# Electronic Supplementary Material (ESI) for RSC Advances.
# This journal is © The Royal Society of Chemistry 2023

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_fi_1d_a
_database_code_depnum_ccdc_archive 'CCDC 2152363'
loop_
_audit_author_name
_audit_author_address
'Shishir Ghosh'
;Jahangirnagar University
Bangladesh
;
_audit_update_record             
;
2022-02-16 deposited with the CCDC.	2022-12-19 downloaded from the CCDC.
;
_audit_creation_date             2021-09-26
_audit_creation_method           
;
Olex2 1.3
(compiled 2020.11.12 svn.r5f609507 for OlexSys, GUI svn.r6272)
;
_shelx_SHELXL_version_number     2014/7
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C52 H37 O9 Os3 P2 Sb'
_chemical_formula_sum            'C52 H37 O9 Os3 P2 Sb'
_chemical_formula_weight         1560.10
_chemical_melting_point          ?
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'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Os Os -1.2165 7.6030 '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'
Sb Sb -0.5866 1.5461 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_H-M_alt        'C 1 2/c 1'
_space_group_name_Hall           '-C 2yc'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -y+1/2, z-1/2'

_cell_length_a                   42.6814(13)
_cell_length_b                   11.4302(3)
_cell_length_c                   19.9930(6)
_cell_angle_alpha                90
_cell_angle_beta                 90.434(2)
_cell_angle_gamma                90
_cell_volume                     9753.4(5)
_cell_formula_units_Z            8
_cell_measurement_reflns_used    9262
_cell_measurement_temperature    210(1)
_cell_measurement_theta_max      27.18
_cell_measurement_theta_min      2.75
_shelx_estimated_absorpt_T_max   0.804
_shelx_estimated_absorpt_T_min   0.172
_exptl_absorpt_coefficient_mu    8.461
_exptl_absorpt_correction_T_max  0.7455
_exptl_absorpt_correction_T_min  0.4270
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
SADABS-2014/5 (Bruker,2014/5) was used for absorption correction.
wR2(int) was 0.1295 before and 0.0686 after correction.
The Ratio of minimum to maximum transmission is 0.5728.
The λ/2 correction factor is Not present.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            orange
_exptl_crystal_colour_primary    orange
_exptl_crystal_density_diffrn    2.125
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       block
_exptl_crystal_F_000             5840
_exptl_crystal_size_max          0.321
_exptl_crystal_size_mid          0.188
_exptl_crystal_size_min          0.127
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0548
_diffrn_reflns_av_unetI/netI     0.0234
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.992
_diffrn_reflns_limit_h_max       54
_diffrn_reflns_limit_h_min       -54
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_limit_l_min       -25
_diffrn_reflns_number            144691
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.992
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         27.240
_diffrn_reflns_theta_min         2.243
_diffrn_ambient_temperature      210(1)
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.992
_diffrn_measurement_device_type  'Bruker D8 Venture'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   ?
_diffrn_source_current           1.0
_diffrn_source_power             0.05
_diffrn_source_voltage           50.0
_diffrn_standards_number         0
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                9430
_reflns_number_total             10838
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       ?
_computing_data_collection       ?
_computing_data_reduction        ?
_computing_molecular_graphics    'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_structure_refinement  'XL  (Sheldrick, 2008)'
_computing_structure_solution    'SHELXT 2014/5 (Sheldrick, 2014)'
_refine_diff_density_max         0.786
_refine_diff_density_min         -0.928
_refine_diff_density_rms         0.118
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.029
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     604
_refine_ls_number_reflns         10838
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0296
_refine_ls_R_factor_gt           0.0215
_refine_ls_restrained_S_all      1.029
_refine_ls_shift/su_max          0.004
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0151P)²+49.9076P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0448
_refine_ls_wR_factor_ref         0.0479
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
2.a Secondary CH2 refined with riding coordinates:
 C10(H10A,H10B)
2.b Aromatic/amide H refined with riding coordinates:
 C12(H12), C13(H13), C14(H14), C15(H15), C16(H16), C18(H18), C19(H19),
 C20(H20), C21(H21), C22(H22), C24(H24), C25(H25), C26(H26), C27(H27), C28(H28),
  C30(H30), C31(H31), C32(H32), C33(H33), C34(H34), C36(H36), C37(H37),
 C38(H38), C39(H39), C40(H40), C42(H42), C43(H43), C44(H44), C45(H45), C46(H46),
  C48(H48), C49(H49), C50(H50), C51(H51), C52(H52)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     dual
_atom_sites_solution_secondary   ?
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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Os1 Os 0.61289(2) 0.70340(2) 0.44963(2) 0.02242(4) Uani 1 1 d . . . . .
Os2 Os 0.67422(2) 0.62473(2) 0.49051(2) 0.02362(4) Uani 1 1 d . . . . .
Os3 Os 0.63283(2) 0.71830(2) 0.58915(2) 0.02374(4) Uani 1 1 d . . . . .
Sb1 Sb 0.58267(2) 0.82738(2) 0.62645(2) 0.02582(6) Uani 1 1 d . . . . .
P1 P 0.62657(2) 0.66348(8) 0.33903(5) 0.02430(19) Uani 1 1 d . . . . .
P2 P 0.68476(2) 0.53466(8) 0.38896(5) 0.02381(19) Uani 1 1 d . . . . .
C1 C 0.62245(9) 0.8688(3) 0.45518(18) 0.0277(8) Uani 1 1 d . . . . .
C2 C 0.57042(10) 0.7411(4) 0.4349(2) 0.0362(9) Uani 1 1 d . . . . .
C3 C 0.60316(9) 0.5406(4) 0.46102(19) 0.0313(8) Uani 1 1 d . . . . .
C4 C 0.68466(10) 0.7813(4) 0.4604(2) 0.0369(10) Uani 1 1 d . . . . .
C5 C 0.71352(11) 0.6047(4) 0.5319(2) 0.0430(11) Uani 1 1 d . . . . .
C6 C 0.66171(10) 0.4752(4) 0.5272(2) 0.0340(9) Uani 1 1 d . . . . .
C7 C 0.65612(9) 0.8616(4) 0.57697(19) 0.0315(9) Uani 1 1 d . . . . .
C8 C 0.65475(9) 0.6974(4) 0.6700(2) 0.0333(9) Uani 1 1 d . . . . .
C9 C 0.61287(10) 0.5680(4) 0.6027(2) 0.0358(9) Uani 1 1 d . . . . .
O1 O 0.62635(7) 0.9673(2) 0.45814(14) 0.0368(7) Uani 1 1 d . . . . .
O2 O 0.54455(7) 0.7604(4) 0.42356(18) 0.0598(10) Uani 1 1 d . . . . .
