#------------------------------------------------------------------------------
#$Date: 2025-07-01 14:04:12 +0300 (Tue, 01 Jul 2025) $
#$Revision: 1179 $
#$URL: svn://crystallography.net/testcod/cif/4/00/00/4000012.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_4000012
loop_
_publ_author_name
'Turrina, Alessandro'
'Garcia, Raquel'
'Cox, Paul A.'
'Casci, John L.'
'Wright, Paul A.'
_publ_section_title
;
 Retrosynthetic Co-Templating Method for the Preparation of
 Silicoaluminophosphate Molecular Sieves
;
_journal_issue                   14
_journal_name_full               'Chemistry of Materials'
_journal_page_first              4998
_journal_page_last               5012
_journal_paper_doi               10.1021/acs.chemmater.6b01676
_journal_volume                  28
_journal_year                    2016
_chemical_formula_moiety         'Al54 P40.5 Si13.5 O216'
_chemical_formula_sum            'Al O4 P0.75 Si0.25'
_chemical_formula_weight         121.23
_chemical_name_common
'SAPO SFW calcined dehydrated(trimethylamine,diDABCO-C8)'
_space_group_IT_number           148
_space_group_name_Hall           '-R 3'
_space_group_name_H-M_alt        'R -3 :H'
_symmetry_cell_setting           trigonal
_symmetry_space_group_name_Hall  '-R 3'
_symmetry_space_group_name_H-M   'R -3 :H'
_audit_creation_date             2015-02-08T14:06
_audit_creation_method           'from EXP file using GSAS2CIF'
_audit_update_record
' 2015-02-08T14:06  Initial CIF as created by GSAS2CIF'
_cell_angle_alpha                90.0
_cell_angle_beta                 90.0
_cell_angle_gamma                120.0
_cell_formula_units_Z            54
_cell_length_a                   13.79468(13)
_cell_length_b                   13.79468
_cell_length_c                   44.6557(9)
_cell_measurement_temperature    295
_cell_volume                     7359.20(16)
_computing_structure_refinement  GSAS
_diffrn_ambient_temperature      295
_diffrn_detector                 'Linear PSD'
_diffrn_radiation_polarisn_ratio 0.55
_diffrn_radiation_probe          x-ray
_diffrn_radiation_wavelength     1.54056
_diffrn_source                   X-ray
_exptl_absorpt_coefficient_mu    5.201
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  1.00000
_exptl_absorpt_process_details
;   GSAS Absorption/surface roughness correction: function number 0
 No correction is applied.
;
_exptl_crystal_density_diffrn    1.477
_exptl_crystal_F_000             3226.5
_pd_block_id
2015-02-08T14:06|SAPO-SFW_calcined_(diDABCO-C8|A_Turrina|Stoe_STADI_P
_pd_calc_method                  'Rietveld Refinement'
_pd_char_colour                  white
_pd_instr_location               ' ?'
_pd_meas_2theta_range_inc        0.01
_pd_meas_2theta_range_max        79.99
_pd_meas_2theta_range_min        3.0
_pd_meas_number_of_points        7700
_pd_phase_name
'from C:/gsas/PhD/SAPO-SFW/C8_calc_S783/SAPO SFW_calcined.cif'
_pd_proc_2theta_range_inc        0.01
_pd_proc_2theta_range_max        79.99
_pd_proc_2theta_range_min        3.0
_pd_proc_info_datetime           2015-02-08T14:06:46
_pd_proc_info_excluded_regions   ' ?'
_pd_proc_ls_background_function
;   GSAS Background function number 1 with 28 terms.
 Shifted Chebyshev function of 1st kind
      1:    484.263     2:   -286.773     3:    114.000     4:   -2.65179    
      5:    6.75243     6:   -87.1905     7:    117.174     8:   -69.2624    
      9:    19.4132    10:    29.5983    11:   -23.4317    12:   -1.02104    
     13:    31.8871    14:   -25.4203    15:    25.0385    16:   -6.52142    
     17:   -6.37426    18:   -2.09532    19:    8.59476    20:   -22.0235    
     21:    12.6278    22:   -1.85893    23:   -5.91378    24:    10.5991    
     25:   -4.71096    26:  -0.141987    27:   -2.92413    28:   -2.89644    
;
_pd_proc_ls_peak_cutoff          0.00100
_pd_proc_ls_profile_function
;
 CW Profile function number 4 with  16 terms
 Pseudovoigt profile coefficients as parameterized in
 P. Thompson, D.E. Cox & J.B. Hastings (1987). J. Appl. Cryst.,20,79-83.
 Asymmetry correction of L.W. Finger, D.E. Cox & A. P. Jephcoat (1994).
 J. Appl. Cryst.,27,892-900.
 Microstrain broadening by P.W. Stephens,  (1999). J. Appl. Cryst.,32,281-289.
 #1(GU)   =  353.109 #2(GV)   =   85.675 #3(GW)   =    2.074
 #4(GP)   =    0.000 #5(LX)   =    2.767 #6(ptec) =     0.00
 #7(trns) =     0.00 #8(shft) =  -1.8234 #9(sfec) =     0.00
 #10(S/L) =   0.0251 #11(H/L) =   0.0240 #12(eta) =   0.0000
 #13(S400 ) =  0.0E+00 #14(S004 ) =  4.2E-04 #15(S202 ) = -1.5E-03
 #16(S310 ) =  4.2E-03 #17(S211 ) =  0.0E+00
 Peak tails are ignored  where the intensity is below 0.0010 times the peak
   Aniso. broadening axis   0.0   0.0   1.0
;
_pd_proc_ls_prof_R_factor        0.0451
_pd_proc_ls_prof_wR_expected     0.0357
_pd_proc_ls_prof_wR_factor       0.0569
_pd_proc_number_of_points        7700
_pd_spec_mounting                ' ?'
