#------------------------------------------------------------------------------
#$Date: 2016-03-25 16:28:01 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179971 $
#$URL: svn://www.crystallography.net/cod/cif/7/02/65/7026512.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_7026512
loop_
_publ_author_name
'Ali, Shoaib'
'Muryn, Christopher A.'
'Tuna, Floriana'
'Winpenny, Richard E. P.'
_publ_section_title
;
 Synthesis and structural and magnetic characterisation of cobalt(ii)
 complexes of mixed phosphonate-antimonate ligands.
;
_journal_issue                   40
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              9588
_journal_page_last               9597
_journal_paper_doi               10.1039/c0dt00482k
_journal_volume                  39
_journal_year                    2010
_chemical_formula_sum            'C66 H66 Cl4 Co2 N2 O20 P4 Sb4'
_chemical_formula_weight         2077.75
_chemical_name_systematic
;
?
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 100.943(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   12.5774(5)
_cell_length_b                   11.8992(4)
_cell_length_c                   24.9253(8)
_cell_measurement_reflns_used    9167
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      28.4909
_cell_measurement_theta_min      2.7100
_cell_volume                     3662.5(2)
_computing_cell_refinement
;
CrysAlis RED, Oxford Diffraction Ltd.,
Version 1.171.32.4 (release 27-04-2006 CrysAlis171 .NET)
(compiled Apr 27 2007,17:53:11)
;
_computing_data_collection
;
CrysAlis CCD, Oxford Diffraction Ltd.,
Version 1.171.32.4 (release 27-04-2006 CrysAlis171 .NET)
(compiled Apr 27 2007,17:53:11)
;
_computing_data_reduction
;
CrysAlis RED, Oxford Diffraction Ltd.,
Version 1.171.32.4 (release 27-04-2006 CrysAlis171 .NET)
(compiled Apr 27 2007,17:53:11)
;
_computing_molecular_graphics    'SHELXL-97 (Sheldrick, 1997)'
_computing_publication_material  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      100(2)
_diffrn_detector_area_resol_mean 8.3367
_diffrn_measured_fraction_theta_full 0.994
_diffrn_measured_fraction_theta_max 0.994
_diffrn_measurement_device_type  'Oxford Diffraction XCalibur 2'
_diffrn_measurement_method       'phi and omega'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0410
_diffrn_reflns_av_sigmaI/netI    0.0750
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       31
_diffrn_reflns_limit_l_min       -31
_diffrn_reflns_number            23272
_diffrn_reflns_theta_full        26.37
_diffrn_reflns_theta_max         26.37
_diffrn_reflns_theta_min         4.12
_exptl_absorpt_coefficient_mu    2.203
_exptl_absorpt_correction_T_max  0.8098
_exptl_absorpt_correction_T_min  0.5578
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlis RED, Oxford Diffraction Ltd.,
Version 1.171.32.4 (release 27-04-2006 CrysAlis171 .NET)
(compiled Apr 27 2007,17:53:11)
Empirical absorption correction using spherical harmonics,
implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            pink
_exptl_crystal_density_diffrn    1.884
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             2044
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.10
_refine_diff_density_max         1.159
_refine_diff_density_min         -0.653
_refine_diff_density_rms         0.137
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.983
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     463
_refine_ls_number_reflns         7456
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.983
_refine_ls_R_factor_all          0.0676
_refine_ls_R_factor_gt           0.0333
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0368P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0659
_refine_ls_wR_factor_ref         0.0775
_reflns_number_gt                4875
_reflns_number_total             7456
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c0dt00482k.txt
_cod_data_source_block           mono820
_cod_original_sg_symbol_H-M      P2(1)/n
_cod_database_code               7026512
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
P1 P 0.97966(10) 0.89436(10) 0.83021(5) 0.0168(3) Uani 1 1 d .
Sb1 Sb 1.03966(2) 0.89648(2) 1.092935(12) 0.01459(9) Uani 1 1 d .
Sb2 Sb 1.06572(2) 0.82479(2) 0.953354(12) 0.01463(9) Uani 1 1 d .
Co3 Co 0.81331(5) 0.88003(5) 0.90733(3) 0.01677(15) Uani 1 1 d .
P2 P 0.78357(10) 0.94375(10) 1.03356(5) 0.0155(3) Uani 1 1 d .
Cl2 Cl 1.04032(11) 0.40566(10) 1.21854(5) 0.0307(3) Uani 1 1 d .
Cl1 Cl 1.36828(11) 0.36658(10) 0.98148(6) 0.0344(3) Uani 1 1 d .