O3 O 0.59590(8) 0.4442(3) 0.46437(16) 0.0484(8) Uani 1 1 d . . . . .
O4 O 0.69247(8) 0.8713(3) 0.44299(19) 0.0549(9) Uani 1 1 d . . . . .
O5 O 0.73766(8) 0.5920(4) 0.5564(2) 0.0728(12) Uani 1 1 d . . . . .
O6 O 0.65680(9) 0.3857(3) 0.54935(18) 0.0554(9) Uani 1 1 d . . . . .
O7 O 0.67044(8) 0.9463(3) 0.57424(16) 0.0482(8) Uani 1 1 d . . . . .
O8 O 0.66749(8) 0.6820(3) 0.71951(16) 0.0503(8) Uani 1 1 d . . . . .
O9 O 0.60155(9) 0.4809(3) 0.61535(17) 0.0548(9) Uani 1 1 d . . . . .
C10 C 0.64985(9) 0.5286(3) 0.33447(18) 0.0268(8) Uani 1 1 d . . . . .
H10A H 0.6564 0.5160 0.2882 0.032 Uiso 1 1 calc R U . . .
H10B H 0.6368 0.4621 0.3477 0.032 Uiso 1 1 calc R U . . .
C11 C 0.64876(9) 0.7656(3) 0.28748(18) 0.0286(8) Uani 1 1 d . . . . .
C12 C 0.65407(16) 0.8780(5) 0.3062(2) 0.0690(18) Uani 1 1 d . . . . .
H12 H 0.6458 0.9057 0.3467 0.083 Uiso 1 1 calc R U . . .
C13 C 0.67152(18) 0.9527(6) 0.2664(3) 0.089(3) Uani 1 1 d . . . . .
H13 H 0.6747 1.0307 0.2797 0.107 Uiso 1 1 calc R U . . .
C14 C 0.68399(12) 0.9135(5) 0.2084(2) 0.0582(15) Uani 1 1 d . . . . .
H14 H 0.6971 0.9624 0.1831 0.070 Uiso 1 1 calc R U . . .
C15 C 0.67754(14) 0.8045(5) 0.1871(3) 0.0616(15) Uani 1 1 d . . . . .
H15 H 0.6851 0.7788 0.1456 0.074 Uiso 1 1 calc R U . . .
C16 C 0.65981(13) 0.7296(4) 0.2261(2) 0.0526(13) Uani 1 1 d . . . . .
H16 H 0.6553 0.6537 0.2107 0.063 Uiso 1 1 calc R U . . .
C17 C 0.59281(9) 0.6313(4) 0.28532(18) 0.0310(9) Uani 1 1 d . . . . .
C18 C 0.57918(11) 0.7221(4) 0.2499(3) 0.0502(12) Uani 1 1 d . . . . .
H18 H 0.5887 0.7964 0.2506 0.060 Uiso 1 1 calc R U . . .
C19 C 0.55181(12) 0.7055(5) 0.2136(3) 0.0577(14) Uani 1 1 d . . . . .
H19 H 0.5427 0.7684 0.1902 0.069 Uiso 1 1 calc R U . . .
C20 C 0.53816(11) 0.5983(5) 0.2117(2) 0.0523(13) Uani 1 1 d . . . . .
H20 H 0.5195 0.5870 0.1873 0.063 Uiso 1 1 calc R U . . .
C21 C 0.55154(12) 0.5073(5) 0.2451(2) 0.0535(13) Uani 1 1 d . . . . .
H21 H 0.5422 0.4329 0.2428 0.064 Uiso 1 1 calc R U . . .
C22 C 0.57884(11) 0.5224(4) 0.2826(2) 0.0452(11) Uani 1 1 d . . . . .
H22 H 0.5877 0.4590 0.3060 0.054 Uiso 1 1 calc R U . . .
C23 C 0.71566(8) 0.5897(3) 0.33524(19) 0.0268(8) Uani 1 1 d . . . . .
C24 C 0.73565(10) 0.6776(4) 0.3555(2) 0.0394(10) Uani 1 1 d . . . . .
H24 H 0.7333 0.7112 0.3981 0.047 Uiso 1 1 calc R U . . .
C25 C 0.75923(11) 0.7173(4) 0.3137(3) 0.0467(12) Uani 1 1 d . . . . .
H25 H 0.7726 0.7780 0.3279 0.056 Uiso 1 1 calc R U . . .
C26 C 0.76308(10) 0.6685(4) 0.2522(2) 0.0426(11) Uani 1 1 d . . . . .
H26 H 0.7788 0.6967 0.2236 0.051 Uiso 1 1 calc R U . . .
C27 C 0.74397(11) 0.5778(4) 0.2318(2) 0.0444(11) Uani 1 1 d . . . . .
H27 H 0.7469 0.5426 0.1898 0.053 Uiso 1 1 calc R U . . .
C28 C 0.72056(10) 0.5390(4) 0.2731(2) 0.0385(10) Uani 1 1 d . . . . .
H28 H 0.7076 0.4771 0.2590 0.046 Uiso 1 1 calc R U . . .
C29 C 0.69601(9) 0.3810(3) 0.39818(18) 0.0270(8) Uani 1 1 d . . . . .
C30 C 0.72747(10) 0.3540(4) 0.4077(2) 0.0368(9) Uani 1 1 d . . . . .
H30 H 0.7427 0.4132 0.4048 0.044 Uiso 1 1 calc R U . . .
C31 C 0.73644(12) 0.2404(4) 0.4216(2) 0.0463(11) Uani 1 1 d . . . . .
H31 H 0.7578 0.2228 0.4277 0.056 Uiso 1 1 calc R U . . .
C32 C 0.71448(13) 0.1529(4) 0.4265(2) 0.0482(12) Uani 1 1 d . . . . .
H32 H 0.7207 0.0759 0.4361 0.058 Uiso 1 1 calc R U . . .
C33 C 0.68365(13) 0.1788(4) 0.4172(3) 0.0524(13) Uani 1 1 d . . . . .
H33 H 0.6686 0.1192 0.4205 0.063 Uiso 1 1 calc R U . . .
C34 C 0.67422(11) 0.2922(4) 0.4031(3) 0.0452(11) Uani 1 1 d . . . . .
H34 H 0.6528 0.3088 0.3967 0.054 Uiso 1 1 calc R U . . .
C35 C 0.53898(9) 0.7376(4) 0.61742(19) 0.0312(9) Uani 1 1 d . . . . .
C36 C 0.53696(11) 0.6369(4) 0.5796(2) 0.0446(11) Uani 1 1 d . . . . .
H36 H 0.5544 0.6106 0.5555 0.054 Uiso 1 1 calc R U . . .