_refine_ls_goodness_of_fit_all   1.65
_refine_ls_matrix_type           full
_refine_ls_number_parameters     88
_refine_ls_number_restraints     60
_refine_ls_R_Fsqd_factor         0.06715
_refine_ls_shift/su_max          0.05
_refine_ls_shift/su_mean         0.01
_reflns_d_resolution_high        1.200
_reflns_d_resolution_low         14.885
_reflns_limit_h_max              11
_reflns_limit_h_min              0
_reflns_limit_k_max              5
_reflns_limit_k_min              -5
_reflns_limit_l_max              37
_reflns_limit_l_min              -37
_reflns_number_total             1007
_cod_data_source_file            cm6b01676_si_001.cif
_cod_data_source_block           SAPO-SFW(C8)_calcined_publ
_cod_original_cell_volume        7359.20(15)
_cod_original_sg_symbol_H-M      'R -3'
_cod_database_code               4000012
_gsas_exptl_extinct_corr_t_min   1.00000
_gsas_exptl_extinct_corr_t_max   1.00000
loop_
_symmetry_equiv_pos_site_id
_symmetry_equiv_pos_as_xyz
1 +x,+y,+z
2 -y,x-y,+z
3 y-x,-x,+z
-1 -x,-y,-z
-2 +y,y-x,-z
-3 x-y,+x,-z
101 +x+1/3,+y+2/3,+z+2/3
102 -y+1/3,x-y+2/3,+z+2/3
103 y-x+1/3,-x+2/3,+z+2/3
-101 -x+2/3,-y+1/3,-z+1/3
-102 +y+2/3,y-x+1/3,-z+1/3
-103 x-y+2/3,+x+1/3,-z+1/3
201 +x+2/3,+y+1/3,+z+1/3
202 -y+2/3,x-y+1/3,+z+1/3
203 y-x+2/3,-x+1/3,+z+1/3
-201 -x+1/3,-y+2/3,-z+2/3
-202 +y+1/3,y-x+2/3,-z+2/3
-203 x-y+1/3,+x+2/3,-z+2/3
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_thermal_displace_type
_atom_site_U_iso_or_equiv
_atom_site_symmetry_multiplicity
Al Al1 0.9947(6) 0.2237(6) 0.25578(19) 1.0 Uiso 0.0233(6) 18
Al Al2 0.2283(7) 0.9997(6) 0.81163(19) 1.0 Uiso 0.0233(6) 18
Al Al3 0.0044(7) 0.2271(6) 0.03462(21) 1.0 Uiso 0.0233(6) 18
O O1 0.2624(9) 1.0007(9) 0.77477(15) 1.0 Uiso 0.0222(11) 18
O O2 0.9958(9) 0.2589(9) 0.21882(14) 1.0 Uiso 0.0222(11) 18
O O3 0.1212(5) 0.2369(6) 0.26582(24) 1.0 Uiso 0.0222(11) 18
O O4 0.8881(5) 0.0883(6) 0.26233(20) 1.0 Uiso 0.0222(11) 18
O O5 0.3087(7) 0.9808(6) 0.72243(24) 1.0 Uiso 0.0222(11) 18
O O6 0.9685(7) 0.3102(7) 0.27779(22) 1.0 Uiso 0.0222(11) 18
O O7 0.9097(5) 0.1054(5) 0.18145(24) 1.0 Uiso 0.0222(11) 18
O O8 0.9826(7) 0.3062(7) 0.16624(25) 1.0 Uiso 0.0222(11) 18
O O9 0.1137(4) 0.2390(7) 0.17764(21) 1.0 Uiso 0.0222(11) 18
O O10 0.0035(9) 0.2535(9) -0.00303(13) 1.0 Uiso 0.0222(11) 18
O O11 0.1329(5) 0.2458(5) 0.04592(21) 1.0 Uiso 0.0222(11) 18
O O12 0.9008(5) 0.0897(5) 0.04332(23) 1.0 Uiso 0.0222(11) 18
P P1 0.23270(18) 1.00583(18) 0.74208(18) 0.75 Uiso 0.0233(6) 18
P P2 1.00231(18) 0.22923(18) 0.18636(18) 0.75 Uiso 0.0233(6) 18
P P3 0.22369(19) -0.00137(19) 0.96356(19) 0.75 Uiso 0.0233(6) 18
Si Si1 0.23270(18) 1.00583(18) 0.74208(18) 0.25 Uiso 0.0233(6) 18
Si Si2 1.00231(18) 0.22923(18) 0.18636(18) 0.25 Uiso 0.0233(6) 18
Si Si3 0.22369(19) -0.00137(19) 0.96356(19) 0.25 Uiso 0.0233(6) 18
loop_
_atom_type_symbol
_atom_type_number_in_cell
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_Cromer_Mann_a1
_atom_type_scat_Cromer_Mann_a2
_atom_type_scat_Cromer_Mann_a3
_atom_type_scat_Cromer_Mann_a4
_atom_type_scat_Cromer_Mann_b1
_atom_type_scat_Cromer_Mann_b2
_atom_type_scat_Cromer_Mann_b3
