 yes F10_eq O8_ax O12_eq 81.412 2_655 1_555 1_555 yes F10_eq O8_ax O12_eq 90.346 3_665 1_555 1_555 yes F10_eq O8_ax O12_eq 41.382 4_565 1_555 1_555 yes O11_eq O8_ax O12_eq 22.865 1_555 1_555 1_555 yes O11_eq O8_ax O12_eq 77.132 2_655 1_555 1_555 yes O11_eq O8_ax O12_eq 86.23 3_665 1_555 1_555 yes O11_eq O8_ax O12_eq 40.14 4_565 1_555 1_555 yes W1 O8_ax O12_eq 45.138 1_555 1_555 2_655 yes Ni3 O8_ax O12_eq 134.862 1_555 1_555 2_655 yes F7_eq O8_ax O12_eq 64.727 1_555 1_555 2_655 yes F7_eq O8_ax O12_eq 4.894 2_655 1_555 2_655 yes F7_eq O8_ax O12_eq 60.442 3_665 1_555 2_655 yes F7_eq O8_ax O12_eq 94.366 4_565 1_555 2_655 yes F10_eq O8_ax O12_eq 41.382 1_555 1_555 2_655 yes F10_eq O8_ax O12_eq 25.084 2_655 1_555 2_655 yes F10_eq O8_ax O12_eq 81.412 3_665 1_555 2_655 yes F10_eq O8_ax O12_eq 90.346 4_565 1_555 2_655 yes O11_eq O8_ax O12_eq 40.14 1_555 1_555 2_655 yes O11_eq O8_ax O12_eq 22.865 2_655 1_555 2_655 yes O11_eq O8_ax O12_eq 77.132 3_665 1_555 2_655 yes O11_eq O8_ax O12_eq 86.23 4_565 1_555 2_655 yes O12_eq O8_ax O12_eq 60.16 1_555 1_555 2_655 yes W1 O8_ax O12_eq 45.138 1_555 1_555 3_665 yes Ni3 O8_ax O12_eq 134.862 1_555 1_555 3_665 yes F7_eq O8_ax O12_eq 94.366 1_555 1_555 3_665 yes F7_eq O8_ax O12_eq 64.727 2_655 1_555 3_665 yes F7_eq O8_ax O12_eq 4.894 3_665 1_555 3_665 yes F7_eq O8_ax O12_eq 60.442 4_565 1_555 3_665 yes F10_eq O8_ax O12_eq 90.346 1_555 1_555 3_665 yes F10_eq O8_ax O12_eq 41.382 2_655 1_555 3_665 yes F10_eq O8_ax O12_eq 25.084 3_665 1_555 3_665 yes F10_eq O8_ax O12_eq 81.412 4_565 1_555 3_665 yes O11_eq O8_ax O12_eq 86.23 1_555 1_555 3_665 yes O11_eq O8_ax O12_eq 40.14 2_655 1_555 3_665 yes O11_eq O8_ax O12_eq 22.865 3_665 1_555 3_665 yes O11_eq O8_ax O12_eq 77.132 4_565 1_555 3_665 yes O12_eq O8_ax O12_eq 90.277 1_555 1_555 3_665 yes O12_eq O8_ax O12_eq 60.16 2_655 1_555 3_665 yes W1 O8_ax O12_eq 45.138 1_555 1_555 4_565 yes Ni3 O8_ax O12_eq 134.862 1_555 1_555 4_565 yes F7_eq O8_ax O12_eq 60.442 1_555 1_555 4_565 yes F7_eq O8_ax O12_eq 94.366 2_655 1_555 4_565 yes F7_eq O8_ax O12_eq 64.727 3_665 1_555 4_565 yes F7_eq O8_ax O12_eq 4.894 4_565 1_555 4_565 yes F10_eq O8_ax O12_eq 81.412 1_555 1_555 4_565 yes F10_eq O8_ax O12_eq 90.346 2_655 1_555 4_565 yes F10_eq O8_ax O12_eq 41.382 3_665 1_555 4_565 yes F10_eq O8_ax O12_eq 25.084 4_565 1_555 4_565 yes O11_eq O8_ax O12_eq 77.132 1_555 1_555 4_565 yes O11_eq O8_ax O12_eq 86.23 2_655 1_555 4_565 yes O11_eq O8_ax O12_eq 40.14 3_665 1_555 4_565 yes O11_eq O8_ax O12_eq 22.865 4_565 1_555 4_565 yes O12_eq O8_ax O12_eq 60.16 1_555 1_555 4_565 yes O12_eq O8_ax O12_eq 90.277 2_655 1_555 4_565 yes O12_eq O8_ax O12_eq 60.16 3_665 1_555 4_565 yes F7_eq O9w F7_eq 141.005 2_655 1_555 21_654 yes F7_eq O9w F10_eq 39.996 2_655 1_555 1_555 yes F7_eq O9w F10_eq 101.009 21_654 1_555 1_555 yes F7_eq O9w F10_eq 101.496 2_655 1_555 22_664 yes F7_eq O9w F10_eq 39.509 21_654 1_555 22_664 yes F10_eq O9w F10_eq 61.501 1_555 1_555 22_664 yes F7_eq O9w O12_eq 0.077 2_655 1_555 2_655 yes F7_eq O9w O12_eq 141.082 21_654 1_555 2_655 yes F10_eq O9w O12_eq 40.072 1_555 1_555 2_655 yes F10_eq O9w O12_eq 101.573 22_664 1_555 2_655 yes F7_eq O9w O12_eq 141.013 2_655 1_555 21_654 yes F7_eq O9w O12_eq 0.008 21_654 1_555 21_654 yes F10_eq O9w O12_eq 101.017 1_555 1_555 21_654 yes F10_eq O9w O12_eq 39.516 22_664 1_555 21_654 yes O12_eq O9w O12_eq 141.089 2_655 1_555 21_654 yes W1 F10_eq F4_ax 43.084 1_555 1_555 1_555 yes W1 F10_eq F4_ax 43.084 1_555 1_555 9_666 yes F4_ax F10_eq F4_ax 86.168 1_555 1_555 9_666 yes W1 F10_eq F7_eq 68.215 1_555 1_555 1_555 yes F4_ax F10_eq F7_eq 74.273 1_555 1_555 1_555 yes F4_ax F10_eq F7_eq 74.273 9_666 1_555 1_555 yes W1 F10_eq F7_eq 61.246 1_555 1_555 2_655 yes F4_ax F10_eq F7_eq 69.431 1_555 1_555 2_655 yes F4_ax F10_eq F7_eq 69.431 9_666 1_555 2_655 yes F7_eq F10_eq F7_eq 129.462 1_555 1_555 2_655 yes W1 F10_eq O8_ax 39.62 1_555 1_555 1_555 yes F4_ax F10_eq O8_ax 3.464 1_555 1_555 1_555 yes F4_ax F10_eq O8_ax 82.704 9_666 1_555 1_555 yes F7_eq F10_eq O8_ax 73.389 1_555 1_555 1_555 yes F7_eq F10_eq O8_ax 68.251 2_655 1_555 1_555 yes W1 F10_eq O8_ax 39.62 1_555 1_555 9_666 yes F4_ax F10_eq O8_ax 82.704 1_555 1_555 9_666 yes F4_ax F10_eq O8_ax 3.464 9_666 1_555 9_666 yes F7_eq F10_eq O8_ax 73.389 1_555 1_555 9_666 yes F7_eq F10_eq O8_ax 68.251 2_655 1_555 9_666 yes O8_ax F10_eq O8_ax 79.24 1_555 1_555 9_666 yes W1 F10_eq O9w 107.636 1_555 1_555 1_555 yes F4_ax F10_eq O9w 102.784 1_555 1_555 1_555 yes F4_ax F10_eq O9w 102.784 9_666 1_555 1_555 yes F7_eq F10_eq O9w 175.851 1_555 1_555 1_555 yes F7_eq F10_eq O9w 46.389 2_655 1_555 1_555 yes O8_ax F10_eq O9w 103.496 1_555 1_555 1_555 yes O8_ax F10_eq O9w 103.496 9_666 1_555 1_555 yes W1 F10_eq O9w 108.674 1_555 1_555 22_664 yes F4_ax F10_eq O9w 103.524 1_555 1_555 22_664 yes F4_ax F10_eq O9w 103.524 9_666 1_555 22_664 yes F7_eq F10_eq O9w 176.889 1_555 1_555 22_664 yes F7_eq F10_eq O9w 47.428 2_655 1_555 22_664 yes O8_ax F10_eq O9w 104.278 1_555 1_555 22_664 yes O8_ax F10_eq O9w 104.278 9_666 1_555 22_664 yes O9w F10_eq O9w 1.038 1_555 1_555 22_664 yes W1 F10_eq F10_eq 45 1_555 1_555 2_655 yes F4_ax F10_eq F10_eq 58.907 1_555 1_555 2_655 yes F4_ax F10_eq F10_eq 58.907 9_666 1_555 2_655 yes F7_eq F10_eq F10_eq 113.215 1_555 1_555 2_655 yes F7_eq F10_eq F10_eq 16.246 2_655 1_555 2_655 yes O8_ax F10_eq F10_eq 56.997 1_555 1_555 2_655 yes O8_ax F10_eq F10_eq 56.997 9_666 1_555 2_655 yes O9w F10_eq F10_eq 62.636 1_555 1_555 2_655 yes O9w F10_eq F10_eq 63.674 22_664 1_555 2_655 yes W1 F10_eq F10_eq 45 1_555 1_555 4_565 yes F4_ax F10_eq F10_eq 58.907 1_555 1_555 4_565 yes F4_ax F10_eq F10_eq 58.907 9_666 1_555 4_565 yes F7_eq F10_eq F10_eq 23.215 1_555 1_555 4_565 yes F7_eq F10_eq F10_eq 106.246 2_655 1_555 4_565 yes O8_ax F10_eq F10_eq 56.997 1_555 1_555 4_565 yes O8_ax F10_eq F10_eq 56.997 9_666 1_555 4_565 yes O9w F10_eq F10_eq 152.636 1_555 1_555 4_565 yes O9w F10_eq F10_eq 153.674 22_664 1_555 4_565 yes F10_eq F10_eq F10_eq 90 2_655 1_555 4_565 yes W1 F10_eq F10_eq 167.404 1_555 1_555 22_664 yes F4_ax F10_eq F10_eq 135.461 1_555 1_555 22_664 yes F4_ax F10_eq F10_eq 135.461 9_666 1_555 22_664 yes F7_eq F10_eq F10_eq 124.38 1_555 1_555 22_664 yes F7_eq F10_eq F10_eq 106.158 2_655 1_555 22_664 yes O8_ax F10_eq F10_eq 138.742 1_555 1_555 22_664 yes O8_ax F10_eq F10_eq 138.742 9_666 1_555 22_664 yes O9w F10_eq F10_eq 59.769 1_555 1_555 22_664 yes O9w F10_eq F10_eq 58.73 22_664 1_555 22_664 yes F10_eq F10_eq F10_eq 122.404 2_655 1_555 22_664 yes F10_eq F10_eq F10_eq 147.596 4_565 1_555 22_664 yes W1 F10_eq O11_eq 40.643 1_555 1_555 2_655 yes F4_ax F10_eq O11_eq 56.346 1_555 1_555 2_655 yes F4_ax F10_eq O11_eq 56.346 9_666 1_555 2_655 yes F7_eq F10_eq O11_eq 108.858 1_555 1_555 2_655 yes F7_eq F10_eq O11_eq 20.604 2_655 1_555 2_655 yes O8_ax F10_eq O11_eq 54.233 1_555 1_555 2_655 yes O8_ax F10_eq O11_eq 54.233 9_666 1_555 2_655 yes O9w F10_eq O11_eq 66.993 1_555 1_555 2_655 yes O9w F10_eq O11_eq 