C37 C 0.50903(13) 0.5744(5) 0.5771(2) 0.0601(15) Uani 1 1 d . . . . .
H37 H 0.5078 0.5047 0.5523 0.072 Uiso 1 1 calc R U . . .
C38 C 0.48334(12) 0.6138(6) 0.6106(3) 0.0628(16) Uani 1 1 d . . . . .
H38 H 0.4643 0.5726 0.6078 0.075 Uiso 1 1 calc R U . . .
C39 C 0.48542(11) 0.7135(5) 0.6483(3) 0.0645(17) Uani 1 1 d . . . . .
H39 H 0.4678 0.7401 0.6718 0.077 Uiso 1 1 calc R U . . .
C40 C 0.51310(11) 0.7753(4) 0.6521(3) 0.0509(13) Uani 1 1 d . . . . .
H40 H 0.5143 0.8433 0.6783 0.061 Uiso 1 1 calc R U . . .
C41 C 0.57954(10) 0.8765(4) 0.7295(2) 0.0338(9) Uani 1 1 d . . . . .
C42 C 0.59588(10) 0.8175(4) 0.7787(2) 0.0421(10) Uani 1 1 d . . . . .
H42 H 0.6096 0.7565 0.7669 0.051 Uiso 1 1 calc R U . . .
C43 C 0.59229(11) 0.8475(5) 0.8455(2) 0.0546(14) Uani 1 1 d . . . . .
H43 H 0.6035 0.8067 0.8788 0.066 Uiso 1 1 calc R U . . .
C44 C 0.57254(12) 0.9364(5) 0.8629(2) 0.0534(13) Uani 1 1 d . . . . .
H44 H 0.5702 0.9564 0.9082 0.064 Uiso 1 1 calc R U . . .
C45 C 0.55618(13) 0.9964(5) 0.8151(2) 0.0546(13) Uani 1 1 d . . . . .
H45 H 0.5425 1.0570 0.8276 0.066 Uiso 1 1 calc R U . . .
C46 C 0.55965(13) 0.9681(4) 0.7483(2) 0.0485(12) Uani 1 1 d . . . . .
H46 H 0.5486 1.0105 0.7154 0.058 Uiso 1 1 calc R U . . .
C47 C 0.57179(10) 0.9935(3) 0.58462(19) 0.0322(9) Uani 1 1 d . . . . .
C48 C 0.54298(12) 1.0177(4) 0.5553(2) 0.0456(11) Uani 1 1 d . . . . .
H48 H 0.5277 0.9586 0.5517 0.055 Uiso 1 1 calc R U . . .
C49 C 0.53669(13) 1.1291(4) 0.5312(3) 0.0567(14) Uani 1 1 d . . . . .
H49 H 0.5170 1.1456 0.5122 0.068 Uiso 1 1 calc R U . . .
C50 C 0.55863(14) 1.2143(4) 0.5347(3) 0.0536(13) Uani 1 1 d . . . . .
H50 H 0.5541 1.2893 0.5179 0.064 Uiso 1 1 calc R U . . .
C51 C 0.58730(12) 1.1917(4) 0.5625(3) 0.0537(13) Uani 1 1 d . . . . .
H51 H 0.6026 1.2509 0.5644 0.064 Uiso 1 1 calc R U . . .
C52 C 0.59400(11) 1.0817(4) 0.5880(2) 0.0440(11) Uani 1 1 d . . . . .
H52 H 0.6137 1.0669 0.6076 0.053 Uiso 1 1 calc R U . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Os1 Os2 2.8807(2) . ?
Os1 Os3 2.9153(2) . ?
Os1 P1 2.3363(9) . ?
Os1 C1 1.937(4) . ?
Os1 C2 1.884(4) . ?
Os1 C3 1.921(4) . ?
Os2 Os3 2.8648(2) . ?
Os2 P2 2.3234(9) . ?
Os2 C4 1.941(4) . ?
Os2 C5 1.878(5) . ?
Os2 C6 1.937(4) . ?
Os3 Sb1 2.5921(3) . ?
Os3 C7 1.933(4) . ?
Os3 C8 1.876(4) . ?
Os3 C9 1.937(4) . ?
Sb1 C35 2.135(4) . ?
Sb1 C41 2.140(4) . ?
Sb1 C47 2.125(4) . ?
P1 C10 1.837(4) . ?
P1 C11 1.827(4) . ?
P1 C17 1.828(4) . ?
P2 C10 1.840(4) . ?
P2 C23 1.819(4) . ?
P2 C29 1.830(4) . ?
C1 O1 1.140(5) . ?
C2 O2 1.147(5) . ?
C3 O3 1.146(5) . ?
C4 O4 1.137(5) . ?
C5 O5 1.147(5) . ?
C6 O6 1.134(5) . ?
C7 O7 1.146(5) . ?
C8 O8 1.140(5) . ?
C9 O9 1.137(5) . ?
C10 H10A 0.9800 . ?
C10 H10B 0.9800 . ?
C11 C12 1.357(6) . ?
C11 C16 1.381(6) . ?
C12 H12 0.9400 . ?
C12 C13 1.388(7) . ?
C13 H13 0.9400 . ?
C13 C14 1.356(8) . ?
C14 H14 0.9400 . ?
C14 C15 1.345(8) . ?
C15 H15 0.9400 . ?
C15 C16 1.386(7) . ?
C16 H16 0.9400 . ?
C17 C18 1.382(6) . ?
C17 C22 1.381(6) . ?
C18 H18 0.9400 . ?
C18 C19 1.385(6) . ?
C19 H19 0.9400 . ?
C19 C20 1.356(7) . ?
C20 H20 0.9400 . ?
C20 C21 1.360(8) . ?
C21 H21 0.9400 . ?
C21 C22 1.392(6) . ?
C22 H22 0.9400 . ?
C23 C24 1.378(5) . ?
C23 C28 1.389(5) . ?
C24 H24 0.9400 . ?
C24 C25 1.389(6) . ?
C25 H25 0.9400 . ?
C25 C26 1.362(6) . ?
C26 H26 0.9400 . ?
C26 C27 1.379(6) . ?
C27 H27 0.9400 . ?
C27 C28 1.374(6) . ?
C28 H28 0.9400 . ?
C29 C30 1.389(6) . ?
C29 C34 1.381(6) . ?
C30 H30 0.9400 . ?
C30 C31 1.381(6) . ?
C31 H31 0.9400 . ?
C31 C32 1.375(7) . ?
C32 H32 0.9400 . ?
C32 C33 1.360(7) . ?
C33 H33 0.9400 . ?
C33 C34 1.385(6) . ?
C34 H34 0.9400 . ?
C35 C36 1.379(6) . ?