_atom_type_scat_Cromer_Mann_b4
_atom_type_scat_Cromer_Mann_c
_atom_type_scat_source
Al 54.0 0.000 0.000 6.42020 3.03870 1.90020 0.74260 1.59360 31.5472 1.96460
85.0886 1.11510 International_Tables_Vol_C
O 216.0 0.000 0.000 3.04850 13.2771 2.28680 5.70110 1.54630 0.32390 0.86700
32.9089 0.25080 International_Tables_Vol_C
P 40.5 0.000 0.000 6.43450 1.90670 4.17910 27.1570 1.78000 0.52600 1.49080
68.1645 1.11490 International_Tables_Vol_C
Si 13.5 0.000 0.000 6.29150 2.43860 3.03530 32.3337 1.98910 0.67850 1.54100
81.6937 1.14070 International_Tables_Vol_C
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_2
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
O2 Al1 O3 110.8(6) 1_555 . 1_655 N
O2 Al1 O4 110.5(6) 1_555 . 1_555 N
O2 Al1 O6 109.1(6) 1_555 . 1_555 N
O3 Al1 O4 109.9(5) 1_655 . 1_555 N
O3 Al1 O6 109.4(6) 1_655 . 1_555 N
O4 Al1 O6 107.0(6) 1_555 . 1_555 N
O1 Al2 O7 111.0(6) 1_555 . -1_666 N
O1 Al2 O8 108.3(5) 1_555 . 101_455 N
O1 Al2 O9 111.9(6) 1_555 . -2_566 N
O7 Al2 O8 108.4(6) -1_666 . 101_455 N
O7 Al2 O9 107.1(7) -1_666 . -2_566 N
O8 Al2 O9 110.2(7) 101_455 . -2_566 N
O5 Al3 O10 111.0(6) 201_444 . 1_555 N
O5 Al3 O11 108.3(6) 201_444 . 1_555 N
O5 Al3 O12 106.5(6) 201_444 . 1_455 N
O10 Al3 O11 111.5(6) 1_555 . 1_555 N
O10 Al3 O12 110.9(6) 1_555 . 1_455 N
O11 Al3 O12 108.4(5) 1_555 . 1_455 N
Al2 O1 P1 147.3(7) 1_555 . 1_555 N
Al2 O1 Si1 147.3(7) 1_555 . 1_555 N
P1 O1 Si1 0.0 1_555 . 1_555 N
Al1 O2 P2 146.3(7) 1_555 . 1_555 N
Al1 O2 Si2 146.3(7) 1_555 . 1_555 N
P2 O2 Si2 0.0 1_555 . 1_555 N
Al1 O3 P1 150.6(7) 1_455 . -3_656 N
Al1 O3 Si1 150.6(7) 1_455 . -3_656 N
P1 O3 Si1 0.0 -3_656 . -3_656 N
Al1 O4 P1 150.8(6) 1_555 . -1_666 N
Al1 O4 Si1 150.8(6) 1_555 . -1_666 N
P1 O4 Si1 0.0 -1_666 . -1_666 N
Al3 O5 P1 153.3(6) 101_555 . 1_555 N
Al3 O5 Si1 153.3(6) 101_555 . 1_555 N
P1 O5 Si1 0.0 1_555 . 1_555 N
Al1 O6 P3 151.1(7) 1_555 . 201_554 N
Al1 O6 Si3 151.1(7) 1_555 . 201_554 N
P3 O6 Si3 0.0 201_554 . 201_554 N
Al2 O7 P2 147.4(6) -1_666 . 1_555 N
Al2 O7 Si2 147.4(6) -1_666 . 1_555 N
P2 O7 Si2 0.0 1_555 . 1_555 N
Al2 O8 P2 150.6(6) 201_544 . 1_555 N
Al2 O8 Si2 150.6(6) 201_544 . 1_555 N
P2 O8 Si2 0.0 1_555 . 1_555 N
Al2 O9 P2 147.9(7) -3_656 . 1_455 N
Al2 O9 Si2 147.9(7) -3_656 . 1_455 N
P2 O9 Si2 0.0 1_455 . 1_455 N
Al3 O10 P3 153.4(9) 1_555 . 2_554 N
Al3 O10 Si3 153.4(9) 1_555 . 2_554 N
P3 O10 Si3 0.0 2_554 . 2_554 N
Al3 O11 P3 142.2(6) 1_555 . -3_556 N
Al3 O11 Si3 142.2(6) 1_555 . -3_556 N
P3 O11 Si3 0.0 -3_556 . -3_556 N
Al3 O12 P3 141.6(6) 1_655 . -1_656 N
Al3 O12 Si3 141.6(6) 1_655 . -1_656 N
P3 O12 Si3 0.0 -1_656 . -1_656 N
O1 P1 O3 112.8(7) 1_555 . -2_566 N
O1 P1 O4 106.7(5) 1_555 . -1_666 N
O1 P1 O5 107.9(5) 1_555 . 1_555 N
O3 P1 O4 107.3(5) -2_566 . -1_666 N
O3 P1 O5 113.6(5) -2_566 . 1_555 N
O4 P1 O5 108.2(6) -1_666 . 1_555 N
O2 P2 O7 107.6(5) 1_555 . 1_555 N
O2 P2 O8 108.7(5) 1_555 . 1_555 N
O2 P2 O9 114.4(6) 1_555 . 1_655 N
O7 P2 O8 110.5(5) 1_555 . 1_555 N
O7 P2 O9 107.5(4) 1_555 . 1_655 N
O8 P2 O9 108.2(5) 1_555 . 1_655 N
O6 P3 O10 110.1(6) 101_445 . 3_556 N
O6 P3 O11 104.8(5) 101_445 . -2_556 N