68.031 22_664 1_555 2_655 yes F10_eq F10_eq O11_eq 4.357 2_655 1_555 2_655 yes F10_eq F10_eq O11_eq 85.643 4_565 1_555 2_655 yes F10_eq F10_eq O11_eq 126.762 22_664 1_555 2_655 yes W1 F10_eq O11_eq 39.766 1_555 1_555 4_565 yes F4_ax F10_eq O11_eq 55.848 1_555 1_555 4_565 yes F4_ax F10_eq O11_eq 55.848 9_666 1_555 4_565 yes F7_eq F10_eq O11_eq 28.449 1_555 1_555 4_565 yes F7_eq F10_eq O11_eq 101.013 2_655 1_555 4_565 yes O8_ax F10_eq O11_eq 53.695 1_555 1_555 4_565 yes O8_ax F10_eq O11_eq 53.695 9_666 1_555 4_565 yes O9w F10_eq O11_eq 147.402 1_555 1_555 4_565 yes O9w F10_eq O11_eq 148.44 22_664 1_555 4_565 yes F10_eq F10_eq O11_eq 84.766 2_655 1_555 4_565 yes F10_eq F10_eq O11_eq 5.234 4_565 1_555 4_565 yes F10_eq F10_eq O11_eq 152.829 22_664 1_555 4_565 yes O11_eq F10_eq O11_eq 80.409 2_655 1_555 4_565 yes W1 F10_eq O12_eq 56.29 1_555 1_555 1_555 yes F4_ax F10_eq O12_eq 66.088 1_555 1_555 1_555 yes F4_ax F10_eq O12_eq 66.088 9_666 1_555 1_555 yes F7_eq F10_eq O12_eq 11.925 1_555 1_555 1_555 yes F7_eq F10_eq O12_eq 117.537 2_655 1_555 1_555 yes O8_ax F10_eq O12_eq 64.691 1_555 1_555 1_555 yes O8_ax F10_eq O12_eq 64.691 9_666 1_555 1_555 yes O9w F10_eq O12_eq 163.926 1_555 1_555 1_555 yes O9w F10_eq O12_eq 164.964 22_664 1_555 1_555 yes F10_eq F10_eq O12_eq 101.29 2_655 1_555 1_555 yes F10_eq F10_eq O12_eq 11.29 4_565 1_555 1_555 yes F10_eq F10_eq O12_eq 136.305 22_664 1_555 1_555 yes O11_eq F10_eq O12_eq 96.933 2_655 1_555 1_555 yes O11_eq F10_eq O12_eq 16.524 4_565 1_555 1_555 yes W1 F10_eq O12_eq 52.024 1_555 1_555 2_655 yes F4_ax F10_eq O12_eq 63.295 1_555 1_555 2_655 yes F4_ax F10_eq O12_eq 63.295 9_666 1_555 2_655 yes F7_eq F10_eq O12_eq 120.24 1_555 1_555 2_655 yes F7_eq F10_eq O12_eq 9.222 2_655 1_555 2_655 yes O8_ax F10_eq O12_eq 61.707 1_555 1_555 2_655 yes O8_ax F10_eq O12_eq 61.707 9_666 1_555 2_655 yes O9w F10_eq O12_eq 55.611 1_555 1_555 2_655 yes O9w F10_eq O12_eq 56.649 22_664 1_555 2_655 yes F10_eq F10_eq O12_eq 7.024 2_655 1_555 2_655 yes F10_eq F10_eq O12_eq 97.024 4_565 1_555 2_655 yes F10_eq F10_eq O12_eq 115.38 22_664 1_555 2_655 yes O11_eq F10_eq O12_eq 11.382 2_655 1_555 2_655 yes O11_eq F10_eq O12_eq 91.791 4_565 1_555 2_655 yes O12_eq F10_eq O12_eq 108.315 1_555 1_555 2_655 yes W1 F10_eq H14 100.125 1_555 1_555 4_565 yes F4_ax F10_eq H14 141.835 1_555 1_555 4_565 yes F4_ax F10_eq H14 58.031 9_666 1_555 4_565 yes F7_eq F10_eq H14 82.87 1_555 1_555 4_565 yes F7_eq F10_eq H14 105.268 2_655 1_555 4_565 yes O8_ax F10_eq H14 138.552 1_555 1_555 4_565 yes O8_ax F10_eq H14 61.397 9_666 1_555 4_565 yes O9w F10_eq H14 98.11 1_555 1_555 4_565 yes O9w F10_eq H14 97.869 22_664 1_555 4_565 yes F10_eq F10_eq H14 105.575 2_655 1_555 4_565 yes F10_eq F10_eq H14 88.86 4_565 1_555 4_565 yes F10_eq F10_eq H14 82.699 22_664 1_555 4_565 yes O11_eq F10_eq H14 105.439 2_655 1_555 4_565 yes O11_eq F10_eq H14 90.268 4_565 1_555 4_565 yes O12_eq F10_eq H14 85.867 1_555 1_555 4_565 yes O12_eq F10_eq H14 105.6 2_655 1_555 4_565 yes W1 F10_eq H14 100.125 1_555 1_555 10_566 yes F4_ax F10_eq H14 58.031 1_555 1_555 10_566 yes F4_ax F10_eq H14 141.835 9_666 1_555 10_566 yes F7_eq F10_eq H14 82.87 1_555 1_555 10_566 yes F7_eq F10_eq H14 105.268 2_655 1_555 10_566 yes O8_ax F10_eq H14 61.397 1_555 1_555 10_566 yes O8_ax F10_eq H14 138.552 9_666 1_555 10_566 yes O9w F10_eq H14 98.11 1_555 1_555 10_566 yes O9w F10_eq H14 97.869 22_664 1_555 10_566 yes F10_eq F10_eq H14 105.575 2_655 1_555 10_566 yes F10_eq F10_eq H14 88.86 4_565 1_555 10_566 yes F10_eq F10_eq H14 82.699 22_664 1_555 10_566 yes O11_eq F10_eq H14 105.439 2_655 1_555 10_566 yes O11_eq F10_eq H14 90.268 4_565 1_555 10_566 yes O12_eq F10_eq H14 85.867 1_555 1_555 10_566 yes O12_eq F10_eq H14 105.6 2_655 1_555 10_566 yes H14 F10_eq H14 148.763 4_565 1_555 10_566 yes W1 O11_eq F4_ax 47.895 1_555 1_555 1_555 yes W1 O11_eq F4_ax 47.895 1_555 1_555 9_666 yes F4_ax O11_eq F4_ax 95.79 1_555 1_555 9_666 yes W1 O11_eq F7_eq 83.346 1_555 1_555 1_555 yes F4_ax O11_eq F7_eq 85.544 1_555 1_555 1_555 yes F4_ax O11_eq F7_eq 85.544 9_666 1_555 1_555 yes W1 O11_eq F7_eq 70.151 1_555 1_555 2_655 yes F4_ax O11_eq F7_eq 76.841 1_555 1_555 2_655 yes F4_ax O11_eq F7_eq 76.841 9_666 1_555 2_655 yes F7_eq O11_eq F7_eq 153.497 1_555 1_555 2_655 yes W1 O11_eq O8_ax 44.405 1_555 1_555 1_555 yes F4_ax O11_eq O8_ax 3.49 1_555 1_555 1_555 yes F4_ax O11_eq O8_ax 92.3 9_666 1_555 1_555 yes F7_eq O11_eq O8_ax 85.252 1_555 1_555 1_555 yes F7_eq O11_eq O8_ax 75.962 2_655 1_555 1_555 yes W1 O11_eq O8_ax 44.405 1_555 1_555 9_666 yes F4_ax O11_eq O8_ax 92.3 1_555 1_555 9_666 yes F4_ax O11_eq O8_ax 3.49 9_666 1_555 9_666 yes F7_eq O11_eq O8_ax 85.252 1_555 1_555 9_666 yes F7_eq O11_eq O8_ax 75.962 2_655 1_555 9_666 yes O8_ax O11_eq O8_ax 88.811 1_555 1_555 9_666 yes W1 O11_eq F10_eq 49.182 1_555 1_555 2_655 yes F4_ax O11_eq F10_eq 64.006 1_555 1_555 2_655 yes F4_ax O11_eq F10_eq 64.006 9_666 1_555 2_655 yes F7_eq O11_eq F10_eq 132.528 1_555 1_555 2_655 yes F7_eq O11_eq F10_eq 20.969 2_655 1_555 2_655 yes O8_ax O11_eq F10_eq 62.162 1_555 1_555 2_655 yes O8_ax O11_eq F10_eq 62.162 9_666 1_555 2_655 yes W1 O11_eq F10_eq 50.409 1_555 1_555 4_565 yes F4_ax O11_eq F10_eq 64.703 1_555 1_555 4_565 yes F4_ax O11_eq F10_eq 64.703 9_666 1_555 4_565 yes F7_eq O11_eq F10_eq 32.937 1_555 1_555 4_565 yes F7_eq O11_eq F10_eq 120.56 2_655 1_555 4_565 yes O8_ax O11_eq F10_eq 62.916 1_555 1_555 4_565 yes O8_ax O11_eq F10_eq 62.916 9_666 1_555 4_565 yes F10_eq O11_eq F10_eq 99.591 2_655 1_555 4_565 yes W1 O11_eq O11_eq 45 1_555 1_555 2_655 yes F4_ax O11_eq O11_eq 61.699 1_555 1_555 2_655 yes F4_ax O11_eq O11_eq 61.699 9_666 1_555 2_655 yes F7_eq O11_eq O11_eq 128.346 1_555 1_555 2_655 yes F7_eq O11_eq O11_eq 25.151 2_655 1_555 2_655 yes O8_ax O11_eq O11_eq 59.658 1_555 1_555 2_655 yes O8_ax O11_eq O11_eq 59.658 9_666 1_555 2_655 yes F10_eq O11_eq O11_eq 4.182 2_655 1_555 2_655 yes F10_eq O11_eq O11_eq 95.409 4_565 1_555 2_655 yes W1 O11_eq O11_eq 45 1_555 1_555 4_565 yes F4_ax O11_eq O11_eq 61.699 1_555 1_555 4_565 yes F4_ax O11_eq O11_eq 61.699 9_666 1_555 4_565 yes F7_eq O11_eq O11_eq 38.346 1_555 1_555 4_565 yes F7_eq O11_eq O11_eq 115.151 2_655 1_555 4_565 yes O8_ax O11_eq O11_eq 59.658 1_555 1_555 4_565 yes O8_ax O11_eq O11_eq 59.658 9_666 1_555 4_565 yes F10_eq O11_eq O11_eq 94.182 2_655 1_555 4_565 yes F10_eq O11_eq O11_eq 5.409 4_565 1_555 4_565 yes O11_eq O11_eq O11_eq 90 2_655 1_555 4_565 yes W1 O11_eq O12_eq 72.257 1_555 1_555 1_555 yes F4_ax O11_eq O12_eq 78.21 1_555 1_555 1_555 yes F4_ax O11_eq O12_eq 78.21 9_666 1_555 1_555 yes F7_eq O11_eq O12_eq 11.089 1_555 1_555 1_555 yes F7_eq O11_eq O12_eq 142.408 2_655 1_555 1_555 yes O8_ax O11_eq O12_eq 77.425 1_555 1_555 1_555 yes O8_ax O11_eq O12_eq 77.425 9_666 1_555 1_555 yes F10_eq O11_eq O12_eq 121.439 2_655 1_555 1_555 yes F10_eq O11_eq O12_eq 21.848 4_565 1_555 1_555 yes O11_eq O11_eq O12_eq 117.257 2_655 1_555 1_555 yes O11_eq O11_eq O12_eq 