O4 O 1.0725(2) 0.8182(2) 1.03121(11) 0.0142(7) Uani 1 1 d .
O9 O 1.1952(2) 0.9441(2) 1.11752(12) 0.0169(7) Uani 1 1 d .
O10 O 1.0015(2) 0.9768(2) 1.16029(12) 0.0164(7) Uani 1 1 d .
O7 O 0.7501(2) 0.9019(2) 0.97618(12) 0.0173(7) Uani 1 1 d .
O2 O 1.0664(2) 0.8303(2) 0.87099(12) 0.0168(7) Uani 1 1 d .
O5 O 0.9228(2) 0.7434(2) 0.93420(12) 0.0170(7) Uani 1 1 d .
O3 O 1.1935(2) 0.9287(2) 0.96335(12) 0.0163(7) Uani 1 1 d .
O6 O 0.8796(2) 0.8775(2) 1.06656(12) 0.0159(7) Uani 1 1 d .
N1 N 0.6698(3) 0.7993(3) 0.87049(16) 0.0209(9) Uani 1 1 d .
C10 C 1.0449(4) 0.5377(4) 1.18828(19) 0.0227(11) Uani 1 1 d .
O8 O 0.8669(3) 0.8593(2) 0.83260(12) 0.0197(7) Uani 1 1 d .
C9 C 1.1122(4) 0.5544(4) 1.1523(2) 0.0269(12) Uani 1 1 d .
H8 H 1.1587 0.4958 1.1450 0.032 Uiso 1 1 calc R
C1 C 1.1652(4) 0.6816(4) 0.95834(18) 0.0154(10) Uani 1 1 d .
C7 C 1.0453(4) 0.7440(4) 1.13717(17) 0.0160(10) Uani 1 1 d .
C4 C 1.2913(4) 0.4898(4) 0.9722(2) 0.0202(11) Uani 1 1 d .
C14 C 0.7048(4) 0.9444(4) 1.1284(2) 0.0306(13) Uani 1 1 d .
H4 H 0.7780 0.9574 1.1452 0.037 Uiso 1 1 calc R
C2 C 1.2612(4) 0.6777(4) 0.9971(2) 0.0239(11) Uani 1 1 d .
H18 H 1.2830 0.7416 1.0194 0.029 Uiso 1 1 calc R
C6 C 1.1348(4) 0.5877(4) 0.92657(19) 0.0213(11) Uani 1 1 d .
H14 H 1.0706 0.5897 0.8994 0.026 Uiso 1 1 calc R
C13 C 0.6783(4) 0.9285(4) 1.0717(2) 0.0205(11) Uani 1 1 d .
C3 C 1.3255(4) 0.5817(4) 1.0037(2) 0.0259(12) Uani 1 1 d .
H17 H 1.3916 0.5800 1.0295 0.031 Uiso 1 1 calc R
C18 C 0.5719(4) 0.9084(4) 1.0484(2) 0.0257(12) Uani 1 1 d .
H2 H 0.5524 0.8966 1.0101 0.031 Uiso 1 1 calc R
C15 C 0.6263(5) 0.9414(5) 1.1602(2) 0.0431(16) Uani 1 1 d .
H5 H 0.6453 0.9531 1.1985 0.052 Uiso 1 1 calc R
C11 C 0.9758(4) 0.6214(4) 1.1995(2) 0.0280(12) Uani 1 1 d .
H12 H 0.9288 0.6083 1.2245 0.034 Uiso 1 1 calc R
C5 C 1.1969(4) 0.4902(4) 0.9338(2) 0.0244(12) Uani 1 1 d .
H15 H 1.1745 0.4251 0.9126 0.029 Uiso 1 1 calc R
C17 C 0.4924(4) 0.9052(4) 1.0805(3) 0.0369(14) Uani 1 1 d .
H3 H 0.4190 0.8919 1.0640 0.044 Uiso 1 1 calc R
O11 O 1.0337(2) 1.0450(2) 1.05783(12) 0.0147(7) Uani 1 1 d .
C28 C 0.5700(4) 0.6812(4) 0.8017(2) 0.0293(13) Uani 1 1 d .
H27 H 0.5700 0.6344 0.7709 0.035 Uiso 1 1 calc R
C19 C 1.0086(4) 0.8713(4) 0.76339(19) 0.0188(11) Uani 1 1 d .
C27 C 0.4737(4) 0.6989(4) 0.8208(2) 0.0295(13) Uani 1 1 d .
C29 C 0.6645(4) 0.7312(4) 0.8274(2) 0.0241(12) Uani 1 1 d .