O6 P3 O12 110.4(6) 101_445 . -1_656 N
O10 P3 O11 111.4(6) 3_556 . -2_556 N
O10 P3 O12 110.7(5) 3_556 . -1_656 N
O11 P3 O12 109.2(4) -2_556 . -1_656 N
O1 Si1 O3 112.8(7) 1_555 . -2_566 N
O1 Si1 O4 106.7(5) 1_555 . -1_666 N
O1 Si1 O5 107.9(5) 1_555 . 1_555 N
O3 Si1 O4 107.3(5) -2_566 . -1_666 N
O3 Si1 O5 113.6(5) -2_566 . 1_555 N
O4 Si1 O5 108.2(6) -1_666 . 1_555 N
O2 Si2 O7 107.6(5) 1_555 . 1_555 N
O2 Si2 O8 108.7(5) 1_555 . 1_555 N
O2 Si2 O9 114.4(6) 1_555 . 1_655 N
O7 Si2 O8 110.5(5) 1_555 . 1_555 N
O7 Si2 O9 107.5(4) 1_555 . 1_655 N
O8 Si2 O9 108.2(5) 1_555 . 1_655 N
O6 Si3 O10 110.1(6) 101_445 . 3_556 N
O6 Si3 O11 104.8(5) 101_445 . -2_556 N
O6 Si3 O12 110.4(6) 101_445 . -1_656 N
O10 Si3 O11 111.4(6) 3_556 . -2_556 N
O10 Si3 O12 110.7(5) 3_556 . -1_656 N
O11 Si3 O12 109.2(4) -2_556 . -1_656 N
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Al1 O2 1.719(8) . 1_555 N
Al1 O3 1.720(8) . 1_655 N
Al1 O4 1.728(8) . 1_555 N
Al1 O6 1.719(8) . 1_555 N
Al1 Si2 3.102(11) . 1_555 N
Al2 O1 1.710(8) . 1_555 N
Al2 O7 1.749(7) . -1_666 N
Al2 O8 1.717(7) . 101_455 N
Al2 O9 1.732(10) . -2_566 N
Al2 Si1 3.107(11) . 1_555 N
Al3 O5 1.724(8) . 201_444 N
Al3 O10 1.722(8) . 1_555 N
Al3 O11 1.734(8) . 1_555 N
Al3 O12 1.754(8) . 1_455 N
Al3 P3 3.069(8) . -3_556 N
Al3 Si3 3.069(8) . -3_556 N
O1 Al2 1.710(8) . 1_555 N
O1 P1 1.528(8) . 1_555 N
O1 Si1 1.528(8) . 1_555 N
O2 Al1 1.719(8) . 1_555 N
O2 P2 1.521(8) . 1_555 N
O2 Si2 1.521(8) . 1_555 N
O3 Al1 1.720(8) . 1_455 N
O3 P1 1.529(7) . -3_656 N
O3 Si1 1.529(7) . -3_656 N
O4 Al1 1.728(8) . 1_555 N
O4 P1 1.530(6) . -1_666 N
O4 Si1 1.530(6) . -1_666 N
O5 Al3 1.724(8) . 101_555 N
O5 P1 1.533(6) . 1_555 N
O5 Si1 1.533(6) . 1_555 N
O6 Al1 1.719(8) . 1_555 N
O6 P3 1.517(6) . 201_554 N
O6 Si3 1.517(6) . 201_554 N
O7 Al2 1.749(7) . -1_666 N
O7 P2 1.554(6) . 1_555 N
O7 Si2 1.554(6) . 1_555 N
O8 Al2 1.717(7) . 201_544 N
O8 P2 1.516(6) . 1_555 N
O8 Si2 1.516(6) . 1_555 N
O9 Al2 1.732(10) . -3_656 N
O9 P2 1.524(6) . 1_455 N
O9 Si2 1.524(6) . 1_455 N
O10 Al3 1.722(8) . 1_555 N
O10 P3 1.539(8) . 2_554 N
O10 Si3 1.539(8) . 2_554 N
O11 Al3 1.734(8) . 1_555 N
O11 P3 1.508(8) . -3_556 N
O11 Si3 1.508(8) . -3_556 N
O12 Al3 1.754(8) . 1_655 N
O12 P3 1.561(7) . -1_656 N
O12 Si3 1.561(7) . -1_656 N
P1 O1 1.528(8) . 1_555 N
P1 O3 1.529(7) . -2_566 N
P1 O4 1.530(6) . -1_666 N
P1 O5 1.533(6) . 1_555 N
P2 O2 1.521(8) . 1_555 N
P2 O7 1.554(6) . 1_555 N
P2 O8 1.516(6) . 1_555 N
P2 O9 1.524(6) . 1_655 N
P3 Al3 3.069(8) . -2_556 N
P3 O6 1.517(6) . 101_445 N
P3 O10 1.539(8) . 3_556 N
P3 O11 1.508(8) . -2_556 N
P3 O12 1.561(7) . -1_656 N
Si1 Al2 3.107(11) . 1_555 N
Si1 O1 1.528(8) . 1_555 N
Si1 O3 1.529(7) . -2_566 N
Si1 O4 1.530(6) . -1_666 N
Si1 O5 1.533(6) . 1_555 N
Si2 Al1 3.102(11) . 1_555 N
Si2 O2 1.521(8) . 1_555 N
Si2 O7 1.554(6) . 1_555 N
Si2 O8 1.516(6) . 1_555 N
Si2 O9 1.524(6) . 1_655 N
Si3 Al3 3.069(8) . -2_556 N
Si3 O6 1.517(6) . 101_445 N
Si3 O10 1.539(8) . 3_556 N
Si3 O11 1.508(8) . -2_556 N
Si3 O12 1.561(7) . -1_656 N
loop_
_pd_meas_counts_total
_pd_proc_ls_weight
_pd_proc_intensity_bkg_calc
_pd_calc_intensity_total
16.0 0.0 122.56589 .