27.257 4_565 1_555 1_555 yes W1 O11_eq O12_eq 60.342 1_555 1_555 2_655 yes F4_ax O11_eq O12_eq 70.623 1_555 1_555 2_655 yes F4_ax O11_eq O12_eq 70.623 9_666 1_555 2_655 yes F7_eq O11_eq O12_eq 143.688 1_555 1_555 2_655 yes F7_eq O11_eq O12_eq 9.81 2_655 1_555 2_655 yes O8_ax O11_eq O12_eq 69.298 1_555 1_555 2_655 yes O8_ax O11_eq O12_eq 69.298 9_666 1_555 2_655 yes F10_eq O11_eq O12_eq 11.16 2_655 1_555 2_655 yes F10_eq O11_eq O12_eq 110.75 4_565 1_555 2_655 yes O11_eq O11_eq O12_eq 15.342 2_655 1_555 2_655 yes O11_eq O11_eq O12_eq 105.342 4_565 1_555 2_655 yes O12_eq O11_eq O12_eq 132.599 1_555 1_555 2_655 yes W1 O12_eq F4_ax 48.348 1_555 1_555 1_555 yes W1 O12_eq F4_ax 48.348 1_555 1_555 9_666 yes F4_ax O12_eq F4_ax 96.697 1_555 1_555 9_666 yes W1 O12_eq F7_eq 51.184 1_555 1_555 2_655 yes F4_ax O12_eq F7_eq 65.381 1_555 1_555 2_655 yes F4_ax O12_eq F7_eq 65.381 9_666 1_555 2_655 yes W1 O12_eq F7_eq 47.13 1_555 1_555 4_565 yes F4_ax O12_eq F7_eq 63.118 1_555 1_555 4_565 yes F4_ax O12_eq F7_eq 63.118 9_666 1_555 4_565 yes F7_eq O12_eq F7_eq 98.314 2_655 1_555 4_565 yes W1 O12_eq O8_ax 44.862 1_555 1_555 1_555 yes F4_ax O12_eq O8_ax 3.487 1_555 1_555 1_555 yes F4_ax O12_eq O8_ax 93.21 9_666 1_555 1_555 yes F7_eq O12_eq O8_ax 63.621 2_655 1_555 1_555 yes F7_eq O12_eq O8_ax 61.169 4_565 1_555 1_555 yes W1 O12_eq O8_ax 44.862 1_555 1_555 9_666 yes F4_ax O12_eq O8_ax 93.21 1_555 1_555 9_666 yes F4_ax O12_eq O8_ax 3.487 9_666 1_555 9_666 yes F7_eq O12_eq O8_ax 63.621 2_655 1_555 9_666 yes F7_eq O12_eq O8_ax 61.169 4_565 1_555 9_666 yes O8_ax O12_eq O8_ax 89.723 1_555 1_555 9_666 yes W1 O12_eq O9w 155.684 1_555 1_555 4_565 yes F4_ax O12_eq O9w 127.275 1_555 1_555 4_565 yes F4_ax O12_eq O9w 127.275 9_666 1_555 4_565 yes F7_eq O12_eq O9w 153.132 2_655 1_555 4_565 yes F7_eq O12_eq O9w 108.554 4_565 1_555 4_565 yes O8_ax O12_eq O9w 130.236 1_555 1_555 4_565 yes O8_ax O12_eq O9w 130.236 9_666 1_555 4_565 yes W1 O12_eq O9w 155.202 1_555 1_555 21_644 yes F4_ax O12_eq O9w 127.108 1_555 1_555 21_644 yes F4_ax O12_eq O9w 127.108 9_666 1_555 21_644 yes F7_eq O12_eq O9w 153.614 2_655 1_555 21_644 yes F7_eq O12_eq O9w 108.072 4_565 1_555 21_644 yes O8_ax O12_eq O9w 130.05 1_555 1_555 21_644 yes O8_ax O12_eq O9w 130.05 9_666 1_555 21_644 yes O9w O12_eq O9w 0.482 4_565 1_555 21_644 yes W1 O12_eq F10_eq 90.317 1_555 1_555 1_555 yes F4_ax O12_eq F10_eq 90.211 1_555 1_555 1_555 yes F4_ax O12_eq F10_eq 90.211 9_666 1_555 1_555 yes F7_eq O12_eq F10_eq 39.134 2_655 1_555 1_555 yes F7_eq O12_eq F10_eq 137.448 4_565 1_555 1_555 yes O8_ax O12_eq F10_eq 90.225 1_555 1_555 1_555 yes O8_ax O12_eq F10_eq 90.225 9_666 1_555 1_555 yes O9w O12_eq F10_eq 113.998 4_565 1_555 1_555 yes O9w O12_eq F10_eq 114.481 21_644 1_555 1_555 yes W1 O12_eq F10_eq 71.368 1_555 1_555 4_565 yes F4_ax O12_eq F10_eq 77.741 1_555 1_555 4_565 yes F4_ax O12_eq F10_eq 77.741 9_666 1_555 4_565 yes F7_eq O12_eq F10_eq 122.552 2_655 1_555 4_565 yes F7_eq O12_eq F10_eq 24.237 4_565 1_555 4_565 yes O8_ax O12_eq F10_eq 76.911 1_555 1_555 4_565 yes O8_ax O12_eq F10_eq 76.911 9_666 1_555 4_565 yes O9w O12_eq F10_eq 84.316 4_565 1_555 4_565 yes O9w O12_eq F10_eq 83.834 21_644 1_555 4_565 yes F10_eq O12_eq F10_eq 161.685 1_555 1_555 4_565 yes W1 O12_eq O11_eq 75.403 1_555 1_555 1_555 yes F4_ax O12_eq O11_eq 80.358 1_555 1_555 1_555 yes F4_ax O12_eq O11_eq 80.358 9_666 1_555 1_555 yes F7_eq O12_eq O11_eq 24.219 2_655 1_555 1_555 yes F7_eq O12_eq O11_eq 122.533 4_565 1_555 1_555 yes O8_ax O12_eq O11_eq 79.709 1_555 1_555 1_555 yes O8_ax O12_eq O11_eq 79.709 9_666 1_555 1_555 yes O9w O12_eq O11_eq 128.913 4_565 1_555 1_555 yes O9w O12_eq O11_eq 129.395 21_644 1_555 1_555 yes F10_eq O12_eq O11_eq 14.915 1_555 1_555 1_555 yes F10_eq O12_eq O11_eq 146.77 4_565 1_555 1_555 yes W1 O12_eq O11_eq 61.999 1_555 1_555 4_565 yes F4_ax O12_eq O11_eq 71.819 1_555 1_555 4_565 yes F4_ax O12_eq O11_eq 71.819 9_666 1_555 4_565 yes F7_eq O12_eq O11_eq 113.183 2_655 1_555 4_565 yes F7_eq O12_eq O11_eq 14.868 4_565 1_555 4_565 yes O8_ax O12_eq O11_eq 70.562 1_555 1_555 4_565 yes O8_ax O12_eq O11_eq 70.562 9_666 1_555 4_565 yes O9w O12_eq O11_eq 93.685 4_565 1_555 4_565 yes O9w O12_eq O11_eq 93.203 21_644 1_555 4_565 yes F10_eq O12_eq O11_eq 152.316 1_555 1_555 4_565 yes F10_eq O12_eq O11_eq 9.369 4_565 1_555 4_565 yes O11_eq O12_eq O11_eq 137.401 1_555 1_555 4_565 yes W1 O12_eq O12_eq 45 1_555 1_555 2_655 yes F4_ax O12_eq O12_eq 61.969 1_555 1_555 2_655 yes F4_ax O12_eq O12_eq 61.969 9_666 1_555 2_655 yes F7_eq O12_eq O12_eq 6.184 2_655 1_555 2_655 yes F7_eq O12_eq O12_eq 92.13 4_565 1_555 2_655 yes O8_ax O12_eq O12_eq 59.92 1_555 1_555 2_655 yes O8_ax O12_eq O12_eq 59.92 9_666 1_555 2_655 yes O9w O12_eq O12_eq 159.316 4_565 1_555 2_655 yes O9w O12_eq O12_eq 159.798 21_644 1_555 2_655 yes F10_eq O12_eq O12_eq 45.317 1_555 1_555 2_655 yes F10_eq O12_eq O12_eq 116.368 4_565 1_555 2_655 yes O11_eq O12_eq O12_eq 30.403 1_555 1_555 2_655 yes O11_eq O12_eq O12_eq 106.999 4_565 1_555 2_655 yes W1 O12_eq O12_eq 45 1_555 1_555 4_565 yes F4_ax O12_eq O12_eq 61.969 1_555 1_555 4_565 yes F4_ax O12_eq O12_eq 61.969 9_666 1_555 4_565 yes F7_eq O12_eq O12_eq 96.184 2_655 1_555 4_565 yes F7_eq O12_eq O12_eq 2.13 4_565 1_555 4_565 yes O8_ax O12_eq O12_eq 59.92 1_555 1_555 4_565 yes O8_ax O12_eq O12_eq 59.92 9_666 1_555 4_565 yes O9w O12_eq O12_eq 110.684 4_565 1_555 4_565 yes O9w O12_eq O12_eq 110.202 21_644 1_555 4_565 yes F10_eq O12_eq O12_eq 135.317 1_555 1_555 4_565 yes F10_eq O12_eq O12_eq 26.368 4_565 1_555 4_565 yes O11_eq O12_eq O12_eq 120.403 1_555 1_555 4_565 yes O11_eq O12_eq O12_eq 16.999 4_565 1_555 4_565 yes O12_eq O12_eq O12_eq 90 2_655 1_555 4_565 yes Ni3 H14 F4_ax 40.272 5_654 1_555 9_666 yes Ni3 H14 C4 76.62 5_654 1_555 1_555 yes F4_ax H14 C4 108.068 9_666 1_555 1_555 yes Ni3 H14 C4 115.108 5_654 1_555 24_454 yes F4_ax H14 C4 140.746 9_666 1_555 24_454 yes C4 H14 C4 38.49 1_555 1_555 24_454 yes Ni3 H14 N5 45.205 5_654 1_555 7_564 yes F4_ax H14 N5 79.248 9_666 1_555 7_564 yes C4 H14 N5 31.423 1_555 1_555 7_564 yes C4 H14 N5 69.904 24_454 1_555 7_564 yes Ni3 H14 F7_eq 102.9 5_654 1_555 2_655 yes F4_ax H14 F7_eq 65.062 9_666 1_555 2_655 yes C4 H14 F7_eq 161.245 1_555 1_555 2_655 yes C4 H14 F7_eq 137.445 24_454 1_555 2_655 yes N5 H14 F7_eq 143.818 7_564 1_555 2_655 yes Ni3 H14 F10_eq 108.87 5_654 1_555 2_655 yes F4_ax H14 F10_eq 69.181 9_666 1_555 2_655 yes C4 H14 F10_eq 132.373 1_555 1_555 2_655 yes C4 H14 F10_eq 114.593 24_454 1_555 2_655 yes N5 H14 F10_eq 131.141 7_564 1_555 2_655 yes F7_eq H14 F10_eq 29.555 2_655 1_555 2_655 yes 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 W1 Ni3 3.92879 1_555 1_555 yes W1 Ni3 3.92879 1_555 5_654 yes W1 F4_ax 1.95662 1_555 1_555 yes W1 F4_ax 1.95662 1_555 9_666 yes W1 F7_eq 2.01258 1_555 1_555 yes W1 F7_eq 2.01258 1_555 2_655 yes W1 F7_eq 2.01258 1_555 3_665 yes W1 F7_eq 2.01258 1_555 4_565 yes W1 O8_ax 1.73193 1_555 1_555 yes W1 O8_ax 1.73193 