C35 C40 1.377(6) . ?
C36 H36 0.9400 . ?
C36 C37 1.391(6) . ?
C37 H37 0.9400 . ?
C37 C38 1.366(8) . ?
C38 H38 0.9400 . ?
C38 C39 1.369(8) . ?
C39 H39 0.9400 . ?
C39 C40 1.378(7) . ?
C40 H40 0.9400 . ?
C41 C42 1.378(6) . ?
C41 C46 1.401(6) . ?
C42 H42 0.9400 . ?
C42 C43 1.389(6) . ?
C43 H43 0.9400 . ?
C43 C44 1.367(7) . ?
C44 H44 0.9400 . ?
C44 C45 1.364(8) . ?
C45 H45 0.9400 . ?
C45 C46 1.383(6) . ?
C46 H46 0.9400 . ?
C47 C48 1.386(6) . ?
C47 C52 1.385(6) . ?
C48 H48 0.9400 . ?
C48 C49 1.387(6) . ?
C49 H49 0.9400 . ?
C49 C50 1.353(7) . ?
C50 H50 0.9400 . ?
C50 C51 1.365(7) . ?
C51 H51 0.9400 . ?
C51 C52 1.385(7) . ?
C52 H52 0.9400 . ?

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
_geom_angle_publ_flag
Os2 Os1 Os3 59.240(5) . . ?
P1 Os1 Os2 88.54(2) . . ?
P1 Os1 Os3 147.54(2) . . ?
C1 Os1 Os2 95.61(11) . . ?
C1 Os1 Os3 80.12(11) . . ?
C1 Os1 P1 100.99(11) . . ?
C2 Os1 Os2 170.71(13) . . ?
C2 Os1 Os3 114.18(13) . . ?
C2 Os1 P1 98.28(13) . . ?
C2 Os1 C1 89.32(18) . . ?
C2 Os1 C3 91.80(18) . . ?
C3 Os1 Os2 81.99(12) . . ?
C3 Os1 Os3 90.29(11) . . ?
C3 Os1 P1 88.78(12) . . ?
C3 Os1 C1 169.90(16) . . ?
Os3 Os2 Os1 60.982(5) . . ?
P2 Os2 Os1 94.12(2) . . ?
P2 Os2 Os3 153.06(2) . . ?
C4 Os2 Os1 80.47(13) . . ?
C4 Os2 Os3 90.76(12) . . ?
C4 Os2 P2 95.24(13) . . ?
C5 Os2 Os1 165.82(13) . . ?
C5 Os2 Os3 107.20(13) . . ?
C5 Os2 P2 98.78(13) . . ?
C5 Os2 C4 92.4(2) . . ?
C5 Os2 C6 88.5(2) . . ?
C6 Os2 Os1 97.49(13) . . ?
C6 Os2 Os3 83.99(11) . . ?
C6 Os2 P2 89.76(12) . . ?
C6 Os2 C4 174.71(17) . . ?
Os2 Os3 Os1 59.779(5) . . ?
Sb1 Os3 Os1 93.868(8) . . ?
Sb1 Os3 Os2 153.206(9) . . ?
C7 Os3 Os1 94.34(11) . . ?
C7 Os3 Os2 84.79(12) . . ?
C7 Os3 Sb1 93.16(12) . . ?
C7 Os3 C9 175.12(18) . . ?
C8 Os3 Os1 163.08(12) . . ?
C8 Os3 Os2 103.85(12) . . ?
C8 Os3 Sb1 102.77(12) . . ?
C8 Os3 C7 87.87(17) . . ?
C8 Os3 C9 89.06(18) . . ?
C9 Os3 Os1 87.51(13) . . ?
C9 Os3 Os2 92.26(12) . . ?
C9 Os3 Sb1 91.22(12) . . ?
C35 Sb1 Os3 117.86(11) . . ?
C35 Sb1 C41 98.43(15) . . ?
C41 Sb1 Os3 117.44(12) . . ?
C47 Sb1 Os3 119.68(11) . . ?
C47 Sb1 C35 102.01(16) . . ?
C47 Sb1 C41 97.43(15) . . ?
C10 P1 Os1 110.49(12) . . ?
C11 P1 Os1 122.93(13) . . ?
C11 P1 C10 103.02(18) . . ?
C11 P1 C17 101.95(18) . . ?
C17 P1 Os1 113.19(12) . . ?
C17 P1 C10 103.08(18) . . ?
C10 P2 Os2 111.89(12) . . ?
C23 P2 Os2 120.58(13) . . ?
C23 P2 C10 104.53(17) . . ?
C23 P2 C29 101.56(17) . . ?
C29 P2 Os2 112.93(12) . . ?
C29 P2 C10 103.54(17) . . ?
O1 C1 Os1 176.2(3) . . ?
O2 C2 Os1 176.8(4) . . ?
O3 C3 Os1 175.4(4) . . ?
O4 C4 Os2 176.2(4) . . ?
O5 C5 Os2 179.1(4) . . ?
O6 C6 Os2 174.6(4) . . ?
O7 C7 Os3 175.4(3) . . ?
O8 C8 Os3 177.9(4) . . ?
O9 C9 Os3 175.2(4) . . ?
P1 C10 P2 112.01(18) . . ?
P1 C10 H10A 109.2 . . ?
P1 C10 H10B 109.2 . . ?
P2 C10 H10A 109.2 . . ?
P2 C10 H10B 109.2 . . ?
H10A C10 H10B 107.9 . . ?
C12 C11 P1 122.4(3) . . ?
C12 C11 C16 118.0(4) . . ?
C16 C11 P1 119.5(3) . . ?
C11 C12 H12 119.6 . . ?
C11 C12 C13 120.9(5) . . ?
C13 C12 H12 119.6 . . ?
C12 C13 H13 119.9 . . ?
C14 C13 C12 120.2(5) . . ?
C14 C13 H13 119.9 . . ?
C13 C14 H14 120.2 . . ?
C15 C14 C13 119.7(5) . . ?
C15 C14 H14 120.2 . . ?
C14 C15 H15 119.8 . . ?
C14 C15 C16 120.4(5) . . ?
C16 C15 H15 119.8 . . ?
C11 C16 C15 120.5(5) . . ?
C11 C16 H16 119.8 . . ?
C15 C16 H16 119.8 . . ?
C18 C17 P1 118.4(3) . . ?
C22 C17 P1 122.8(3) . . ?
C22 C17 C18 118.5(4) . . ?
C17 C18 H18 119.5 . . ?
C17 C18 C19 121.0(5) . . ?
C19 C18 H18 119.5 . . ?
C18 C19 H19 120.0 . . ?
C20 C19 C18 119.9(5) . . ?
C20 C19 H19 120.0 . . ?