12.0 0.0 191.84262 .
13.0 0.0 259.49185 .
16.0 0.0 325.54266 .
27.0 0.0 390.02289 .
28.0 0.0 452.95163 .
28.0 0.0 514.35541 .
20.0 0.0 574.26013 .
26.0 0.0 632.68988 .
30.0 0.0 689.66437 .
36.0 0.0 745.21045 .
45.0 0.0 799.34497 .
53.0 0.0 852.09955 .
70.0 0.0 903.49414 .
90.0 0.0 953.54846 .
101.0 0.0 1002.28345 .
128.0 0.0 1049.72339 .
170.0 0.0 1095.88770 .
240.0 0.0 1140.80066 .
251.0 0.0 1184.48145 .
331.0 0.0 1226.95178 .
404.0 0.0 1268.22766 .
464.0 0.0 1308.33447 .
597.0 0.0 1347.29041 .
717.0 0.0 1385.11584 .
811.0 0.0 1421.82813 .
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2334.0 0.000428 523.34186 2562.06885
2484.0 0.000403 523.50061 2803.42676
2713.0 0.000369 523.65851 3075.76050
3054.0 0.0003274 523.81567 3380.39038
3357.0 0.0002979 523.97198 3716.00830
3739.0 0.0002675 524.12744 4077.49146
4050.0 0.0002469 524.28198 4454.83936
4507.0 0.0002219 524.43573 4832.52051
4798.0 0.0002084 524.58850 5189.48779
5150.0 0.0001942 524.74036 5500.08789
5259.0 0.0001902 524.89124 5735.92383
5427.0 0.0001843 525.04126 5868.76074
5554.0 0.0001801 525.19025 5874.56494
5218.0 0.0001916 525.33820 5738.76611
4999.0 0.0002000 525.48523 5461.81982
4667.0 0.0002143 525.63116 5062.24023
4121.0 0.0002427 525.77612 4573.92188
3580.0 0.0002793 525.92004 4038.22388
3203.0 0.0003122 526.06281 3495.33179
2611.0 0.000383 526.20453 2978.62378
2263.0 0.000442 526.34521 2512.38159
1951.0 0.000513 526.48474 2111.59106
1648.0 0.000607 526.62317 1782.85132
1431.0 0.000699 526.76050 1525.95630
1349.0 0.000741 526.89661 1335.86096
1313.0 0.000762 527.03162 1204.72681
1177.0 0.000850 527.16541 1123.73474
1215.0 0.000823 527.29803 1084.44800
1156.0 0.000865 527.42950 1079.63159
1202.0 0.000832 527.55975 1103.56750
1274.0 0.000785 527.68884 1151.99731
1368.0 0.000731 527.81665 1221.87012
1401.0 0.000714 527.94324 1311.04004
1524.0 0.000656 528.06860 1418.00427
1603.0 0.000624 528.19269 1541.73938
1751.0 0.000571 528.31555 1681.62598
1878.0 0.000532 528.43713 1837.42090
1988.0 0.000503 528.55743 2009.27869
2113.0 0.000473 528.67645 2197.78906
2309.0 0.000433 528.79419 2404.04321
2541.0 0.000394 528.91064 2629.72070
2786.0 0.000359 529.02576 2877.20728
3093.0 0.0003233 529.13959 3149.76392
3288.0 0.0003041 529.25214 3451.72827
3698.0 0.0002704 529.36334 3788.75806
4019.0 0.0002488 529.47321 4168.03467
4534.0 0.0002206 529.58173 4598.31250
5049.0 0.0001981 529.68896 5089.63330
5650.0 0.0001770 529.79480 5652.42432
6314.0 0.0001584 529.89935 6295.75586
7228.0 0.0001384 530.00250 7024.55322
8061.0 0.0001241 530.10437 7835.89844
9072.0 0.0001102 530.20483 8714.83887
10084.0 0.0000992 530.30402 9630.60742
11146.0 0.0000897 530.40173 10534.40137
12016.0 0.0000832 530.49817 11359.84082
12863.0 0.0000777 530.59326 12026.89355
13284.0 0.0000753 530.68695 12449.66699
13563.0 0.0000737 530.77924 12548.63965
13214.0 0.0000757 530.87024 12268.28320
12356.0 0.0000809 530.95984 11598.39063
11113.0 0.0000900 531.04803 10588.72754
9821.0 0.0001018 531.13495 9341.76074
8229.0 0.0001215 531.22046 7983.29932
6670.0 0.0001499 531.30463 6630.82324
5281.0 0.0001894 531.38739 5375.24951
4136.0 0.0002418 531.46887 4275.69385
3187.0 0.0003138 531.54895 3361.14038
2522.0 0.000397 531.62762 2635.35742
2019.0 0.000495 531.70502 2083.59741
1632.0 0.000613 531.78101 1679.94263
1313.0 0.000762 531.85565 1394.05786
1194.0 0.000838 531.92902 1196.39807
1051.0 0.000951 532.00104 1061.44519
930.0 0.001075 532.07172 969.09583
880.0 0.001136 532.14099 904.67010
800.0 0.001250 532.20898 858.12903
780.0 0.001282 532.27563 822.94501
745.0 0.001342 532.34100 795.08972
721.0 0.001387 532.40503 772.13464
731.0 0.001368 532.46777 752.63416
710.0 0.001408 532.52924 735.71655
689.0 0.001451 532.58942 720.83344
676.0 0.001479 532.64825 707.61737
672.0 0.001488 532.70581 695.80426
616.0 0.001623 532.76215 685.19202
644.0 0.001553 532.81714 675.61865
633.0 0.001580 532.87097 666.95135
612.0 0.001634 532.92346 659.07782
603.0 0.001658 532.97479 651.90375
644.0 0.001553 533.02484 645.34808
626.0 0.001597 533.07367 639.34106