1_555 9_666 yes W1 O9w 4.01334 1_555 1_555 yes W1 O9w 4.01334 1_555 2_655 yes W1 O9w 4.01334 1_555 3_665 yes W1 O9w 4.01334 1_555 4_565 yes W1 F10_eq 2.09204 1_555 1_555 yes W1 F10_eq 2.09204 1_555 2_655 yes W1 F10_eq 2.09204 1_555 3_665 yes W1 F10_eq 2.09204 1_555 4_565 yes W1 O11_eq 1.76825 1_555 1_555 yes W1 O11_eq 1.76825 1_555 2_655 yes W1 O11_eq 1.76825 1_555 3_665 yes W1 O11_eq 1.76825 1_555 4_565 yes W1 O12_eq 1.74032 1_555 1_555 yes W1 O12_eq 1.74032 1_555 2_655 yes W1 O12_eq 1.74032 1_555 3_665 yes W1 O12_eq 1.74032 1_555 4_565 yes Ni3 W1 3.92879 1_555 1_555 yes Ni3 W1 3.92879 1_555 5_655 yes Ni3 F4_ax 1.97217 1_555 1_555 yes Ni3 F4_ax 1.97217 1_555 13_566 yes Ni3 C4 2.95124 1_555 5_655 yes Ni3 C4 2.95124 1_555 6_665 yes Ni3 C4 2.95124 1_555 7_565 yes Ni3 C4 2.95124 1_555 8_555 yes Ni3 C4 2.95124 1_555 9_666 yes Ni3 C4 2.95124 1_555 10_566 yes Ni3 C4 2.95124 1_555 11_556 yes Ni3 C4 2.95124 1_555 12_656 yes Ni3 C4 4.33472 1_555 17_545 yes Ni3 C4 4.33472 1_555 18_655 yes Ni3 C4 4.33472 1_555 19_565 yes Ni3 C4 4.33472 1_555 20_455 yes Ni3 C4 4.33472 1_555 29_566 yes Ni3 C4 4.33472 1_555 30_456 yes Ni3 C4 4.33472 1_555 31_546 yes Ni3 C4 4.33472 1_555 32_656 yes Ni3 N5 2.152 1_555 1_555 yes Ni3 N5 2.152 1_555 2_655 yes Ni3 N5 2.152 1_555 3_665 yes Ni3 N5 2.152 1_555 4_565 yes Ni3 F7_eq 4.41428 1_555 1_555 yes Ni3 F7_eq 4.41428 1_555 2_655 yes Ni3 F7_eq 4.41428 1_555 3_665 yes Ni3 F7_eq 4.41428 1_555 4_565 yes Ni3 F7_eq 4.41428 1_555 5_655 yes Ni3 F7_eq 4.41428 1_555 6_665 yes Ni3 F7_eq 4.41428 1_555 7_565 yes Ni3 F7_eq 4.41428 1_555 8_555 yes Ni3 O8_ax 2.19686 1_555 1_555 yes Ni3 O8_ax 2.19686 1_555 13_566 yes Ni3 F10_eq 4.45107 1_555 1_555 yes Ni3 F10_eq 4.45107 1_555 2_655 yes Ni3 F10_eq 4.45107 1_555 3_665 yes Ni3 F10_eq 4.45107 1_555 4_565 yes Ni3 F10_eq 4.45107 1_555 5_655 yes Ni3 F10_eq 4.45107 1_555 6_665 yes Ni3 F10_eq 4.45107 1_555 7_565 yes Ni3 F10_eq 4.45107 1_555 8_555 yes Ni3 O11_eq 4.30838 1_555 1_555 yes Ni3 O11_eq 4.30838 1_555 2_655 yes Ni3 O11_eq 4.30838 1_555 3_665 yes Ni3 O11_eq 4.30838 1_555 4_565 yes Ni3 O11_eq 4.30838 1_555 5_655 yes Ni3 O11_eq 4.30838 1_555 6_665 yes Ni3 O11_eq 4.30838 1_555 7_565 yes Ni3 O11_eq 4.30838 1_555 8_555 yes Ni3 O12_eq 4.29699 1_555 1_555 yes Ni3 O12_eq 4.29699 1_555 2_655 yes Ni3 O12_eq 4.29699 1_555 3_665 yes Ni3 O12_eq 4.29699 1_555 4_565 yes Ni3 O12_eq 4.29699 1_555 5_655 yes Ni3 O12_eq 4.29699 1_555 6_665 yes Ni3 O12_eq 4.29699 1_555 7_565 yes Ni3 O12_eq 4.29699 1_555 8_555 yes Ni3 H14 3.01572 1_555 5_655 yes Ni3 H14 3.01572 1_555 6_665 yes Ni3 H14 3.01572 1_555 7_565 yes Ni3 H14 3.01572 1_555 8_555 yes Ni3 H14 3.01572 1_555 9_666 yes Ni3 H14 3.01572 1_555 10_566 yes Ni3 H14 3.01572 1_555 11_556 yes Ni3 H14 3.01572 1_555 12_656 yes F4_ax W1 1.95662 1_555 1_555 yes F4_ax Ni3 1.97217 1_555 1_555 yes F4_ax C4 3.07163 1_555 9_666 yes F4_ax C4 3.07163 1_555 10_566 yes F4_ax C4 3.07163 1_555 11_556 yes F4_ax C4 3.07163 1_555 12_656 yes F4_ax N5 2.919 1_555 1_555 yes F4_ax N5 2.919 1_555 2_655 yes F4_ax N5 2.919 1_555 3_665 yes F4_ax N5 2.919 1_555 4_565 yes F4_ax F7_eq 2.80692 1_555 1_555 yes F4_ax F7_eq 2.80692 1_555 2_655 yes F4_ax F7_eq 2.80692 1_555 3_665 yes F4_ax F7_eq 2.80692 1_555 4_565 yes F4_ax F10_eq 2.86444 1_555 1_555 yes F4_ax F10_eq 2.86444 1_555 2_655 yes F4_ax F10_eq 2.86444 1_555 3_665 yes F4_ax F10_eq 2.86444 1_555 4_565 yes F4_ax O11_eq 2.63725 1_555 1_555 yes F4_ax O11_eq 2.63725 1_555 2_655 yes F4_ax O11_eq 2.63725 1_555 3_665 yes F4_ax O11_eq 2.63725 1_555 4_565 yes F4_ax O12_eq 2.6186 1_555 1_555 yes F4_ax O12_eq 2.6186 1_555 2_655 yes F4_ax O12_eq 2.6186 1_555 3_665 yes F4_ax O12_eq 2.6186 1_555 4_565 yes F4_ax H14 2.59974 1_555 9_666 yes F4_ax H14 2.59974 1_555 10_566 yes F4_ax H14 2.59974 1_555 11_556 yes F4_ax H14 2.59974 1_555 12_656 yes C4 Ni3 2.95124 1_555 5_654 yes C4 Ni3 4.33472 1_555 17_454 yes C4 F4_ax 3.07163 1_555 9_666 yes C4 C4 1.93684 1_555 16_665 yes C4 C4 1.43734 1_555 24_455 yes C4 C4 2.41191 1_555 25_565 yes C4 N5 1.15849 1_555 7_564 yes C4 N5 2.28819 1_555 18_554 yes C4 F7_eq 3.59828 1_555 2_655 yes C4 O8_ax 3.16404 1_555 9_666 yes C4 F10_eq 3.2155 1_555 2_655 yes C4 O11_eq 3.30678 1_555 2_655 yes C4 O13w 3.15367 1_555 5_664 yes C4 H14 1.01755 1_555 1_555 yes C4 H14 2.08676 1_555 24_455 yes N5 Ni3 2.152 1_555 1_555 yes N5 F4_ax 2.919 1_555 1_555 yes N5 F4_ax 2.919 1_555 13_566 yes N5 C4 1.15849 1_555 7_565 yes N5 C4 1.15849 1_555 12_656 yes N5 C4 2.28819 1_555 20_455 yes N5 C4 2.28819 1_555 31_546 yes N5 N5 3.04339 1_555 2_655 yes N5 N5 3.04339 1_555 4_565 yes N5 N5 2.70898 1_555 22_555 yes N5 O8_ax 3.07527 1_555 1_555 yes N5 O8_ax 3.07527 1_555 13_566 yes N5 H14 1.89822 1_555 7_565 yes N5 H14 1.89822 1_555 12_656 yes F7_eq W1 2.01258 1_555 1_555 yes F7_eq Ni3 4.41428 1_555 1_555 yes F7_eq Ni3 4.41428 1_555 5_654 yes F7_eq F4_ax 2.80692 1_555 1_555 yes F7_eq F4_ax 2.80692 1_555 9_666 yes F7_eq C4 3.59828 1_555 4_565 yes F7_eq C4 3.59828 1_555 10_566 yes F7_eq F7_eq 2.84622 1_555 2_655 yes F7_eq F7_eq 2.84622 1_555 4_565 yes F7_eq O8_ax 2.65519 1_555 1_555 yes F7_eq O8_ax 2.65519 1_555 9_666 yes F7_eq O9w 2.06712 1_555 4_565 yes F7_eq O9w 2.12406 1_555 21_645 yes F7_eq F10_eq 1.30235 1_555 1_555 yes F7_eq F10_eq 3.67248 1_555 2_655 yes F7_eq F10_eq 3.89334 1_555 3_665 yes F7_eq F10_eq 1.83497 1_555 4_565 yes F7_eq F10_eq 3.86544 1_555 21_645 yes F7_eq F10_eq 3.81936 1_555 22_665 yes F7_eq O11_eq 1.18761 1_555 1_555 yes F7_eq O11_eq 3.36881 1_555 2_655 yes F7_eq O11_eq 1.73363 1_555 4_565 yes F7_eq O12_eq 2.74078 1_555 2_655 yes F7_eq O12_eq 2.57807 1_555 4_565 yes F7_eq H14 2.61985 1_555 4_565 yes F7_eq H14 2.61985 1_555 10_566 yes O8_ax W1 1.73193 1_555 1_555 yes O8_ax Ni3 2.19686 1_555 1_555 yes O8_ax C4 3.16404 1_555 9_666 yes O8_ax C4 3.16404 1_555 10_566 yes O8_ax C4 3.16404 1_555 11_556 yes O8_ax C4 3.16404 1_555 12_656 yes O8_ax N5 3.07527 1_555 1_555 yes O8_ax N5 3.07527 1_555 2_655 yes O8_ax N5 3.07527 1_555 3_665 yes O8_ax N5 3.07527 1_555 4_565 yes O8_ax F7_eq 2.65519 1_555 1_555 yes O8_ax F7_eq 2.65519 1_555 2_655 yes O8_ax F7_eq 2.65519 1_555 3_665 yes O8_ax F7_eq 2.65519 1_555 4_565 yes O8_ax F10_eq 2.71592 1_555 1_555 yes O8_ax F10_eq 2.71592 1_555 2_655 yes O8_ax F10_eq 2.71592 1_555 3_665 yes O8_ax F10_eq 2.71592 1_555 4_565 yes O8_ax O11_eq 2.47513 1_555 1_555 yes O8_ax O11_eq 2.47513 1_555 2_655 yes O8_ax O11_eq 2.47513 1_555 3_665 yes O8_ax O11_eq 2.47513 1_555 4_565 yes O8_ax O12_eq 2.45526 1_555 1_555 yes O8_ax O12_eq 2.45526 1_555 2_655 yes O8_ax O12_eq 2.45526 1_555 3_665 yes O8_ax O12_eq 2.45526 1_555 4_565 yes O9w W1 4.01334 1_555 1_555 yes O9w F7_eq 2.06712 1_555 2_655 yes O9w F7_eq 2.12406 1_555 21_655 yes O9w O9w 3.00243 1_555 3_675 yes O9w O9w 3.00182 1_555 24_455 yes O9w F10_eq 2.84929 1_555 1_555 yes O9w F10_eq 3.0203 1_555 2_655 yes O9w F10_eq 3.0807 1_555 21_655 yes O9w F10_eq 2.88017 1_555 22_665 yes O9w O11_eq 2.99338 1_555 1_555 yes O9w O11_eq 3.07254 1_555 2_655 