C19 C20 H20 120.1 . . ?
C19 C20 C21 119.9(4) . . ?
C21 C20 H20 120.1 . . ?
C20 C21 H21 119.4 . . ?
C20 C21 C22 121.1(5) . . ?
C22 C21 H21 119.4 . . ?
C17 C22 C21 119.5(5) . . ?
C17 C22 H22 120.3 . . ?
C21 C22 H22 120.3 . . ?
C24 C23 P2 121.9(3) . . ?
C24 C23 C28 118.1(4) . . ?
C28 C23 P2 119.9(3) . . ?
C23 C24 H24 119.6 . . ?
C23 C24 C25 120.7(4) . . ?
C25 C24 H24 119.6 . . ?
C24 C25 H25 119.9 . . ?
C26 C25 C24 120.2(4) . . ?
C26 C25 H25 119.9 . . ?
C25 C26 H26 120.0 . . ?
C25 C26 C27 120.0(4) . . ?
C27 C26 H26 120.0 . . ?
C26 C27 H27 120.1 . . ?
C28 C27 C26 119.8(4) . . ?
C28 C27 H27 120.1 . . ?
C23 C28 H28 119.4 . . ?
C27 C28 C23 121.2(4) . . ?
C27 C28 H28 119.4 . . ?
C30 C29 P2 118.7(3) . . ?
C34 C29 P2 122.4(3) . . ?
C34 C29 C30 118.5(4) . . ?
C29 C30 H30 119.9 . . ?
C31 C30 C29 120.2(4) . . ?
C31 C30 H30 119.9 . . ?
C30 C31 H31 119.7 . . ?
C32 C31 C30 120.7(4) . . ?
C32 C31 H31 119.7 . . ?
C31 C32 H32 120.3 . . ?
C33 C32 C31 119.4(4) . . ?
C33 C32 H32 120.3 . . ?
C32 C33 H33 119.6 . . ?
C32 C33 C34 120.7(4) . . ?
C34 C33 H33 119.6 . . ?
C29 C34 C33 120.5(4) . . ?
C29 C34 H34 119.8 . . ?
C33 C34 H34 119.8 . . ?
C36 C35 Sb1 119.9(3) . . ?
C40 C35 Sb1 120.7(3) . . ?
C40 C35 C36 119.3(4) . . ?
C35 C36 H36 120.1 . . ?
C35 C36 C37 119.9(5) . . ?
C37 C36 H36 120.1 . . ?
C36 C37 H37 119.9 . . ?
C38 C37 C36 120.3(5) . . ?
C38 C37 H37 119.9 . . ?
C37 C38 H38 120.2 . . ?
C37 C38 C39 119.7(5) . . ?
C39 C38 H38 120.2 . . ?
C38 C39 H39 119.7 . . ?
C38 C39 C40 120.6(5) . . ?
C40 C39 H39 119.7 . . ?
C35 C40 C39 120.2(5) . . ?
C35 C40 H40 119.9 . . ?
C39 C40 H40 119.9 . . ?
C42 C41 Sb1 121.6(3) . . ?
C42 C41 C46 118.6(4) . . ?
C46 C41 Sb1 119.8(3) . . ?
C41 C42 H42 119.8 . . ?
C41 C42 C43 120.4(5) . . ?
C43 C42 H42 119.8 . . ?
C42 C43 H43 120.0 . . ?
C44 C43 C42 120.1(5) . . ?
C44 C43 H43 120.0 . . ?
C43 C44 H44 119.7 . . ?
C45 C44 C43 120.6(4) . . ?
C45 C44 H44 119.7 . . ?
C44 C45 H45 120.0 . . ?
C44 C45 C46 120.1(5) . . ?
C46 C45 H45 120.0 . . ?
C41 C46 H46 119.9 . . ?
C45 C46 C41 120.2(5) . . ?
C45 C46 H46 119.9 . . ?
C48 C47 Sb1 122.4(3) . . ?
C52 C47 Sb1 118.9(3) . . ?
C52 C47 C48 118.7(4) . . ?
C47 C48 H48 120.0 . . ?
C47 C48 C49 119.9(4) . . ?
C49 C48 H48 120.0 . . ?
C48 C49 H49 119.6 . . ?
C50 C49 C48 120.7(5) . . ?
C50 C49 H49 119.6 . . ?
C49 C50 H50 119.9 . . ?
C49 C50 C51 120.1(5) . . ?
C51 C50 H50 119.9 . . ?
C50 C51 H51 119.9 . . ?
C50 C51 C52 120.3(5) . . ?
C52 C51 H51 119.9 . . ?
C47 C52 H52 119.9 . . ?
C51 C52 C47 120.2(4) . . ?
C51 C52 H52 119.9 . . ?

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_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
Os1 P1 C10 P2 -55.5(2) . . . . ?
Os1 P1 C11 C12 -11.4(5) . . . . ?
Os1 P1 C11 C16 170.8(3) . . . . ?
Os1 P1 C17 C18 93.1(4) . . . . ?
Os1 P1 C17 C22 -81.7(4) . . . . ?
Os2 P2 C10 P1 39.6(2) . . . . ?
Os2 P2 C23 C24 6.6(4) . . . . ?
Os2 P2 C23 C28 -176.5(3) . . . . ?
Os2 P2 C29 C30 -88.9(3) . . . . ?
Os2 P2 C29 C34 84.1(4) . . . . ?
Sb1 C35 C36 C37 175.9(4) . . . . ?
Sb1 C35 C40 C39 -177.0(4) . . . . ?
Sb1 C41 C42 C43 -176.9(4) . . . . ?
Sb1 C41 C46 C45 176.5(4) . . . . ?
Sb1 C47 C48 C49 177.4(4) . . . . ?
Sb1 C47 C52 C51 -178.5(4) . . . . ?
P1 C11 C12 C13 178.8(5) . . . . ?
P1 C11 C16 C15 -178.0(4) . . . . ?
P1 C17 C18 C19 -173.7(4) . . . . ?
P1 C17 C22 C21 174.3(4) . . . . ?
P2 C23 C24 C25 179.4(4) . . . . ?
P2 C23 C28 C27 -179.2(4) . . . . ?
P2 C29 C30 C31 173.5(3) . . . . ?
P2 C29 C34 C33 -173.0(4) . . . . ?
C10 P1 C11 C12 -136.7(5) . . . . ?
C10 P1 C11 C16 45.5(4) . . . . ?
C10 P1 C17 C18 -147.6(4) . . . . ?
C10 P1 C17 C22 37.7(4) . . . . ?
C10 P2 C23 C24 133.5(4) . . . . ?
C10 P2 C23 C28 -49.6(4) . . . . ?