585.0 0.001709 533.12128 633.82288
634.0 0.001577 533.16766 628.74139
642.0 0.001558 533.21289 624.05145
600.0 0.001667 533.25690 619.71350
633.0 0.001580 533.29974 615.69275
576.0 0.001736 533.34143 611.95880
635.0 0.001575 533.38196 608.48474
595.0 0.001681 533.42133 605.24677
604.0 0.001656 533.45959 602.21558
599.0 0.001669 533.49670 599.38861
588.0 0.001701 533.53271 596.74097
596.0 0.001678 533.56763 594.25751
572.0 0.001748 533.60144 591.92487
538.0 0.001859 533.63422 589.73077
570.0 0.001754 533.66595 587.66431
600.0 0.001667 533.69659 585.71582
567.0 0.001764 533.72614 583.87616
600.0 0.001667 533.75476 582.13727
552.0 0.001812 533.78235 580.49188
571.0 0.001751 533.80890 578.93323
548.0 0.001825 533.83453 577.45514
532.0 0.001880 533.85913 576.05219
537.0 0.001862 533.88281 574.71918
540.0 0.001852 533.90552 573.45142
581.0 0.001721 533.92737 572.24475
538.0 0.001859 533.94824 571.09509
551.0 0.001815 533.96826 569.99872
591.0 0.001692 533.98737 568.95270
567.0 0.001764 534.00568 567.95355
569.0 0.001757 534.02307 566.99866
546.0 0.001832 534.03967 566.08527
555.0 0.001802 534.05548 565.21094
595.0 0.001681 534.07043 559.98859
576.0 0.001736 534.08466 559.26129
552.0 0.001812 534.09808 558.56488
553.0 0.001808 534.11078 557.89752
536.0 0.001866 534.12274 557.25775
532.0 0.001880 534.13397 556.64386
546.0 0.001832 534.14453 556.05444
588.0 0.001701 534.15436 555.48846
581.0 0.001721 534.16357 555.98505
585.0 0.001709 534.17218 555.47742
527.0 0.001898 534.18011 554.98987
534.0 0.001873 534.18750 554.52155
555.0 0.001802 534.19427 554.07147
536.0 0.001866 534.20044 553.63873
611.0 0.001637 534.20612 553.22272
569.0 0.001757 534.21124 552.82245
543.0 0.001842 534.21582 552.43738
556.0 0.001799 534.21997 552.06665
567.0 0.001764 534.22363 551.70990
567.0 0.001764 534.22681 551.36646
565.0 0.001770 534.22955 551.03564
556.0 0.001799 534.23199 550.71722
568.0 0.001761 534.23395 550.41058
559.0 0.001789 534.23553 550.11536
577.0 0.001733 534.23676 549.83093
541.0 0.001848 534.23773 549.55731
536.0 0.001866 534.23840 549.29395
571.0 0.001751 534.23865 549.04065
565.0 0.001770 534.23877 548.79718
520.0 0.001923 534.23859 548.56348
561.0 0.001783 534.23822 548.33948
547.0 0.001828 534.23761 548.12543
539.0 0.001855 534.23682 547.92157
607.0 0.001647 534.23590 547.72858
557.0 0.001795 534.23480 547.54730
564.0 0.001773 534.23364 547.37897
508.0 0.001969 534.23236 547.22510
559.0 0.001789 534.23102 547.08746
548.0 0.001825 534.22961 546.96790
494.0 0.002024 534.22821 546.86829
553.0 0.001808 534.22681 546.79041
560.0 0.001786 534.22540 546.73566
587.0 0.001704 534.22400 546.70483
582.0 0.001718 534.22272 546.69867
569.0 0.001757 534.22156 546.71753
541.0 0.001848 534.22046 546.76147
543.0 0.001842 534.21948 537.58240
544.0 0.001838 534.21869 538.20349
582.0 0.001718 534.21808 538.48743
553.0 0.001808 534.21765 538.79706
562.0 0.001779 534.21741 539.13531
554.0 0.001805 534.21753 539.50671
535.0 0.001869 534.21783 539.91699
584.0 0.001712 534.21844 540.37390
549.0 0.001821 534.21942 540.88696
589.0 0.001698 534.22070 541.46771
568.0 0.001761 534.22235 542.12848
546.0 0.001832 534.22443 542.88080
544.0 0.001838 534.22687 543.73224
542.0 0.001845 534.22980 544.68146
577.0 0.001733 534.23322 545.71277
544.0 0.001838 534.23706 546.79102
582.0 0.001718 534.24139 547.85822
572.0 0.001748 534.24634 548.83380
559.0 0.001789 534.25183 549.61981
532.0 0.001880 534.25787 550.11182
568.0 0.001761 534.26453 550.21625
567.0 0.001764 534.27179 549.87665
588.0 0.001701 534.27979 549.10333
532.0 0.001880 534.28839 547.98505
554.0 0.001805 534.29779 546.66644
569.0 0.001757 534.30780 545.30048
507.0 0.001972 534.31866 544.01410
559.0 0.001789 534.33026 542.89301
544.0 0.001838 534.34265 541.98309
572.0 0.001748 534.35590 541.29578
557.0 0.001795 534.37000 540.81696
572.0 0.001748 534.38495 540.51715
480.0 0.002083 534.40082 540.36078
551.0 0.001815 534.41760 540.31256
538.0 0.001859 534.43536 540.34277
534.0 0.001873 534.45404 540.42841