yes O9w O11_eq 3.13268 1_555 21_655 yes O9w O11_eq 3.02925 1_555 22_665 yes O9w O12_eq 2.36292 1_555 2_655 yes O9w O12_eq 2.41987 1_555 21_655 yes F10_eq W1 2.09204 1_555 1_555 yes F10_eq Ni3 4.45107 1_555 1_555 yes F10_eq Ni3 4.45107 1_555 5_654 yes F10_eq F4_ax 2.86444 1_555 1_555 yes F10_eq F4_ax 2.86444 1_555 9_666 yes F10_eq C4 3.2155 1_555 4_565 yes F10_eq C4 3.2155 1_555 10_566 yes F10_eq F7_eq 1.30235 1_555 1_555 yes F10_eq F7_eq 1.83497 1_555 2_655 yes F10_eq F7_eq 3.89334 1_555 3_665 yes F10_eq F7_eq 3.67248 1_555 4_565 yes F10_eq F7_eq 3.86544 1_555 21_655 yes F10_eq F7_eq 3.81936 1_555 22_665 yes F10_eq O8_ax 2.71592 1_555 1_555 yes F10_eq O8_ax 2.71592 1_555 9_666 yes F10_eq O9w 2.84929 1_555 1_555 yes F10_eq O9w 3.0203 1_555 4_565 yes F10_eq O9w 3.0807 1_555 21_645 yes F10_eq O9w 2.88017 1_555 22_665 yes F10_eq F10_eq 2.9586 1_555 2_655 yes F10_eq F10_eq 2.9586 1_555 4_565 yes F10_eq F10_eq 2.92959 1_555 22_665 yes F10_eq O11_eq 2.71433 1_555 2_655 yes F10_eq O11_eq 2.7639 1_555 4_565 yes F10_eq O11_eq 3.25319 1_555 22_665 yes F10_eq O12_eq 1.15141 1_555 1_555 yes F10_eq O12_eq 1.84331 1_555 2_655 yes F10_eq O12_eq 3.3783 1_555 4_565 yes F10_eq H14 2.44061 1_555 4_565 yes F10_eq H14 2.44061 1_555 10_566 yes O11_eq W1 1.76825 1_555 1_555 yes O11_eq Ni3 4.30838 1_555 1_555 yes O11_eq Ni3 4.30838 1_555 5_654 yes O11_eq F4_ax 2.63725 1_555 1_555 yes O11_eq F4_ax 2.63725 1_555 9_666 yes O11_eq C4 3.30678 1_555 4_565 yes O11_eq C4 3.30678 1_555 10_566 yes O11_eq F7_eq 1.18761 1_555 1_555 yes O11_eq F7_eq 1.73363 1_555 2_655 yes O11_eq F7_eq 3.36881 1_555 4_565 yes O11_eq O8_ax 2.47513 1_555 1_555 yes O11_eq O8_ax 2.47513 1_555 9_666 yes O11_eq O9w 2.99338 1_555 1_555 yes O11_eq O9w 3.07254 1_555 4_565 yes O11_eq O9w 3.13268 1_555 21_645 yes O11_eq O9w 3.02925 1_555 22_665 yes O11_eq F10_eq 2.7639 1_555 2_655 yes O11_eq F10_eq 2.71433 1_555 4_565 yes O11_eq F10_eq 3.25319 1_555 22_665 yes O11_eq O11_eq 2.50068 1_555 2_655 yes O11_eq O11_eq 2.50068 1_555 4_565 yes O11_eq O12_eq 0.97748 1_555 1_555 yes O11_eq O12_eq 1.69204 1_555 2_655 yes O11_eq O12_eq 3.07373 1_555 4_565 yes O12_eq W1 1.74032 1_555 1_555 yes O12_eq Ni3 4.29699 1_555 1_555 yes O12_eq Ni3 4.29699 1_555 5_654 yes O12_eq F4_ax 2.6186 1_555 1_555 yes O12_eq F4_ax 2.6186 1_555 9_666 yes O12_eq F7_eq 2.57807 1_555 2_655 yes O12_eq F7_eq 2.74078 1_555 4_565 yes O12_eq O8_ax 2.45526 1_555 1_555 yes O12_eq O8_ax 2.45526 1_555 9_666 yes O12_eq O9w 2.36292 1_555 4_565 yes O12_eq O9w 2.41987 1_555 21_645 yes O12_eq F10_eq 1.15141 1_555 1_555 yes O12_eq F10_eq 3.3783 1_555 2_655 yes O12_eq F10_eq 1.84331 1_555 4_565 yes O12_eq O11_eq 0.97748 1_555 1_555 yes O12_eq O11_eq 3.07373 1_555 2_655 yes O12_eq O11_eq 1.69204 1_555 4_565 yes O12_eq O12_eq 2.46118 1_555 2_655 yes O12_eq O12_eq 2.46118 1_555 4_565 yes O13w C4 3.15367 1_555 5_645 yes O13w C4 3.15367 1_555 7_565 yes O13w C4 3.15367 1_555 9_666 yes O13w C4 3.15367 1_555 11_546 yes O13w C4 3.15367 1_555 18_645 yes O13w C4 3.15367 1_555 20_455 yes O13w C4 3.15367 1_555 30_446 yes O13w C4 3.15367 1_555 32_656 yes H14 Ni3 3.01572 1_555 5_654 yes H14 F4_ax 2.59974 1_555 9_666 yes H14 C4 1.01755 1_555 1_555 yes H14 C4 2.08676 1_555 24_455 yes H14 N5 1.89822 1_555 7_564 yes H14 F7_eq 2.61985 1_555 2_655 yes H14 F10_eq 2.44061 1_555 2_655 yes loop_ _pd_meas_2theta_scan _pd_meas_intensity_total _pd_calc_intensity_total _pd_proc_intensity_bkg_calc _pd_proc_ls_weight 5.00000 18803 0 0 0 5.01028 18861 19544.833 19544.833 0.0000530195 5.02056 19195 19493.061 19493.061 0.0000520969 5.03084 18859 19441.422 19441.422 0.0000530251 5.04112 19076 19389.917 19389.917 0.0000524219 5.05140 18875 19338.548 19338.548 0.0000529801 5.06168 18968 19287.314 19287.314 0.0000527204 5.07196 18731 19236.217 19236.217 0.0000533874 5.08224 18805 19185.258 19185.258 0.0000531773 5.09252 18498 19134.436 19134.436 0.0000540599 5.10280 18338 19083.754 19083.754 0.0000545316 5.11308 18755 19033.212 19033.212 0.0000533191 5.12336 18284 18982.81 18982.81 0.0000546926 5.13364 18564 18932.549 18932.549 0.0000538677 5.14392 18433 18882.431 18882.431 0.0000542505 5.15420 18105 18832.455 18832.455 0.0000552334 5.16448 18242 18782.622 18782.622 0.0000548186 5.17476 18382 18732.933 18732.933 0.000054401 5.18504 18060 18683.389 18683.389 0.000055371 5.19532 18219 18633.99 18633.99 0.0000548878 5.20560 18183 18584.737 18584.737 0.0000549964 5.21588 18275 18535.63 18535.63 0.0000547196 5.22616 18008 18486.671 18486.671 0.0000555309 5.23644 17821 18437.859 18437.859 0.0000561136 5.24672 17917 18389.196 18389.196 0.0000558129 5.25700 17759 18340.681 18340.681 0.0000563095 5.26728 18150 18292.316 18292.316 0.0000550964 5.27756 18100 18244.101 18244.101 0.0000552486 5.28783 17760 18196.083 18196.083 0.0000563063 5.29811 17520 18148.17 18148.17 0.0000570776 5.30839 17573 18100.407 18100.407 0.0000569055 5.31867 17895 18052.797 18052.797 0.0000558815 5.32895 17744 18005.34 18005.34 0.0000563571 5.33923 17854 17958.035 17958.035 0.0000560099 5.34951 17281 17910.884 17910.884 0.000057867 5.35979 17646 17863.887 17863.887 0.0000566701 5.37007 17758 17817.045 17817.045 0.0000563126 5.38035 17409 17770.357 17770.357 0.0000574416 5.39063 17434 17723.825 17723.825 0.0000573592 5.40091 17412 17677.448 17677.448 0.0000574317 5.41119 17297 17631.227 17631.227 0.0000578135 5.42147 17209 17585.163 17585.163 0.0000581091 5.43175 17334 17539.255 17539.255 0.0000576901 5.44203 17437 17493.505 17493.505 0.0000573493 5.45231 17081 17447.912 17447.912 0.0000585446 5.46259 17307 17402.478 17402.478 0.0000577801 5.47287 16916 17357.201 17357.201 0.0000591156 5.48315 17248 17312.084 17312.084 0.0000579777 5.49343 17206 17267.125 17267.125 0.0000581193 5.50371 16935 17222.325 17222.325 0.0000590493 5.51399 17200 17177.685 17177.685 0.0000581395 5.52427 16996 17133.205 17133.205 0.0000588374 5.53455 17040 17088.885 17088.885 0.0000586854 5.54483 16893 17044.726 17044.726 0.0000591961 5.55511 16971 17000.727 17000.727 0.000058924 5.56539 16675 16956.889 16956.889 0.00005997 5.57567 16845 16913.212 16913.212 0.0000593648 5.58595 16596 16869.697 16869.697 0.0000602555 5.59623 16709 16826.343 16826.343 0.000059848 5.60651 16731 16783.151 16783.151 0.0000597693 5.61679 16543 16740.122 16740.122 0.0000604485 5.62707 16629 16697.254 16697.254 0.0000601359 5.63735 16488 16654.549 16654.549 0.0000606502 5.64763 16516 16612.007 16612.007 0.0000605473 5.65791 16580 16569.628 16569.628 0.0000603136 5.66819 16602 16527.411 16527.411 0.0000602337 5.67847 16479 16485.358 16485.358 0.0000606833 5.68875 16364 16443.469 16443.469 0.0000611098 5.69903 16412 16401.742 16401.742 0.000060931 5.70931 16366 16360.18 16360.18 0.0000611023 5.71959 16564 16318.781 16318.781 0.0000603719 5.72987 16355 16277.546 16277.546 0.0000611434 5.74015 16378 16236.475 16236.475 0.0000610575 5.75043 16175 16195.568 16195.568 0.0000618238 5.76071 16235 16154.825 16154.825 0.0000615953 5.77099 16132 16114.246 