H26 H 0.7289 0.7168 0.8139 0.029 Uiso 1 1 calc R
C32 C 1.2514(4) 0.9146(4) 1.1705(2) 0.0263(12) Uani 1 1 d .
H25A H 1.1991 0.8998 1.1942 0.040 Uiso 1 1 calc R
H25B H 1.2990 0.9767 1.1857 0.040 Uiso 1 1 calc R
H25C H 1.2949 0.8471 1.1682 0.040 Uiso 1 1 calc R
C25 C 0.5780(4) 0.8138(5) 0.8895(2) 0.0349(13) Uani 1 1 d .
H30 H 0.5804 0.8594 0.9210 0.042 Uiso 1 1 calc R
C20 C 0.9231(4) 0.8759(4) 0.7184(2) 0.0297(13) Uani 1 1 d .
H22 H 0.8507 0.8848 0.7238 0.036 Uiso 1 1 calc R
C24 C 1.1125(4) 0.8551(4) 0.7551(2) 0.0308(13) Uani 1 1 d .
H20 H 1.1707 0.8514 0.7855 0.037 Uiso 1 1 calc R
C26 C 0.4806(5) 0.7664(5) 0.8660(2) 0.0434(16) Uani 1 1 d .
H29 H 0.4179 0.7803 0.8811 0.052 Uiso 1 1 calc R
C16 C 0.5203(5) 0.9214(5) 1.1360(3) 0.0457(16) Uani 1 1 d .
H31 H 0.4660 0.9188 1.1578 0.055 Uiso 1 1 calc R
C12 C 0.9763(4) 0.7243(4) 1.1738(2) 0.0243(12) Uani 1 1 d .
H23 H 0.9292 0.7822 1.1812 0.029 Uiso 1 1 calc R
C8 C 1.1126(4) 0.6569(4) 1.1264(2) 0.0253(12) Uani 1 1 d .
H24 H 1.1591 0.6682 1.1010 0.030 Uiso 1 1 calc R
C23 C 1.1328(5) 0.8443(5) 0.7025(2) 0.0417(15) Uani 1 1 d .
H36 H 1.2045 0.8321 0.6968 0.050 Uiso 1 1 calc R
C21 C 0.9442(5) 0.8674(5) 0.6666(2) 0.0392(15) Uani 1 1 d .
H37 H 0.8864 0.8726 0.6360 0.047 Uiso 1 1 calc R
C22 C 1.0483(5) 0.8513(5) 0.6585(2) 0.0408(16) Uani 1 1 d .
H38 H 1.0619 0.8451 0.6224 0.049 Uiso 1 1 calc R
C35 C 0.8949(4) 0.6598(4) 0.97077(19) 0.0202(11) Uani 1 1 d .
H35A H 0.9529 0.6037 0.9784 0.030 Uiso 1 1 calc R
H35B H 0.8271 0.6230 0.9538 0.030 Uiso 1 1 calc R
H35C H 0.8858 0.6957 1.0050 0.030 Uiso 1 1 calc R
C50 C 0.3671(4) 0.6507(5) 0.7909(2) 0.0362(14) Uani 1 1 d .
H50A H 0.3326 0.7060 0.7633 0.043 Uiso 1 1 calc R
H50B H 0.3822 0.5821 0.7712 0.043 Uiso 1 1 calc R
C51 C 0.2879(5) 0.6214(5) 0.8274(3) 0.0507(17) Uani 1 1 d .
H51A H 0.3237 0.5734 0.8574 0.076 Uiso 1 1 calc R
H51B H 0.2259 0.5813 0.8061 0.076 Uiso 1 1 calc R
H51C H 0.2627 0.6905 0.8423 0.076 Uiso 1 1 calc R
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Co Co 0.3494 0.9721 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Sb Sb -0.5866 1.5461 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
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_3
O8 P1 O2 113.25(17) . .
O8 P1 O10 112.76(17) . 3_777
O2 P1 O10 108.45(17) . 3_777
O8 P1 C19 110.9(2) . .
O2 P1 C19 107.1(2) . .
O10 P1 C19 103.86(18) 3_777 .
O4 Sb1 O11 94.35(12) . .
O4 Sb1 O6 92.19(12) . .
O11 Sb1 O6 90.24(12) . .
O4 Sb1 O9 92.06(12) . .
O11 Sb1 O9 80.55(12) . .
O6 Sb1 O9 170.12(11) . .
O4 Sb1 O10 178.18(12) . .
O11 Sb1 O10 87.18(11) . .