524.0 0.001908 534.47375 540.55310
554.0 0.001805 534.49451 540.70654
572.0 0.001748 534.51630 540.88208
553.0 0.001808 534.53918 541.07959
563.0 0.001776 534.56311 541.29041
524.0 0.001908 534.58820 541.51715
581.0 0.001721 534.61444 541.75989
581.0 0.001721 534.64185 542.01868
572.0 0.001748 534.67041 542.29456
540.0 0.001852 534.70020 542.58807
567.0 0.001764 534.73126 542.90027
546.0 0.001832 534.76361 543.23242
561.0 0.001783 534.79718 543.58563
547.0 0.001828 534.83215 543.96179
565.0 0.001770 534.86841 544.36230
632.0 0.001582 534.90607 544.78918
563.0 0.001776 534.94507 545.24475
547.0 0.001828 534.98547 545.73145
575.0 0.001739 535.02734 546.25195
562.0 0.001779 535.07068 546.80981
563.0 0.001776 535.11554 547.40857
590.0 0.001695 535.16187 548.05255
584.0 0.001712 535.20972 548.74677
555.0 0.001802 535.25916 549.49762
566.0 0.001767 535.31012 550.31329
590.0 0.001695 535.36273 551.20398
603.0 0.001658 535.41699 552.18378
595.0 0.001681 535.47284 553.27301
630.0 0.001587 535.53040 554.50024
581.0 0.001721 535.58966 555.90649
576.0 0.001736 535.65070 557.55017
591.0 0.001692 535.71338 559.51239
541.0 0.001848 535.77789 561.90387
596.0 0.001678 535.84412 564.87012
588.0 0.001701 535.91229 568.59668
629.0 0.001590 535.98218 573.31085
608.0 0.001645 536.05402 579.28125
583.0 0.001715 536.12769 586.81195
616.0 0.001623 536.20325 596.23193
679.0 0.001473 536.28082 607.88062
660.0 0.001515 536.36029 622.08911
678.0 0.001475 536.44171 639.16241
704.0 0.001420 536.52521 659.36871
721.0 0.001387 536.61066 682.94037
679.0 0.001473 536.69812 710.08398
742.0 0.001348 536.78772 741.00024
774.0 0.001292 536.87939 775.92065
817.0 0.001224 536.97321 815.15015
841.0 0.001189 537.06903 859.10583
853.0 0.001172 537.16711 908.36340
947.0 0.001056 537.26733 963.69769
966.0 0.001035 537.36975 1026.10242
966.0 0.001035 537.47443 1096.78723
1041.0 0.000961 537.58130 1177.11890
1168.0 0.000856 537.69043 1268.47827
1146.0 0.000873 537.80182 1372.02185
1261.0 0.000793 537.91553 1488.32288
1343.0 0.000745 538.03162 1616.91467
1481.0 0.000675 538.14996 1755.79517
1633.0 0.000612 538.27075 1900.97681
1817.0 0.000550 538.39386 2046.21252
1886.0 0.000530 538.51941 2183.01123
1974.0 0.000507 538.64734 2301.02856
2132.0 0.000469 538.77777 2388.87842
2079.0 0.000481 538.91064 2435.38989
2144.0 0.000466 539.04602 2431.38916
2030.0 0.000493 539.18390 2371.99316
1973.0 0.000507 539.32428 2258.87256
1786.0 0.000560 539.46722 2101.05859
1618.0 0.000618 539.61273 1913.14258
1448.0 0.000691 539.76080 1711.63770
1298.0 0.000770 539.91150 1511.64868
1218.0 0.000821 540.06482 1325.02563
1017.0 0.000983 540.22070 1159.79675
940.0 0.001064 540.37933 1020.29779
845.0 0.001183 540.54065 907.67719
775.0 0.001290 540.70465 820.62817
725.0 0.001379 540.87134 756.22614
754.0 0.001326 541.04071 710.74347
724.0 0.001381 541.21295 680.32190
628.0 0.001592 541.38788 661.43970
654.0 0.001529 541.56555 651.16705
679.0 0.001473 541.74609 647.24438
712.0 0.001404 541.92950 648.04156
680.0 0.001471 542.11566 652.45502
693.0 0.001443 542.30475 659.78931
707.0 0.001414 542.49664 669.65295
733.0 0.001364 542.69147 681.87842
758.0 0.001319 542.88916 696.46857
719.0 0.001391 543.08978 713.56561
745.0 0.001342 543.29340 733.43329
768.0 0.001302 543.49988 756.44086
746.0 0.001340 543.70941 783.03784
766.0 0.001305 543.92188 813.70605
822.0 0.001217 544.13739 848.87592
859.0 0.001164 544.35590 888.80389
856.0 0.001168 544.57739 933.39905
912.0 0.001096 544.80200 982.07642
949.0 0.001054 545.02960 1033.52673
1019.0 0.000981 545.26038 1085.63257
1086.0 0.000921 545.49414 1135.43848
1144.0 0.000874 545.73108 1179.26428
1145.0 0.000873 545.97107 1212.97437
1149.0 0.000870 546.21423 1232.40906
1112.0 0.000899 546.46057 1234.00916
1115.0 0.000897 546.71002 1215.64282
1109.0 0.000902 546.96265 1177.47925
1088.0 0.000919 547.21851 1122.41833
1019.0 0.000981 547.47754 1055.56982
919.0 0.001088 547.73981 982.95349
883.0 0.001133 548.00525 910.20282
836.0 0.001196 548.27399 841.80444
762.0 0.001312 548.54596 780.83917