16114.246 0.0000619886 5.78127 15962 16073.832 16073.832 0.0000626488 5.79154 16168 16033.621 16033.621 0.0000618506 5.80182 16184 15993.536 15993.536 0.0000617894 5.81210 16176 15953.615 15953.615 0.00006182 5.82238 15887 15913.859 15913.859 0.0000629445 5.83266 15850 15874.267 15874.267 0.0000630915 5.84294 16034 15834.84 15834.84 0.0000623675 5.85322 16040 15795.578 15795.578 0.0000623441 5.86350 15932 15756.481 15756.481 0.0000627668 5.87378 15788 15717.548 15717.548 0.0000633392 5.88406 15596 15678.78 15678.78 0.000064119 5.89434 15827 15640.177 15640.177 0.0000631832 5.90462 15774 15601.739 15601.739 0.0000633955 5.91490 15602 15563.465 15563.465 0.0000640943 5.92518 15535 15525.356 15525.356 0.0000643708 5.93546 15910 15487.412 15487.412 0.0000628536 5.94574 15676 15449.633 15449.633 0.0000637918 5.95602 15689 15412.018 15412.018 0.0000637389 5.96630 15639 15374.567 15374.567 0.0000639427 5.97658 15708 15337.282 15337.282 0.0000636618 5.98686 15475 15300.161 15300.161 0.0000646204 5.99714 15852 15263.204 15263.204 0.0000630835 6.00742 15339 15226.411 15226.411 0.0000651933 6.01770 15324 15189.783 15189.783 0.0000652571 6.02798 15699 15153.319 15153.319 0.0000636983 6.03826 15216 15117.02 15117.02 0.0000657203 6.04854 15411 15080.884 15080.884 0.0000648887 6.05882 15369 15044.912 15044.912 0.000065066 6.06910 15223 15009.104 15009.104 0.0000656901 6.07938 15217 14973.46 14973.46 0.000065716 6.08966 15170 14937.979 14937.979 0.0000659196 6.09994 15209 14902.662 14902.662 0.0000657505 6.11022 15255 14867.508 14867.508 0.0000655523 6.12050 15121 14832.518 14832.518 0.0000661332 6.13078 14968 14797.69 14797.69 0.0000668092 6.14106 15043 14763.026 14763.026 0.0000664761 6.15134 14692 14728.524 14728.524 0.0000680643 6.16162 14905 14694.185 14694.185 0.0000670916 6.17190 14888 14660.008 14660.008 0.0000671682 6.18218 14895 14625.994 14625.994 0.0000671366 6.19246 14813 14592.141 14592.141 0.0000675083 6.20274 14828 14558.451 14558.451 0.00006744 6.21302 14935 14524.923 14524.923 0.0000669568 6.22330 14689 14491.556 14491.556 0.0000680782 6.23358 14685 14458.35 14458.35 0.0000680967 6.24386 14545 14425.306 14425.306 0.0000687521 6.25414 14804 14392.423 14392.423 0.0000675493 6.26442 14832 14359.701 14359.701 0.0000674218 6.27470 14823 14327.139 14327.139 0.0000674627 6.28498 14491 14294.738 14294.738 0.0000690084 6.29525 14847 14262.528 14262.528 0.0000673537 6.30553 14462 14230.446 14230.446 0.0000691467 6.31581 14563 14198.525 14198.525 0.0000686672 6.32609 14385 14166.763 14166.763 0.0000695169 6.33637 14308 14135.16 14135.16 0.000069891 6.34665 14535 14103.716 14103.716 0.0000687994 6.35693 14504 14072.431 14072.431 0.0000689465 6.36721 14538 14041.304 14041.304 0.0000687853 6.37749 14603 14010.336 14010.336 0.0000684791 6.38777 14373 13979.526 13979.526 0.0000695749 6.39805 14377 13948.874 13948.874 0.0000695555 6.40833 14287 13918.379 13918.379 0.0000699937 6.41861 14129 13888.041 13888.041 0.0000707764 6.42889 14359 13857.861 13857.861 0.0000696427 6.43917 14119 13827.837 13827.837 0.0000708265 6.44945 14219 13797.969 13797.969 0.0000703284 6.45973 14262 13768.258 13768.258 0.0000701164 6.47001 14128 13738.702 13738.702 0.0000707814 6.48029 14216 13709.302 13709.302 0.0000703433 6.49057 14008 13680.058 13680.058 0.0000713878 6.50085 14065 13650.968 13650.968 0.0000710985 6.51113 14048 13622.033 13622.033 0.0000711845 6.52141 14197 13593.252 13593.252 0.0000704374 6.53169 13926 13564.626 13564.626 0.0000718081 6.54197 13972 13536.153 13536.153 0.0000715717 6.55225 14094 13507.833 13507.833 0.0000709522 6.56253 13910 13479.667 13479.667 0.0000718907 6.57281 13692 13451.653 13451.653 0.0000730353 6.58309 13803 13423.792 13423.792 0.000072448 6.59337 13699 13396.083 13396.083 0.000072998 6.60365 13717 13368.526 13368.526 0.0000729022 6.61393 13863 13341.12 13341.12 0.0000721345 6.62421 13438 13313.865 13313.865 0.0000744158 6.63449 13995 13286.762 13286.762 0.0000714541 6.64477 13660 13259.808 13259.808 0.0000732064 6.65505 13739 13233.005 13233.005 0.0000727855 6.66533 13553 13206.352 13206.352 0.0000737844 6.67561 13642 13179.847 13179.847 0.000073303 6.68589 13611 13153.492 13153.492 0.00007347 6.69617 13596 13127.286 13127.286 0.000073551 6.70645 13458 13101.228 13101.228 0.0000743052 6.71673 13607 13075.318 13075.318 0.0000734916 6.72701 13690 13049.555 13049.555 0.000073046 6.73729 13498 13023.94 13023.94 0.000074085 6.74757 13263 12998.472 12998.472 0.0000753977 6.75785 13245 12973.15 12973.15 0.0000755002 6.76813 13322 12947.974 12947.974 0.0000750638 6.77841 13422 12922.944 12922.944 0.0000745045 6.78869 13230 12898.06 12898.06 0.0000755858 6.79897 13224 12873.32 12873.32 0.0000756201 6.80924 13187 12848.749 12848.749 0.0000758323 6.81952 13295 12824.298 12824.298 0.0000752162 6.82980 13162 12799.99 12799.99 0.0000759763 6.84008 13251 12775.826 12775.826 0.000075466 6.85036 13167 12751.806 12751.806 0.0000759474 6.86064 13246 12727.928 12727.928 0.0000754945 6.87092 13190 12704.192 12704.192 0.000075815 6.88120 13038 12680.597 12680.597 0.0000766989 6.89148 13005 12657.145 12657.145 0.0000768935 6.90176 12866 12633.833 12633.833 0.0000777242 6.91204 13073 12610.662 12610.662 0.0000764935 6.92232 13021 12587.631 12587.631 0.000076799 6.93260 13216 12564.74 12564.74 0.0000756659 6.94288 12728 12541.989 12541.989 0.0000785669 6.95316 12883 12519.376 12519.376 0.0000776217 6.96344 12837 12496.902 12496.902 0.0000778998 6.97372 12722 12474.566 12474.566 0.000078604 6.98400 12942 12452.368 12452.368 0.0000772678 6.99428 12765 12430.307 12430.307 0.0000783392 7.00456 12807 12408.383 12408.383 0.0000780823 7.01484 12841 12386.595 12386.595 0.0000778756 7.02512 12755 12364.943 12364.943 0.0000784006 7.03540 12881 12343.427 12343.427 0.0000776337 7.04568 12643 12322.046 12322.046 0.0000790952 7.05596 12604 12300.8 12300.8 0.0000793399 7.06624 12518 12279.688 12279.688 0.000079885 7.07652 12540 12258.71 12258.71 0.0000797448 7.08680 12684 12237.866 12237.866 0.0000788395 7.09708 12709 12217.154 12217.154 0.0000786844 7.10736 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0.0000782289 119.95900 12825 13678.606 13320.373 0.0000779727 119.96930 12870 13686.91 13346.162 0.0000777001 119.97950 12705 13695.993 13372.012 0.0000787092 119.98980 12670 13706.098 13398.431 0.0000789266 120.00010 12803 13717.21 13425.172 0 120.01040 12673 0 0 0 loop_ _refln_index_h _refln_index_k _refln_index_l _refln_F_squared_meas _refln_F_squared_calc _refln_phase_calc _refln_d_spacing _gsas_i100_meas 0 0 2 28101.8319 21061.6245 -0.0 7.85758 13.24 1 1 0 206033.5242 194609.9110 0.0 7.01298 100.00 1 1 2 18466.3780 18301.5047 0.0 5.23215 12.03 2 0 0 75893.4763 71702.0106 0.0 4.95893 18.53 2 1 1 35.1026 31.9429 -180.0 4.26864 0.03 2 0 2 65795.8355 74848.1244 0.0 4.19362 25.59 0 0 4 375597.8222 318703.4399 0.0 3.92879 44.36 2 2 0 159092.8265 142202.9342 0.0 3.50649 19.05 1 1 4 90887.5163 89905.6699 0.0 3.42758 28.69 