O6 Sb1 O10 86.83(11) . .
O9 Sb1 O10 89.14(12) . .
O4 Sb1 C7 90.59(14) . .
O11 Sb1 C7 174.99(14) . .
O6 Sb1 C7 90.38(15) . .
O9 Sb1 C7 98.49(15) . .
O10 Sb1 C7 87.89(14) . .
O4 Sb2 O11 94.58(11) . 3_777
O4 Sb2 O3 91.08(12) . .
O11 Sb2 O3 90.28(12) 3_777 .
O4 Sb2 O5 94.92(12) . .
O11 Sb2 O5 80.29(12) 3_777 .
O3 Sb2 O5 169.18(12) . .
O4 Sb2 O2 177.21(12) . .
O11 Sb2 O2 87.51(11) 3_777 .
O3 Sb2 O2 87.07(12) . .
O5 Sb2 O2 87.23(12) . .
O4 Sb2 C1 89.73(14) . .
O11 Sb2 C1 174.98(15) 3_777 .
O3 Sb2 C1 92.21(14) . .
O5 Sb2 C1 96.80(15) . .
O2 Sb2 C1 88.26(14) . .
O7 Co3 N1 89.21(13) . .
O7 Co3 O8 175.66(12) . .
N1 Co3 O8 87.26(13) . .
O7 Co3 O11 93.97(11) . 3_777
N1 Co3 O11 176.08(13) . 3_777
O8 Co3 O11 89.65(11) . 3_777
O7 Co3 O5 99.39(11) . .
N1 Co3 O5 103.68(13) . .
O8 Co3 O5 83.92(11) . .
O11 Co3 O5 73.57(11) 3_777 .
O7 Co3 O9 96.33(11) . 3_777
N1 Co3 O9 108.90(13) . 3_777
O8 Co3 O9 82.43(11) . 3_777
O11 Co3 O9 73.04(11) 3_777 3_777
O5 Co3 O9 143.85(11) . 3_777
O7 P2 O6 112.93(17) . .
O7 P2 O3 112.96(17) . 3_777
O6 P2 O3 110.84(17) . 3_777
O7 P2 C13 111.9(2) . .
O6 P2 C13 104.4(2) . .
O3 P2 C13 102.98(18) 3_777 .
Sb1 O4 Sb2 144.68(16) . .
C32 O9 Sb1 119.8(3) . .
C32 O9 Co3 119.4(3) . 3_777
Sb1 O9 Co3 100.99(12) . 3_777
P1 O10 Sb1 121.65(16) 3_777 .
P2 O7 Co3 139.62(18) . .
P1 O2 Sb2 122.46(17) . .
C35 O5 Sb2 119.7(3) . .
C35 O5 Co3 120.1(2) . .
Sb2 O5 Co3 101.51(12) . .
P2 O3 Sb2 138.60(18) 3_777 .
P2 O6 Sb1 138.75(17) . .
C29 N1 C25 116.6(4) . .
C29 N1 Co3 122.5(3) . .
C25 N1 Co3 120.9(3) . .
C9 C10 C11 121.4(4) . .
C9 C10 Cl2 119.5(4) . .
C11 C10 Cl2 119.0(4) . .
P1 O8 Co3 117.89(18) . .
C10 C9 C8 119.7(5) . .
C10 C9 H8 120.1 . .
C8 C9 H8 120.1 . .
C6 C1 C2 118.6(4) . .
C6 C1 Sb2 121.7(3) . .
C2 C1 Sb2 119.6(3) . .
C12 C7 C8 118.5(4) . .
C12 C7 Sb1 121.5(3) . .
C8 C7 Sb1 119.9(3) . .
C3 C4 C5 122.2(4) . .
C3 C4 Cl1 119.2(4) . .
C5 C4 Cl1 118.6(4) . .
C15 C14 C13 121.1(5) . .
C15 C14 H4 119.4 . .
C13 C14 H4 119.5 . .
C3 C2 C1 121.0(5) . .
C3 C2 H18 119.5 . .
C1 C2 H18 119.5 . .
C1 C6 C5 120.9(5) . .
C1 C6 H14 119.5 . .
C5 C6 H14 119.5 . .
C18 C13 C14 118.4(4) . .
C18 C13 P2 123.7(4) . .
C14 C13 P2 117.8(4) . .
C4 C3 C2 118.5(5) . .
C4 C3 H17 120.8 . .
C2 C3 H17 120.8 . .
C13 C18 C17 120.6(5) . .
C13 C18 H2 119.7 . .