749.0 0.001335 548.82117 729.01025
697.0 0.001435 549.09967 686.81732
687.0 0.001456 549.38147 653.82208
666.0 0.001502 549.66656 628.95691
635.0 0.001575 549.95496 610.83038
637.0 0.001570 550.24670 597.98370
662.0 0.001511 550.54175 589.07300
632.0 0.001582 550.84015 582.97095
593.0 0.001686 551.14191 578.80109
592.0 0.001689 551.44702 575.92444
621.0 0.001610 551.75549 573.90045
603.0 0.001658 552.06738 572.43970
591.0 0.001692 552.38269 571.35962
580.0 0.001724 552.70135 570.54816
621.0 0.001610 553.02344 569.93787
591.0 0.001692 553.34894 569.48761
619.0 0.001616 553.67792 569.17163
609.0 0.001642 554.01031 568.97272
575.0 0.001739 554.34613 568.87769
563.0 0.001776 554.68542 568.87543
576.0 0.001736 555.02820 568.95538
601.0 0.001664 555.37445 569.10577
577.0 0.001733 555.72418 569.31433
567.0 0.001764 556.07739 569.56665
586.0 0.001706 556.43408 571.75287
631.0 0.001585 556.79431 572.07806
579.0 0.001727 557.15802 572.39642
649.0 0.001541 557.52527 572.68982
602.0 0.001661 557.89606 572.94061
624.0 0.001603 558.27039 573.13373
600.0 0.001667 558.64825 573.25751
579.0 0.001727 559.02960 573.30621
608.0 0.001645 559.41455 573.28015
568.0 0.001761 559.80310 573.18744
623.0 0.001605 560.19513 573.04218
627.0 0.001595 560.59070 572.86310
601.0 0.001664 560.98999 572.67023
579.0 0.001727 561.39276 572.48309
592.0 0.001689 561.79907 572.31879
631.0 0.001585 562.20905 572.19141
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642.0 0.001558 563.03973 572.08508
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616.0 0.001623 563.88477 572.20502
592.0 0.001689 564.31274 572.34955
604.0 0.001656 564.74426 572.54584
610.0 0.001639 565.17944 572.78882
577.0 0.001733 565.61823 573.07318
579.0 0.001727 566.06061 573.39337
599.0 0.001669 566.50659 573.74426
632.0 0.001582 566.95624 574.12115
590.0 0.001695 567.40948 574.52026
597.0 0.001675 567.86639 574.93842
608.0 0.001645 568.32690 575.37317
594.0 0.001684 568.79102 575.82269
599.0 0.001669 569.25873 576.28534
627.0 0.001595 569.73016 576.76038
605.0 0.001653 570.20520 577.24713
607.0 0.001647 570.68390 577.74518
635.0 0.001575 571.16620 578.25415
652.0 0.001534 571.65210 578.77386
632.0 0.001582 572.14166 579.30450
589.0 0.001698 572.63477 579.84576
642.0 0.001558 573.13159 580.39807
635.0 0.001575 573.63202 579.48773
606.0 0.001650 574.13611 580.08759
632.0 0.001582 574.64380 580.69818
623.0 0.001605 575.15515 581.31970
612.0 0.001634 575.67010 581.95227
628.0 0.001592 576.18866 582.73291
607.0 0.001647 576.71075 583.39081
592.0 0.001689 577.23657 584.06116
606.0 0.001650 577.76605 584.74414
656.0 0.001524 578.29907 585.44031
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633.0 0.001580 579.37598 586.87433
601.0 0.001664 579.91992 587.61328
623.0 0.001605 580.46735 588.36774
649.0 0.001541 581.01831 589.13837
637.0 0.001570 581.57300 589.92609
631.0 0.001585 582.13123 590.73193
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613.0 0.001631 584.40009 594.15588
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602.0 0.001661 586.72583 597.96674
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681.0 0.001468 595.30994 616.95667
671.0 0.001490 595.94904 621.88776
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671.0 0.001490 598.54016 632.52789
646.0 0.001548 599.19647 636.23755
678.0 0.001475 599.85614 640.67816
668.0 0.001497 600.51923 646.09851
768.0 0.001302 601.18561 652.81464
720.0 0.001389 601.85522 661.21338
748.0 0.001337 602.52838 671.75262
714.0 0.001401 603.20483 684.95306
756.0 0.001323 603.88458 701.38458
760.0 0.001316 604.56763 721.64624
849.0 0.001178 605.25403 746.34259
813.0 0.001230 605.94373 776.06293
832.0 0.001202 606.63666 811.37671
845.0 0.001183 607.33270 852.84802
940.0 0.001064 608.03217 901.06769
994.0 0.001006 608.73492 956.69995
1054.0 0.000949 609.44086 1020.55475
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1342.0 0.000745 612.29663 1383.27820
1419.0 0.000705 613.01831 1508.01025
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389.0 . . .