C10 P2 C29 C30 149.9(3) . . . . ?
C10 P2 C29 C34 -37.1(4) . . . . ?
C11 P1 C10 P2 77.5(2) . . . . ?
C11 P1 C17 C18 -41.0(4) . . . . ?
C11 P1 C17 C22 144.3(4) . . . . ?
C11 C12 C13 C14 -1.0(11) . . . . ?
C12 C11 C16 C15 4.1(8) . . . . ?
C12 C13 C14 C15 4.7(11) . . . . ?
C13 C14 C15 C16 -3.9(10) . . . . ?
C14 C15 C16 C11 -0.5(9) . . . . ?
C16 C11 C12 C13 -3.3(9) . . . . ?
C17 P1 C10 P2 -176.73(19) . . . . ?
C17 P1 C11 C12 116.7(5) . . . . ?
C17 P1 C11 C16 -61.1(4) . . . . ?
C17 C18 C19 C20 -0.8(8) . . . . ?
C18 C17 C22 C21 -0.4(7) . . . . ?
C18 C19 C20 C21 -0.5(8) . . . . ?
C19 C20 C21 C22 1.3(8) . . . . ?
C20 C21 C22 C17 -0.8(7) . . . . ?
C22 C17 C18 C19 1.2(7) . . . . ?
C23 P2 C10 P1 -92.5(2) . . . . ?
C23 P2 C29 C30 41.7(3) . . . . ?
C23 P2 C29 C34 -145.3(4) . . . . ?
C23 C24 C25 C26 -0.7(8) . . . . ?
C24 C23 C28 C27 -2.2(7) . . . . ?
C24 C25 C26 C27 -1.4(8) . . . . ?
C25 C26 C27 C28 1.7(8) . . . . ?
C26 C27 C28 C23 0.1(7) . . . . ?
C28 C23 C24 C25 2.5(7) . . . . ?
C29 P2 C10 P1 161.47(19) . . . . ?
C29 P2 C23 C24 -119.0(4) . . . . ?
C29 P2 C23 C28 57.9(4) . . . . ?
C29 C30 C31 C32 -0.4(7) . . . . ?
C30 C29 C34 C33 0.0(7) . . . . ?
C30 C31 C32 C33 0.3(7) . . . . ?
C31 C32 C33 C34 -0.1(8) . . . . ?
C32 C33 C34 C29 -0.1(8) . . . . ?
C34 C29 C30 C31 0.2(6) . . . . ?
C35 C36 C37 C38 1.7(8) . . . . ?
C36 C35 C40 C39 -0.7(7) . . . . ?
C36 C37 C38 C39 -1.8(8) . . . . ?
C37 C38 C39 C40 0.8(9) . . . . ?
C38 C39 C40 C35 0.5(8) . . . . ?
C40 C35 C36 C37 -0.4(7) . . . . ?
C41 C42 C43 C44 -0.2(8) . . . . ?
C42 C41 C46 C45 -1.3(7) . . . . ?
C42 C43 C44 C45 0.0(8) . . . . ?
C43 C44 C45 C46 -0.5(8) . . . . ?
C44 C45 C46 C41 1.1(8) . . . . ?
C46 C41 C42 C43 0.9(7) . . . . ?
C47 C48 C49 C50 1.4(8) . . . . ?
C48 C47 C52 C51 0.2(7) . . . . ?
C48 C49 C50 C51 -0.5(9) . . . . ?
C49 C50 C51 C52 -0.6(8) . . . . ?
C50 C51 C52 C47 0.8(8) . . . . ?
C52 C47 C48 C49 -1.2(7) . . . . ?

_olex2_submission_special_instructions 'No special instructions were received'
####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_fi_1d1_a
_database_code_depnum_ccdc_archive 'CCDC 2152364'
loop_
_audit_author_name
_audit_author_address
'Shishir Ghosh'
;Jahangirnagar University
Bangladesh
;
_audit_update_record             
;
2022-02-16 deposited with the CCDC.	2022-12-19 downloaded from the CCDC.
;
_audit_creation_date             2021-09-28
_audit_creation_method           
;
Olex2 1.3
(compiled 2020.11.12 svn.r5f609507 for OlexSys, GUI svn.r6272)
;
_shelx_SHELXL_version_number     2014/7
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C50 H37 O7 Os3 P2 Sb, C H2 Cl2'
_chemical_formula_sum            'C51 H39 Cl2 O7 Os3 P2 Sb'
_chemical_formula_weight         1589.01
_chemical_melting_point          ?
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'
Cl Cl 0.1484 0.1585 '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'
Os Os -1.2165 7.6030 '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'
Sb Sb -0.5866 1.5461 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 1 21/c 1'
_space_group_name_Hall           '-P 2ybc'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'

_cell_length_a                   19.6929(10)
_cell_length_b                   13.9599(7)
_cell_length_c                   20.1424(10)
_cell_angle_alpha                90
_cell_angle_beta                 113.6390(10)
_cell_angle_gamma                90
_cell_volume                     5072.7(4)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    9241
_cell_measurement_temperature    210(1)
_cell_measurement_theta_max      28.24
_cell_measurement_theta_min      2.69
_shelx_estimated_absorpt_T_max   ?
_shelx_estimated_absorpt_T_min   ?
_exptl_absorpt_coefficient_mu    8.235
_exptl_absorpt_correction_T_max  0.7457
_exptl_absorpt_correction_T_min  0.5174
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
SADABS-2014/5 (Bruker,2014/5) was used for absorption correction.
wR2(int) was 0.1055 before and 0.0581 after correction.
The Ratio of minimum to maximum transmission is 0.6938.
The λ/2 correction factor is Not present.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            green
_exptl_crystal_colour_primary    green
_exptl_crystal_density_diffrn    2.081
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       block
_exptl_crystal_F_000             2976
_exptl_crystal_size_max          0.221
_exptl_crystal_size_mid          0.188
_exptl_crystal_size_min          0.079
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0611
_diffrn_reflns_av_unetI/netI     0.0391
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.992
_diffrn_reflns_limit_h_max       26
_diffrn_reflns_limit_h_min       -26
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_l_max       26
_diffrn_reflns_limit_l_min       -26
_diffrn_reflns_number            115314
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.992
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         28.381
_diffrn_reflns_theta_min         2.258
_diffrn_ambient_temperature      210(1)
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.992
_diffrn_measurement_device_type  'Bruker D8 Venture'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   ?
_diffrn_source_current           1.0
_diffrn_source_power             0.05
_diffrn_source_voltage           50.0
_diffrn_standards_number         0
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                9804
_reflns_number_total             12614
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       ?
_computing_data_collection       ?
_computing_data_reduction        ?