C17 C18 H2 119.7 . .
C16 C15 C14 119.6(5) . .
C16 C15 H5 120.2 . .
C14 C15 H5 120.2 . .
C12 C11 C10 119.0(4) . .
C12 C11 H12 120.5 . .
C10 C11 H12 120.5 . .
C4 C5 C6 118.8(4) . .
C4 C5 H15 120.6 . .
C6 C5 H15 120.6 . .
C16 C17 C18 120.0(5) . .
C16 C17 H3 120.0 . .
C18 C17 H3 120.0 . .
Sb1 O11 Sb2 137.42(15) . 3_777
Sb1 O11 Co3 103.74(13) . 3_777
Sb2 O11 Co3 103.05(12) 3_777 3_777
C29 C28 C27 120.4(5) . .
C29 C28 H27 119.8 . .
C27 C28 H27 119.8 . .
C24 C19 C20 119.5(5) . .
C24 C19 P1 121.8(4) . .
C20 C19 P1 118.5(4) . .
C26 C27 C28 116.3(5) . .
C26 C27 C50 122.3(5) . .
C28 C27 C50 121.3(5) . .
N1 C29 C28 122.9(4) . .
N1 C29 H26 118.5 . .
C28 C29 H26 118.5 . .
O9 C32 H25A 109.5 . .
O9 C32 H25B 109.5 . .
H25A C32 H25B 109.5 . .
O9 C32 H25C 109.5 . .
H25A C32 H25C 109.5 . .
H25B C32 H25C 109.5 . .
N1 C25 C26 123.6(5) . .
N1 C25 H30 118.2 . .
C26 C25 H30 118.2 . .
C21 C20 C19 119.7(5) . .
C21 C20 H22 120.2 . .
C19 C20 H22 120.2 . .
C19 C24 C23 120.4(5) . .
C19 C24 H20 119.8 . .
C23 C24 H20 119.8 . .
C27 C26 C25 120.1(5) . .
C27 C26 H29 120.0 . .
C25 C26 H29 120.0 . .
C17 C16 C15 120.3(5) . .
C17 C16 H31 119.8 . .
C15 C16 H31 119.8 . .
C11 C12 C7 120.7(4) . .
C11 C12 H23 119.6 . .
C7 C12 H23 119.6 . .
C9 C8 C7 120.7(4) . .
C9 C8 H24 119.7 . .
C7 C8 H24 119.7 . .
C22 C23 C24 119.5(5) . .
C22 C23 H36 120.2 . .
C24 C23 H36 120.2 . .
C20 C21 C22 120.6(5) . .
C20 C21 H37 119.7 . .
C22 C21 H37 119.7 . .
C21 C22 C23 120.3(5) . .
C21 C22 H38 119.9 . .
C23 C22 H38 119.9 . .
O5 C35 H35A 109.5 . .
O5 C35 H35B 109.5 . .
H35A C35 H35B 109.5 . .
O5 C35 H35C 109.5 . .
H35A C35 H35C 109.5 . .
H35B C35 H35C 109.5 . .
C51 C50 C27 114.5(5) . .
C51 C50 H50A 108.6 . .
C27 C50 H50A 108.6 . .
C51 C50 H50B 108.6 . .
C27 C50 H50B 108.6 . .
H50A C50 H50B 107.6 . .
C50 C51 H51A 109.5 . .
C50 C51 H51B 109.5 . .
H51A C51 H51B 109.5 . .
C50 C51 H51C 109.5 . .
H51A C51 H51C 109.5 . .
H51B C51 H51C 109.5 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
P1 O8 1.491(3) .
P1 O2 1.544(3) .
P1 O10 1.563(3) 3_777
P1 C19 1.792(4) .
Sb1 O4 1.910(3) .
Sb1 O11 1.967(3) .
Sb1 O6 2.008(3) .
Sb1 O9 2.017(3) .
Sb1 O10 2.066(3) .
Sb1 C7 2.117(4) .
Sb2 O4 1.928(3) .
Sb2 O11 1.977(3) 3_777
Sb2 O3 2.005(3) .
Sb2 O5 2.018(3) .
Sb2 O2 2.056(3) .
Sb2 C1 2.103(4) .
Co3 O7 2.041(3) .
Co3 N1 2.096(4) .
Co3 O8 2.112(3) .
Co3 O11 2.149(3) 3_777
Co3 O5 2.153(3) .
Co3 O9 2.180(3) 3_777
P2 O7 1.497(3) .
P2 O6 1.542(3) .
P2 O3 1.544(3) 3_777
P2 C13 1.780(5) .