2 1 3 3056.4890 4287.4583 180.0 3.38499 1.61 2 2 2 2462.6761 1996.7244 0.0 3.20212 0.52 3 1 0 59321.8718 65149.7560 0.0 3.13630 11.21 2 0 4 45727.9535 47575.9488 -0.0 3.07945 10.73 3 1 2 21944.2773 27180.4149 0.0 2.91284 7.46 3 2 1 4480.0192 2761.8557 -0.0 2.70952 1.25 0 0 6 48875.9643 47443.0976 -0.0 2.61919 2.43 2 2 4 45305.5515 50323.8865 0.0 2.61607 6.90 2 1 5 1961.0771 891.6048 0.0 2.56444 0.63 4 0 0 71130.9606 69950.4780 0.0 2.47946 4.02 1 1 6 17968.9380 17723.6947 -0.0 2.45365 2.90 3 1 4 23904.7921 23811.9591 -0.0 2.45109 6.15 3 2 3 281.4780 211.7983 180.0 2.43537 0.07 4 1 1 28.5925 20.6198 0.0 2.37774 0.01 4 0 2 23219.5353 20073.3910 0.0 2.36454 2.44 3 3 0 123909.5829 127117.1403 0.0 2.33766 6.12 2 0 6 8258.6100 13293.8787 0.0 2.31599 1.12 3 3 2 541.4804 629.8151 0.0 2.24061 0.05 4 2 0 100440.7546 103566.4310 0.0 2.21770 8.79 4 1 3 478.4451 286.0673 -0.0 2.18598 0.09 4 2 2 5694.0070 5494.0250 0.0 2.13432 0.94 2 2 6 4814.7439 4633.0944 -0.0 2.09842 0.48 4 0 4 25464.7020 25701.2310 0.0 2.09681 2.19 3 2 5 1312.3985 2209.3235 0.0 2.06994 0.23 3 1 6 9883.7203 12251.4078 -0.0 2.01035 1.76 3 3 4 45795.5257 56283.1032 0.0 2.00894 3.53 2 1 7 133.8433 167.6564 -180.0 2.00305 0.03 4 3 1 273.4725 301.5489 -0.0 1.96796 0.04 0 0 8 172157.6441 152556.8948 0.0 1.96440 4.41 5 1 0 97886.2341 89231.0395 0.0 1.94505 6.30 4 2 4 38905.1678 41748.0108 0.0 1.93126 5.41 4 1 5 68.5992 64.7798 180.0 1.91021 0.01 1 1 8 111498.0831 103995.6931 -0.0 1.89159 10.06 5 1 2 14108.4993 13236.4274 0.0 1.88807 1.73 4 3 3 47.3065 18.7271 180.0 1.85503 0.01 5 2 1 65.1691 70.0410 180.0 1.82918 0.01 2 0 8 85497.2871 84696.8748 -0.0 1.82632 6.87 4 0 6 22005.0235 17265.0594 -0.0 1.80062 1.43 4 4 0 71023.8538 61907.1093 0.0 1.75325 1.78 3 3 6 1089.8424 1098.9662 -0.0 1.74405 0.06 5 1 4 39987.1152 41142.5351 0.0 1.74313 4.26 3 2 7 4.1624 3.9350 -180.0 1.73928 0.00 5 2 3 827.2533 756.3731 -0.0 1.73745 0.08 2 2 8 38064.8543 48044.5378 0.0 1.71379 2.49 4 4 2 7830.7594 8849.4146 0.0 1.71117 0.38 5 3 0 57272.0810 49664.2618 0.0 1.70090 2.66 4 2 6 5300.4577 5158.0055 -0.0 1.69250 0.58 4 3 5 797.2827 816.0570 -0.0 1.67745 0.08 3 1 8 37788.9309 41790.3928 -0.0 1.66480 4.51 5 3 2 10209.5082 10734.8756 0.0 1.66240 0.91 6 0 0 78678.6554 81099.9251 0.0 1.65298 1.70 4 1 7 423.5298 343.1427 0.0 1.64125 0.04 2 1 9 22.6971 17.8634 0.0 1.62476 0.00 6 1 1 689.3808 563.0419 180.0 1.62178 0.06 6 0 2 4922.3545 3413.0533 0.0 1.61757 0.21 4 4 4 44305.4405 41174.0483 -0.0 1.60106 1.89 5 2 5 375.6975 312.2010 -180.0 1.58900 0.03 0 0 10 37655.0783 29773.5806 0.0 1.57152 0.56 6 2 0 42143.5826 35973.3453 0.0 1.56815 1.60 5 1 6 11137.5169 9017.8094 -0.0 1.56156 0.97 5 3 4 30236.6773 24704.8350 -0.0 1.56090 2.42 6 1 3 23.8146 20.0179 -180.0 1.55682 0.00 5 4 1 342.3055 325.0399 -0.0 1.54144 0.03 4 0 8 38818.2224 38130.9915 -0.0 1.53973 1.82 6 2 2 8217.5421 7898.7773 0.0 1.53782 0.60 1 1 10 15564.6071 17043.7818 0.0 1.53349 0.85 6 0 4 48861.7594 49122.3356 0.0 1.52361 1.83 3 3 8 45181.0830 57727.8979 -0.0 1.50391 1.98 2 0 10 7264.6980 11400.3281 0.0 1.49809 0.37 4 3 7 21.4345 16.9712 -180.0 1.48648 0.00 5 4 3 1.0488 0.8000 0.0 1.48534 0.00 3 2 9 60.6630 72.4927 0.0 1.47419 0.01 6 3 1 66.2497 78.8009 -0.0 1.47197 0.00 4 2 8 40344.1185 50199.7558 -0.0 1.47047 3.30 4 4 6 2266.9107 1713.9193 -0.0 1.45696 0.08 6 2 4 21568.3733 16590.3804 -0.0 1.45642 1.44 6 1 5 631.3927 673.2500 -180.0 1.44733 0.04 2 2 10 6857.5987 8974.9468 0.0 1.43408 0.30 5 3 6 6058.5809 5237.3056 -0.0 1.42650 0.41 5 2 7 153.8072 134.2540 0.0 1.42388 0.01 6 3 3 24.2643 21.6106 0.0 1.42288 0.00 4 1 9 0.6565 0.6343 -0.0 1.41307 0.00 3 1 10 11108.5175 11497.2247 0.0 1.40500 0.91 5 5 0 41372.1967 37306.8164 0.0 1.40260 0.60 7 1 0 40707.7023 36707.6178 0.0 1.40260 1.18 6 0 6 1798.9186 1543.1343 -0.0 1.39787 0.06 5 4 5 644.2342 732.9272 -0.0 1.38936 0.04 5 1 8 43801.0415 45800.8679 -0.0 1.38215 3.00 5 5 2 4133.6273 4006.1953 0.0 1.38077 0.12 7 1 2 1331.7398 1290.6847 0.0 1.38077 0.08 6 4 0 46930.8138 30483.0566 0.0 1.37536 1.30 2 1 11 31.0834 20.0890 -0.0 1.35985 0.00 7 2 1 320.3529 213.1321 -180.0 1.35723 0.02 6 4 2 6042.9447 3587.1516 0.0 1.35476 0.33 6 2 6 5526.2820 3830.3164 -0.0 1.34544 0.32 6 3 5 57.5823 84.0513 0.0 1.33784 0.00 4 0 10 13327.7978 15812.8274 0.0 1.32736 0.46 5 5 4 22204.5287 18616.7380 0.0 1.32094 0.58 7 1 4 22850.7207 19158.5189 0.0 1.32094 1.20 6 1 7 76.4839 68.7797 180.0 1.31926 0.00 7 2 3 1046.3977 943.6344 180.0 1.31846 0.05 4 3 9 113.2100 108.3124 0.0 1.31065 0.01 0 0 12 65065.2752 59428.3267 0.0 1.30960 0.62 4 4 8 52700.4251 51036.5033 -0.0 1.30804 1.55 3 3 10 2871.6421 2698.8423 0.0 1.30420 0.09 7 3 0 16922.2566 13822.4824 0.0 1.30228 0.41 6 4 4 14553.5672 11181.9660 0.0 1.29811 0.73 1 1 12 38087.1912 39892.8774 0.0 1.28734 1.38 5 3 8 31671.5972 33979.0972 -0.0 1.28586 1.78 7 3 2 2730.6309 3015.3293 0.0 1.28475 0.13 4 2 10 4465.5173 5444.0636 0.0 1.28222 0.28 5 4 7 1.2221 1.8945 -180.0 1.27492 0.00 3 2 11 36.3974 48.9311 -0.0 1.26785 0.00 5 2 9 0.0072 0.0096 -180.0 1.26714 0.00 2 0 12 22078.9063 29161.4377 0.0 1.26619 0.76 6 5 1 86.2591 114.9790 -0.0 1.26573 0.00 6 0 8 34895.1936 47616.4492 -0.0 1.26478 0.94 7 2 5 36.7615 47.1759 180.0 1.24996 0.00 8 0 0 38492.9467 26900.6466 0.0 1.23973 0.42 5 5 6 4385.6252 2623.8833 -0.0 1.23647 0.10 7 1 6 767.3095 459.0749 -0.0 1.23647 0.04 7 3 4 7197.8750 4412.6125 0.0 1.23614 0.33 6 3 7 30.0489 19.9895 -0.0 1.23476 0.00 6 5 3 128.6237 86.1397 0.0 1.23411 0.01 4 1 11 0.1068 0.1032 180.0 1.22834 0.00 2 2 12 20047.0546 19199.4554 0.0 1.22683 0.63 7 4 1 122.7828 118.3198 0.0 1.22641 0.01 8 1 1 128.9655 124.2778 -180.0 1.22641 0.01 6 2 8 25398.3788 25384.2713 -0.0 1.22554 1.27 8 0 2 748.4857 777.0358 0.0 1.22458 0.02 5 1 10 8588.4501 8479.6853 0.0 1.22239 0.47 6 4 6 6735.0369 4374.7734 -0.0 1.21769 0.31 3 1 12 10121.3962 15880.0410 0.0 1.20847 0.61 8 2 0 14538.7742 14723.2760 0.0 1.20272 0.30 7 4 3 247.4786 311.4571 -0.0 1.19758 0.01 8 1 3 505.6394 636.3581 180.0 1.19758 0.02 6 1 9 226.4516 140.9520 -180.0 1.19171 0.01 8 2 2 881.0433 389.4835 0.0 1.18887 0.04 8 0 4 13739.8042 11550.0763 0.0 1.18227 0.28 6 5 5 137.4900 127.6449 -0.0 1.17739 0.01 4 4 10 2903.7755 2585.2956 0.0 1.17022 0.07 6 6 0 28710.7179 21392.8791 0.0 1.16883 0.28 2 1 13 14.8661 9.6960 180.0 1.16632 0.00 7 3 6 3366.9323 2203.0453 -0.0 1.16609 0.14 7 2 7 534.0678 380.3597 -180.0 1.16466 0.02 4 3 11 76.6101 76.5238 -0.0 1.15927 0.00 5 4 9 133.6582 137.0488 0.0 1.15872 0.01 4 0 12 14036.2286 15026.4350 0.0 1.15800 0.38 8 3 1 3.7585 4.0213 180.0 1.15764 0.00 6 6 2 449.9468 409.0698 0.0 1.15611 0.01 5 3 10 5521.2036 5032.8684 0.0 1.15426 0.26 7 5 0 22642.9773 18640.0663 0.0 1.15293 0.43 8 2 4 7638.3662 6082.8452 0.0 1.15004 0.30 7 4 5 13.3877 11.3067 0.0 1.14554 0.00 8 1 5 0.0204 0.0173 -0.0 1.14554 0.00 3 3 12 24260.4956 23795.0700 0.0 1.14253 0.63 5 5 8 21806.9222 22313.9338 -0.0 1.14149 0.47 7 1 8 23692.3119 24243.1587 -0.0 1.14149 1.02 7 5 2 783.1840 823.7734 0.0 1.14071 0.03 