_computing_molecular_graphics    'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_structure_refinement  'XL  (Sheldrick, 2008)'
_computing_structure_solution    'SHELXT 2014/5 (Sheldrick, 2014)'
_refine_diff_density_max         1.133
_refine_diff_density_min         -1.049
_refine_diff_density_rms         0.164
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.025
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     599
_refine_ls_number_reflns         12614
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0522
_refine_ls_R_factor_gt           0.0290
_refine_ls_restrained_S_all      1.025
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0136P)²+17.8976P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0498
_refine_ls_wR_factor_ref         0.0559
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
2.a Secondary CH2 refined with riding coordinates:
 C8(H8A,H8B), C51(H51A,H51B)
2.b Aromatic/amide H refined with riding coordinates:
 C11(H11), C12(H12), C13(H13), C14(H14), C16(H16), C17(H17), C18(H18),
 C19(H19), C20(H20), C22(H22), C23(H23), C24(H24), C25(H25), C26(H26), C28(H28),
  C29(H29), C30(H30), C31(H31), C32(H32), C34(H34), C35(H35), C36(H36),
 C37(H37), C38(H38), C40(H40), C41(H41), C42(H42), C43(H43), C44(H44), C46(H46),
  C47(H47), C48(H48), C49(H49), C50(H50)
;
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     dual
_atom_sites_solution_secondary   ?
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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Os1 Os 0.73378(2) 0.67976(2) 0.53768(2) 0.01840(4) Uani 1 1 d . . . . .
Os2 Os 0.84967(2) 0.81198(2) 0.56083(2) 0.02276(5) Uani 1 1 d . . . . .
Os3 Os 0.70759(2) 0.84233(2) 0.45196(2) 0.02083(4) Uani 1 1 d . . . . .
Sb1 Sb 0.56560(2) 0.85280(2) 0.36663(2) 0.02186(7) Uani 1 1 d . . . . .
P1 P 0.81524(6) 0.55213(8) 0.55467(6) 0.0228(2) Uani 1 1 d . . . . .
P2 P 0.86536(6) 0.70328(8) 0.48024(6) 0.0225(2) Uani 1 1 d . . . . .
C1 C 0.6514(3) 0.5995(3) 0.5187(2) 0.0227(10) Uani 1 1 d . . . . .
C2 C 0.7549(3) 0.6995(3) 0.6367(3) 0.0301(11) Uani 1 1 d . . . . .
C3 C 0.8983(3) 0.9154(4) 0.5347(3) 0.0398(13) Uani 1 1 d . . . . .
C4 C 0.9269(3) 0.7528(4) 0.6390(3) 0.0327(12) Uani 1 1 d . . . . .
C5 C 0.8179(3) 0.8839(4) 0.6243(3) 0.0341(12) Uani 1 1 d . . . . .
C6 C 0.7425(3) 0.9020(4) 0.3887(3) 0.0331(12) Uani 1 1 d . . . . .
C7 C 0.7086(3) 0.9611(4) 0.4910(3) 0.0313(11) Uani 1 1 d . . . . .
O1 O 0.60324(19) 0.5479(2) 0.51038(18) 0.0354(8) Uani 1 1 d . . . . .
O2 O 0.7667(2) 0.7133(3) 0.69673(19) 0.0461(10) Uani 1 1 d . . . . .
O3 O 0.9269(3) 0.9765(3) 0.5185(3) 0.0701(14) Uani 1 1 d . . . . .
O4 O 0.9738(2) 0.7157(3) 0.6866(2) 0.0518(11) Uani 1 1 d . . . . .
O5 O 0.7996(2) 0.9247(3) 0.6636(2) 0.0528(11) Uani 1 1 d . . . . .
O6 O 0.7654(2) 0.9398(3) 0.3513(2) 0.0548(11) Uani 1 1 d . . . . .
O7 O 0.7106(2) 1.0367(3) 0.5160(2) 0.0510(11) Uani 1 1 d . . . . .
C8 C 0.8872(2) 0.5833(3) 0.5213(3) 0.0249(10) Uani 1 1 d . . . . .
H8A H 0.9362 0.5834 0.5614 0.030 Uiso 1 1 calc R U . . .
H8B H 0.8874 0.5364 0.4852 0.030 Uiso 1 1 calc R U . . .
C9 C 0.7800(2) 0.6789(3) 0.4032(2) 0.0218(9) Uani 1 1 d . . . . .
C10 C 0.7178(2) 0.6783(3) 0.4215(2) 0.0204(9) Uani 1 1 d . . . . .
C11 C 0.6507(2) 0.6458(3) 0.3663(2) 0.0243(10) Uani 1 1 d . . . . .
H11 H 0.6078 0.6427 0.3759 0.029 Uiso 1 1 calc R U . . .
C12 C 0.6465(3) 0.6186(3) 0.2989(3) 0.0305(11) Uani 1 1 d . . . . .
H12 H 0.6009 0.5980 0.2634 0.037 Uiso 1 1 calc R U . . .
C13 C 0.7086(3) 0.6214(4) 0.2830(3) 0.0319(11) Uani 1 1 d . . . . .
H13 H 0.7053 0.6034 0.2368 0.038 Uiso 1 1 calc R U . . .
C14 C 0.7756(3) 0.6508(3) 0.3355(3) 0.0303(11) Uani 1 1 d . . . . .
H14 H 0.8182 0.6519 0.3254 0.036 Uiso 1 1 calc R U . . .
C15 C 0.9373(3) 0.7265(3) 0.4472(3) 0.0278(11) Uani 1 1 d . . . . .
C16 C 1.0085(3) 0.6941(4) 0.4856(4) 0.0503(16) Uani 1 1 d . . . . .
H16 H 1.0186 0.6538 0.5258 0.060 Uiso 1 1 calc R U . . .
C17 C 1.0658(4) 0.7206(5) 0.4653(4) 0.072(2) Uani 1 1 d . . . . .
H17 H 1.1143 0.6988 0.4922 0.086 Uiso 1 1 calc R U . . .
C18 C 1.0513(4) 0.7780(5) 0.4065(4) 0.065(2) Uani 1 1 d . . . . .
H18 H 1.0897 0.7948 0.3923 0.077 Uiso 1 1 calc R U . . .
C19 C 0.9811(4) 0.8111(5) 0.3681(4) 0.0563(17) Uani 1 1 d . . . . .
H19 H 0.9711 0.8506 0.3275 0.068 Uiso 1 1 calc R U . . .
C20 C 0.9248(3) 0.7865(4) 0.3892(3) 0.0427(14) Uani 1 1 d . . . . .
H20 H 0.8770 0.8112 0.3634 0.051 Uiso 1 1 calc R U . . .