Cl2 C10 1.748(5) .
Cl1 C4 1.748(4) .
O9 C32 1.418(5) .
O9 Co3 2.180(3) 3_777
O10 P1 1.563(3) 3_777
O5 C35 1.437(5) .
O3 P2 1.544(3) 3_777
N1 C29 1.337(6) .
N1 C25 1.340(6) .
C10 C9 1.359(6) .
C10 C11 1.386(6) .
C9 C8 1.381(6) .
C9 H8 0.9500 .
C1 C6 1.381(6) .
C1 C2 1.397(6) .
C7 C12 1.394(6) .
C7 C8 1.396(6) .
C4 C3 1.367(6) .
C4 C5 1.376(7) .
C14 C15 1.377(7) .
C14 C13 1.402(7) .
C14 H4 0.9500 .
C2 C3 1.391(6) .
C2 H18 0.9500 .
C6 C5 1.391(6) .
C6 H14 0.9500 .
C13 C18 1.375(7) .
C3 H17 0.9500 .
C18 C17 1.395(7) .
C18 H2 0.9500 .
C15 C16 1.376(8) .
C15 H5 0.9500 .
C11 C12 1.382(6) .
C11 H12 0.9500 .
C5 H15 0.9500 .
C17 C16 1.374(8) .
C17 H3 0.9500 .
O11 Sb2 1.977(3) 3_777
O11 Co3 2.149(3) 3_777
C28 C29 1.373(7) .
C28 C27 1.397(6) .
C28 H27 0.9500 .
C19 C24 1.374(7) .
C19 C20 1.400(7) .
C27 C26 1.375(7) .
C27 C50 1.517(7) .
C29 H26 0.9500 .
C32 H25A 0.9800 .
C32 H25B 0.9800 .
C32 H25C 0.9800 .
C25 C26 1.375(7) .
C25 H30 0.9500 .
C20 C21 1.370(7) .
C20 H22 0.9500 .
C24 C23 1.390(7) .
C24 H20 0.9500 .
C26 H29 0.9500 .
C16 H31 0.9500 .
C12 H23 0.9500 .
C8 H24 0.9500 .
C23 C22 1.377(8) .
C23 H36 0.9500 .
C21 C22 1.376(8) .
C21 H37 0.9500 .
C22 H38 0.9500 .
C35 H35A 0.9800 .
C35 H35B 0.9800 .
C35 H35C 0.9800 .
C50 C51 1.511(7) .
C50 H50A 0.9900 .
C50 H50B 0.9900 .
C51 H51A 0.9800 .
C51 H51B 0.9800 .
C51 H51C 0.9800 .
loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_4
O11 Sb1 O4 Sb2 -21.3(3) . .
O6 Sb1 O4 Sb2 69.1(3) . .
O9 Sb1 O4 Sb2 -102.0(3) . .
O10 Sb1 O4 Sb2 126(4) . .
C7 Sb1 O4 Sb2 159.5(3) . .
O11 Sb2 O4 Sb1 -12.9(3) 3_777 .
O3 Sb2 O4 Sb1 77.5(3) . .
O5 Sb2 O4 Sb1 -93.5(3) . .
O2 Sb2 O4 Sb1 126(2) . .
C1 Sb2 O4 Sb1 169.7(3) . .
O4 Sb1 O9 C32 -122.5(3) . .
O11 Sb1 O9 C32 143.4(3) . .
O6 Sb1 O9 C32 122.1(7) . .
O10 Sb1 O9 C32 56.2(3) . .
C7 Sb1 O9 C32 -31.6(3) . .
O4 Sb1 O9 Co3 104.12(12) . 3_777
O11 Sb1 O9 Co3 10.05(12) . 3_777
O6 Sb1 O9 Co3 -11.3(7) . 3_777
O10 Sb1 O9 Co3 -77.24(12) . 3_777
C7 Sb1 O9 Co3 -164.98(14) . 3_777
O4 Sb1 O10 P1 -168(4) . 3_777
O11 Sb1 O10 P1 -20.5(2) . 3_777
O6 Sb1 O10 P1 -110.9(2) . 3_777
O9 Sb1 O10 P1 60.1(2) . 3_777
C7 Sb1 O10 P1 158.6(2) . 3_777
O6 P2 O7 Co3 -59.3(3) . .
O3 P2 O7 Co3 67.5(3) 3_777 .
C13 P2 O7 Co3 -176.9(3) . .
N1 Co3 O7 P2 173.8(3) . .
O8 Co3 O7 P2 -150.5(14) . .