6 0 10 3048.1384 3150.1726 0.0 1.13894 0.07 8 3 3 6.7192 6.7340 -0.0 1.13331 0.00 5 2 11 0.9840 1.2755 180.0 1.12883 0.00 6 3 9 22.5373 29.5511 0.0 1.12833 0.00 4 2 12 14813.9831 19986.8539 0.0 1.12766 0.75 6 4 8 8728.2160 12187.6632 0.0 1.12666 0.37 0 0 14 7358.0242 7629.0635 0.0 1.12251 0.05 8 0 6 963.0802 734.5482 -0.0 1.12055 0.02 6 6 4 15373.5237 11736.0057 -0.0 1.12030 0.29 6 2 10 4182.7518 3735.5436 0.0 1.11004 0.19 8 4 0 13299.3471 12153.0482 0.0 1.10885 0.24 1 1 14 6185.6915 5755.1949 -0.0 1.10840 0.17 3 2 13 2.2492 1.8103 180.0 1.10670 0.00 7 5 4 10876.9083 8701.0206 0.0 1.10628 0.41 6 5 7 44.7806 37.0435 -0.0 1.10529 0.00 8 4 2 1828.3774 985.3129 0.0 1.09797 0.07 9 1 0 17217.0175 12609.5615 0.0 1.09524 0.31 2 0 14 7563.8154 5788.9203 -0.0 1.09481 0.21 8 2 6 194.2042 147.7862 -0.0 1.09299 0.01 8 3 5 66.1184 59.2230 180.0 1.08891 0.00 5 1 12 17669.4694 18915.8997 0.0 1.08631 0.84 7 3 8 7201.2001 7829.7907 -0.0 1.08542 0.29 9 1 2 1326.4386 1420.1412 0.0 1.08476 0.05 4 1 13 44.4091 41.8324 -0.0 1.08013 0.00 7 4 7 283.3221 269.6694 0.0 1.07882 0.01 8 1 7 491.0653 467.4018 -180.0 1.07882 0.02 6 1 11 130.3381 100.5418 180.0 1.07452 0.01 7 2 9 164.8775 126.2959 180.0 1.07409 0.01 7 6 1 0.0650 0.0500 0.0 1.07323 0.00 9 2 1 46.0883 35.5039 180.0 1.07323 0.00 2 2 14 2482.1100 2137.5913 -0.0 1.06907 0.06 6 6 6 68.4675 51.7425 -180.0 1.06737 0.00 8 4 4 7948.0656 6053.6260 -0.0 1.06716 0.29 3 1 14 4254.9774 4427.9297 -0.0 1.05686 0.22 7 5 6 481.7683 440.4935 -0.0 1.05522 0.02 9 1 4 5640.1868 5177.0026 0.0 1.05502 0.20 7 6 3 0.8107 0.7849 0.0 1.05375 0.00 9 2 3 2.0335 1.9688 -0.0 1.05375 0.00 5 4 11 95.7363 104.2868 -0.0 1.05015 0.00 4 4 12 18391.4922 20781.0919 0.0 1.04921 0.42 8 5 1 0.5518 0.6345 -0.0 1.04895 0.00 8 0 8 12307.0398 14449.1773 -0.0 1.04841 0.24 5 5 10 3299.6450 3466.6965 0.0 1.04643 0.07 7 1 10 946.0173 993.9114 0.0 1.04643 0.04 9 3 0 13041.5778 13693.4456 0.0 1.04543 0.23 5 3 12 11652.1017 13604.4169 0.0 1.03766 0.52 9 3 2 39.0437 43.3094 180.0 1.03630 0.00 6 4 10 5373.1771 5552.7483 0.0 1.03497 0.22 4 3 13 1.0841 1.0859 180.0 1.03227 0.00 8 3 7 30.3445 32.2336 0.0 1.03112 0.00 8 5 3 0.0586 0.0620 0.0 1.03074 0.00 6 3 11 21.2275 22.7671 -0.0 1.02737 0.00 6 5 9 53.9647 58.4290 0.0 1.02699 0.00 6 0 12 18701.4230 20798.5187 0.0 1.02648 0.42 8 2 8 8431.1042 9902.3435 -0.0 1.02573 0.32 4 0 14 4393.3221 6048.9052 -0.0 1.02260 0.11 8 4 6 197.0381 263.1529 -0.0 1.02111 0.01 2 1 15 22.2440 31.7228 -0.0 1.01962 0.00 7 6 5 0.8986 1.1184 -0.0 1.01778 0.00 9 2 5 41.3191 51.4243 -180.0 1.01778 0.00 3 3 14 646.8864 494.6330 -0.0 1.01190 0.02 5 2 13 26.6568 19.7788 -0.0 1.01060 0.00 9 1 6 1260.7308 946.1068 -0.0 1.01046 0.05 9 3 4 9317.0517 7114.3535 0.0 1.01028 0.33 7 4 9 48.9984 45.4730 -0.0 1.00565 0.00 8 1 9 58.3463 54.1484 180.0 1.00565 0.00 6 2 12 10625.8170 9833.6367 0.0 1.00518 0.47 9 4 1 14.0266 13.0250 -0.0 1.00494 0.00 6 6 8 19900.4762 18955.4835 -0.0 1.00447 0.38 7 3 10 2804.7582 2833.9480 0.0 1.00273 0.11 7 7 0 10513.6902 11009.5812 0.0 1.00185 0.09 4 2 14 1678.1237 1837.9496 -0.0 1.00152 0.08 8 5 5 6.8611 6.8658 -0.0 0.99700 0.00 7 5 8 14516.6464 11757.0989 -0.0 0.99432 0.56 7 7 2 169.5170 145.5893 180.0 0.99381 0.00 8 6 0 13935.2486 11051.4847 0.0 0.99179 0.24 10 0 0 7843.1663 6220.0994 0.0 0.99179 0.07 9 4 3 2.3641 2.0967 0.0 0.98890 0.00 7 2 11 90.7553 73.9055 -180.0 0.98592 0.00 10 1 1 15.0475 10.9785 180.0 0.98492 0.00 8 6 2 125.8931 96.1301 0.0 0.98398 0.00 10 0 2 4666.8557 3563.5412 0.0 0.98398 0.08 0 0 16 50213.9479 40192.2690 -0.0 0.98220 0.34 3 2 15 37.2675 46.2182 -0.0 0.97907 0.00 8 0 10 1135.6106 1196.8568 0.0 0.97333 0.02 1 1 16 23672.6476 25617.1233 -0.0 0.97270 0.64 10 2 0 9999.4317 11046.6849 0.0 0.97253 0.18 5 1 14 2446.0112 2774.2450 -0.0 0.97222 0.12 6 1 13 24.0797 24.1563 -180.0 0.97108 0.00 9 3 6 176.5612 174.5733 -180.0 0.97095 0.01 7 7 4 5692.7172 5567.4411 -0.0 0.97079 0.10 7 6 7 0.7999 0.7970 -180.0 0.97012 0.00 9 2 7 2.9443 2.9339 180.0 0.97012 0.00 10 1 3 23.8266 23.9894 -0.0 0.96980 0.00 8 3 9 7.3438 6.5586 -180.0 0.96668 0.00 8 4 8 10052.0883 9372.3255 -0.0 0.96563 0.39 10 2 2 22.5829 22.1975 0.0 0.96516 0.00 2 0 16 16184.9620 16782.6750 -0.0 0.96348 0.44 9 5 0 9341.8296 9786.7549 0.0 0.96331 0.17 8 6 4 5278.1030 5028.9151 0.0 0.96162 0.19 10 0 4 2969.6804 2829.4770 -0.0 0.96162 0.05 4 1 15 1.9192 1.9466 -180.0 0.96053 0.00 9 4 5 27.2976 26.5932 -0.0 0.95899 0.00 5 5 12 9089.8869 9682.1683 0.0 0.95722 0.20 7 1 12 9753.8676 10389.4128 0.0 0.95722 0.43 9 1 8 6989.6419 7660.1065 -0.0 0.95661 0.27 9 5 2 655.5433 712.4265 0.0 0.95615 0.02 8 2 10 447.0503 460.9258 0.0 0.95510 0.02 5 4 13 0.5500 0.5038 0.0 0.95298 0.00 8 5 7 3.5823 3.1774 -180.0 0.95207 0.00 6 5 11 44.3829 41.8150 -0.0 0.94912 0.00 6 4 12 4918.4327 4915.4084 0.0 0.94842 0.22 10 3 1 40.9682 41.9755 -0.0 0.94823 0.00 2 2 16 15716.0575 15862.9140 -0.0 0.94579 0.43 4 4 14 780.1591 798.7160 -0.0 0.94535 0.02 10 2 4 5759.2086 5263.4790 0.0 0.94403 0.21 10 1 5 43.0288 39.9722 -180.0 0.94154 0.00 6 6 10 43.9884 51.2622 0.0 0.93787 0.00 3 1 16 9845.9044 11829.8044 -0.0 0.93731 0.54 5 3 14 1463.1325 1776.0972 -0.0 0.93688 0.07 6 3 13 9.4204 9.8980 0.0 0.93585 0.00 7 7 6 402.3303 416.2078 -180.0 0.93574 0.01 9 5 4 4711.0451 4796.1074 0.0 0.93559 0.18 10 3 3 17.1359 16.2294 0.0 0.93471 0.00 7 4 11 44.4832 29.2990 0.0 0.93220 0.00 8 1 11 47.7749 31.4671 -180.0 0.93220 0.00 8 7 1 44.0827 27.0346 180.0 0.93135 0.00 7 5 10 1366.2511 824.8242 0.0 0.92959 0.06 6 0 14 902.0924 557.5705 -0.0 0.92863 0.02 8 6 6 92.0097 55.0557 -0.0 0.92752 0.00 10 0 6 2762.9927 1653.2887 -0.0 0.92752 0.05 4 3 15 58.5983 38.5993 0.0 0.92640 0.00 7 3 12 3526.2869 2723.5474 0.0 0.92343 0.16 9 3 8 12188.4032 10102.6952 -0.0 0.92288 0.51 10 4 0 12105.3672 10601.1200 0.0 0.92085 0.23 9 4 7 0.4884 0.4546 -0.0 0.91881 0.00 8 7 3 16.6934 15.8215 -180.0 0.91854 0.00 7 6 9 0.2968 0.3039 0.0 0.91588 0.00 9 2 9 8.9968 9.2119 -180.0 0.91588 0.00 9 6 1 62.8640 64.9481 -180.0 0.91535 0.00 10 4 2 26.4483 27.6941 180.0 0.91459 0.00 4 0 16 10260.3558 11472.1322 -0.0 0.91316 0.29 6 2 14 1226.0468 1411.7680 -0.0 0.91276 0.06 10 2 6 19.2559 20.7723 -180.0 0.91171 0.00 5 2 15 12.1859 13.2305 180.0 0.91064 0.00 10 3 5 50.0410 52.2909 -0.0 0.90933 0.00 8 4 10 515.9615 596.0391 0.0 0.90602 0.02 3 3 16 14426.2706 17179.3047 -0.0 0.90552 0.42 2 1 17 4.9888 6.0132 -180.0 0.90498 0.00 7 2 13 90.6379 98.4082 180.0 0.90420 0.00 9 5 6 279.9963 299.7453 -0.0 0.90410 0.01 10 1 7 3.4480 3.5389 0.0 0.90343 0.00 9 6 3 88.0706 90.4099 180.0 0.90317 0.00 8 3 11 5.9479 5.4999 180.0 0.90091 0.00 8 5 9 1.2268 1.1559 0.0 0.90065 0.00 8 0 12 6348.1612 6165.0014 0.0 0.90031 0.16 9 1 10 1407.9568 1364.8180 0.0 0.89855 0.07 4 2 16 13976.1568 13927.0167 -0.0 0.89806 0.82 11 1 0 5567.0989 5577.0400 0.0 0.89792 0.11 10 4 4 6039.1824 5278.4752 0.0 0.89655 0.25 8 7 5 49.8043 38.4359 180.0 0.89442 0.00 7 7 8 9906.5954 8556.3958 -0.0 0.89249 0.22 11 1 2 317.9254 317.9330 0.0 0.89211 0.01