O11 Co3 O7 P2 -3.9(3) 3_777 .
O5 Co3 O7 P2 70.1(3) . .
O9 Co3 O7 P2 -77.3(3) 3_777 .
O8 P1 O2 Sb2 -54.9(2) . .
O10 P1 O2 Sb2 71.0(2) 3_777 .
C19 P1 O2 Sb2 -177.5(2) . .
O4 Sb2 O2 P1 -156(2) . .
O11 Sb2 O2 P1 -17.2(2) 3_777 .
O3 Sb2 O2 P1 -107.6(2) . .
O5 Sb2 O2 P1 63.2(2) . .
C1 Sb2 O2 P1 160.1(2) . .
O4 Sb2 O5 C35 -31.2(3) . .
O11 Sb2 O5 C35 -125.1(3) 3_777 .
O3 Sb2 O5 C35 -154.7(5) . .
O2 Sb2 O5 C35 147.0(3) . .
C1 Sb2 O5 C35 59.1(3) . .
O4 Sb2 O5 Co3 103.64(12) . .
O11 Sb2 O5 Co3 9.82(11) 3_777 .
O3 Sb2 O5 Co3 -19.8(7) . .
O2 Sb2 O5 Co3 -78.12(12) . .
C1 Sb2 O5 Co3 -166.04(14) . .
O7 Co3 O5 C35 34.0(3) . .
N1 Co3 O5 C35 -57.5(3) . .
O8 Co3 O5 C35 -143.2(3) . .
O11 Co3 O5 C35 125.4(3) 3_777 .
O9 Co3 O5 C35 148.5(3) 3_777 .
O7 Co3 O5 Sb2 -100.68(12) . .
N1 Co3 O5 Sb2 167.83(13) . .
O8 Co3 O5 Sb2 82.15(13) . .
O11 Co3 O5 Sb2 -9.29(11) 3_777 .
O9 Co3 O5 Sb2 13.9(2) 3_777 .
O4 Sb2 O3 P2 -90.3(3) . 3_777
O11 Sb2 O3 P2 4.3(3) 3_777 3_777
O5 Sb2 O3 P2 33.4(8) . 3_777
O2 Sb2 O3 P2 91.8(3) . 3_777
C1 Sb2 O3 P2 179.9(3) . 3_777
O7 P2 O6 Sb1 103.3(3) . .
O3 P2 O6 Sb1 -24.6(3) 3_777 .
C13 P2 O6 Sb1 -134.8(3) . .
O4 Sb1 O6 P2 -95.1(3) . .
O11 Sb1 O6 P2 -0.7(3) . .
O9 Sb1 O6 P2 20.4(9) . .
O10 Sb1 O6 P2 86.5(3) . .
C7 Sb1 O6 P2 174.3(3) . .
O7 Co3 N1 C29 -160.0(4) . .
O8 Co3 N1 C29 22.5(4) . .
O11 Co3 N1 C29 -16(2) 3_777 .
O5 Co3 N1 C29 -60.6(4) . .
O9 Co3 N1 C29 103.5(4) 3_777 .
O7 Co3 N1 C25 19.9(4) . .
O8 Co3 N1 C25 -157.6(4) . .
O11 Co3 N1 C25 164.3(17) 3_777 .
O5 Co3 N1 C25 119.3(4) . .
O9 Co3 N1 C25 -76.6(4) 3_777 .
O2 P1 O8 Co3 60.2(2) . .
O10 P1 O8 Co3 -63.4(2) 3_777 .
C19 P1 O8 Co3 -179.43(19) . .
O7 Co3 O8 P1 149.0(14) . .
N1 Co3 O8 P1 -175.2(2) . .
O11 Co3 O8 P1 2.34(19) 3_777 .
O5 Co3 O8 P1 -71.17(19) . .
O9 Co3 O8 P1 75.27(19) 3_777 .
C11 C10 C9 C8 0.3(8) . .
Cl2 C10 C9 C8 177.1(4) . .
O4 Sb2 C1 C6 126.1(3) . .
O11 Sb2 C1 C6 -23.1(18) 3_777 .
O3 Sb2 C1 C6 -142.8(3) . .
O5 Sb2 C1 C6 31.2(4) . .
O2 Sb2 C1 C6 -55.8(3) . .
O4 Sb2 C1 C2 -49.7(3) . .
O11 Sb2 C1 C2 161.1(14) 3_777 .
O3 Sb2 C1 C2 41.4(3) . .
O5 Sb2 C1 C2 -144.6(3) . .
O2 Sb2 C1 C2 128.4(3) . .
O4 Sb1 C7 C12 -144.8(4) . .
O11 Sb1 C7 C12 44.5(19) . .
O6 Sb1 C7 C12 -52.6(4) . .
O9 Sb1 C7 C12 123.0(4) . .
O10 Sb1 C7 C12 34.2(4) . .
O4 Sb1 C7 C8 29.6(4) . .
O11 Sb1 C7 C8 -141.1(15) . .
O6 Sb1 C7 C8 121.8(4) . .
O9 Sb1 C7 C8 -62.6(4) . .
O10 Sb1 C7 C8 -151.4(4) . .
C6 C1 C2 C3 0.2(7) . .
Sb2 C1 C2 C3 176.1(3) . .
C2 C1 C6 C5 1.5(6) . .
Sb2 C1 C6 C5 -174.3(3) . .
C15 C14 C13 C18 -0.7(7) . .
C15 C14 C13 P2 175.6(4) . .
O7 P2 C13 C18 -15.5(4) . .
O6 P2 C13 C18 -138.0(4) . .
O3 P2 C13 C18 106.1(4) 3_777 .
O7 P2 C13 C14 168.3(4) . .
O6 P2 C13 C14 45.8(4) . .
O3 P2 C13 C14 -70.1(4) 3_777 .
C5 C4 C3 C2 1.2(7) . .
Cl1 C4 C3 C2 -177.7(3) . .
C1 C2 C3 C4 -1.6(7) . .
C14 C13 C18 C17 0.7(7) . .
P2 C13 C18 C17 -175.5(4) . .
C13 C14 C15 C16 0.6(8) . .
C9 C10 C11 C12 -0.6(8) . .
Cl2 C10 C11 C12 -177.3(4) . .
C3 C4 C5 C6 0.5(7) . .
Cl1 C4 C5 C6 179.4(3) . .
C1 C6 C5 C4 -1.9(7) . .
C13 C18 C17 C16 -0.5(8) . .
O4 Sb1 O11 Sb2 130.8(2) . 3_777
O6 Sb1 O11 Sb2 38.6(2) . 3_777
O9 Sb1 O11 Sb2 -137.9(2) . 3_777
O10 Sb1 O11 Sb2 -48.3(2) . 3_777
C7 Sb1 O11 Sb2 -58.6(18) . 3_777
O4 Sb1 O11 Co3 -101.68(13) . 3_777
O6 Sb1 O11 Co3 166.11(13) . 3_777
O9 Sb1 O11 Co3 -10.30(12) . 3_777
O10 Sb1 O11 Co3 79.30(13) . 3_777
C7 Sb1 O11 Co3 69.0(17) . 3_777
O8 P1 C19 C24 -154.7(4) . .
O2 P1 C19 C24 -30.7(4) . .
O10 P1 C19 C24 83.9(4) 3_777 .
O8 P1 C19 C20 28.7(4) . .
O2 P1 C19 C20 152.7(4) . .
O10 P1 C19 C20 -92.7(4) 3_777 .
C29 C28 C27 C26 -0.9(8) . .
C29 C28 C27 C50 176.0(5) . .
C25 N1 C29 C28 2.6(7) . .
Co3 N1 C29 C28 -177.5(4) . .
C27 C28 C29 N1 -0.9(8) . .
C29 N1 C25 C26 -2.4(8) . .
Co3 N1 C25 C26 177.7(4) . .
C24 C19 C20 C21 -1.8(7) . .
P1 C19 C20 C21 174.9(4) . .
C20 C19 C24 C23 0.5(7) . .
P1 C19 C24 C23 -176.0(4) . .
C28 C27 C26 C25 1.0(8) . .
C50 C27 C26 C25 -175.8(5) . .
N1 C25 C26 C27 0.7(9) . .
C18 C17 C16 C15 0.4(9) . .
C14 C15 C16 C17 -0.4(9) . .
C10 C11 C12 C7 -0.1(7) . .
C8 C7 C12 C11 1.0(7) . .
Sb1 C7 C12 C11 175.5(4) . .
C10 C9 C8 C7 0.6(8) . .
C12 C7 C8 C9 -1.2(7) . .
Sb1 C7 C8 C9 -175.8(4) . .
C19 C24 C23 C22 0.9(8) . .
C19 C20 C21 C22 1.8(8) . .
C20 C21 C22 C23 -0.4(9) . .
C24 C23 C22 C21 -0.9(8) . .
C26 C27 C50 C51 -34.3(8) . .
C28 C27 C50 C51 149.0(5) . .