C21 C 0.8666(3) 0.5060(3) 0.6462(3) 0.0300(11) Uani 1 1 d . . . . .
C22 C 0.8326(3) 0.5034(4) 0.6942(3) 0.0415(14) Uani 1 1 d . . . . .
H22 H 0.7843 0.5277 0.6800 0.050 Uiso 1 1 calc R U . . .
C23 C 0.8686(4) 0.4654(4) 0.7630(3) 0.0532(17) Uani 1 1 d . . . . .
H23 H 0.8445 0.4625 0.7948 0.064 Uiso 1 1 calc R U . . .
C24 C 0.9397(4) 0.4323(5) 0.7844(3) 0.0598(19) Uani 1 1 d . . . . .
H24 H 0.9650 0.4084 0.8317 0.072 Uiso 1 1 calc R U . . .
C25 C 0.9741(3) 0.4337(5) 0.7370(4) 0.0614(19) Uani 1 1 d . . . . .
H25 H 1.0226 0.4101 0.7516 0.074 Uiso 1 1 calc R U . . .
C26 C 0.9374(3) 0.4700(4) 0.6681(3) 0.0469(15) Uani 1 1 d . . . . .
H26 H 0.9609 0.4701 0.6357 0.056 Uiso 1 1 calc R U . . .
C27 C 0.7737(2) 0.4412(3) 0.5051(3) 0.0274(11) Uani 1 1 d . . . . .
C28 C 0.7574(3) 0.4330(4) 0.4313(3) 0.0358(12) Uani 1 1 d . . . . .
H28 H 0.7679 0.4842 0.4066 0.043 Uiso 1 1 calc R U . . .
C29 C 0.7261(3) 0.3506(4) 0.3945(3) 0.0474(15) Uani 1 1 d . . . . .
H29 H 0.7159 0.3456 0.3449 0.057 Uiso 1 1 calc R U . . .
C30 C 0.7097(3) 0.2756(4) 0.4296(4) 0.0520(16) Uani 1 1 d . . . . .
H30 H 0.6885 0.2194 0.4041 0.062 Uiso 1 1 calc R U . . .
C31 C 0.7243(3) 0.2828(4) 0.5015(4) 0.0508(16) Uani 1 1 d . . . . .
H31 H 0.7128 0.2315 0.5254 0.061 Uiso 1 1 calc R U . . .
C32 C 0.7562(3) 0.3659(4) 0.5398(3) 0.0379(13) Uani 1 1 d . . . . .
H32 H 0.7659 0.3706 0.5893 0.045 Uiso 1 1 calc R U . . .
C33 C 0.4836(2) 0.7472(3) 0.3562(3) 0.0256(10) Uani 1 1 d . . . . .
C34 C 0.4444(3) 0.7019(4) 0.2905(3) 0.0394(13) Uani 1 1 d . . . . .
H34 H 0.4554 0.7154 0.2502 0.047 Uiso 1 1 calc R U . . .
C35 C 0.3891(3) 0.6371(4) 0.2844(4) 0.0538(17) Uani 1 1 d . . . . .
H35 H 0.3627 0.6067 0.2397 0.065 Uiso 1 1 calc R U . . .
C36 C 0.3726(3) 0.6169(4) 0.3425(4) 0.0533(17) Uani 1 1 d . . . . .
H36 H 0.3342 0.5738 0.3375 0.064 Uiso 1 1 calc R U . . .
C37 C 0.4120(3) 0.6592(4) 0.4082(4) 0.0459(15) Uani 1 1 d . . . . .
H37 H 0.4014 0.6441 0.4485 0.055 Uiso 1 1 calc R U . . .
C38 C 0.4673(3) 0.7242(4) 0.4148(3) 0.0376(13) Uani 1 1 d . . . . .
H38 H 0.4943 0.7531 0.4599 0.045 Uiso 1 1 calc R U . . .
C39 C 0.5426(3) 0.8754(3) 0.2555(2) 0.0258(10) Uani 1 1 d . . . . .
C40 C 0.5963(3) 0.8585(3) 0.2291(3) 0.0278(11) Uani 1 1 d . . . . .
H40 H 0.6426 0.8335 0.2599 0.033 Uiso 1 1 calc R U . . .
C41 C 0.5820(3) 0.8783(4) 0.1573(3) 0.0325(11) Uani 1 1 d . . . . .
H41 H 0.6188 0.8676 0.1397 0.039 Uiso 1 1 calc R U . . .
C42 C 0.5138(3) 0.9137(4) 0.1117(3) 0.0320(11) Uani 1 1 d . . . . .
H42 H 0.5044 0.9279 0.0632 0.038 Uiso 1 1 calc R U . . .
C43 C 0.4596(3) 0.9280(4) 0.1374(3) 0.0326(12) Uani 1 1 d . . . . .
H43 H 0.4127 0.9503 0.1059 0.039 Uiso 1 1 calc R U . . .
C44 C 0.4735(3) 0.9101(3) 0.2090(3) 0.0283(11) Uani 1 1 d . . . . .
H44 H 0.4364 0.9212 0.2264 0.034 Uiso 1 1 calc R U . . .
C45 C 0.5101(3) 0.9759(3) 0.3834(2) 0.0277(11) Uani 1 1 d . . . . .
C46 C 0.5411(3) 1.0650(4) 0.3843(3) 0.0369(12) Uani 1 1 d . . . . .
H46 H 0.5857 1.0699 0.3780 0.044 Uiso 1 1 calc R U . . .
C47 C 0.5069(3) 1.1473(4) 0.3945(3) 0.0451(14) Uani 1 1 d . . . . .
H47 H 0.5281 1.2076 0.3945 0.054 Uiso 1 1 calc R U . . .
C48 C 0.4425(3) 1.1405(4) 0.4045(3) 0.0428(14) Uani 1 1 d . . . . .
H48 H 0.4195 1.1963 0.4116 0.051 Uiso 1 1 calc R U . . .
C49 C 0.4110(3) 1.0525(4) 0.4040(3) 0.0444(14) Uani 1 1 d . . . . .
H49 H 0.3666 1.0482 0.4109 0.053 Uiso 1 1 calc R U . . .
C50 C 0.4446(3) 0.9704(4) 0.3935(3) 0.0351(12) Uani 1 1 d . . . . .
H50 H 0.4229 0.9104 0.3932 0.042 Uiso 1 1 calc R U . . .
C51 C 0.1476(5) 0.8525(8) 0.2594(6) 0.127(4) Uani 1 1 d . . . . .
H51A H 0.1398 0.8921 0.2959 0.152 Uiso 1 1 calc R U . . .
H51B H 0.1133 0.7982 0.2484 0.152 Uiso 1 1 calc R U . . .
Cl1 Cl 0.12613(15) 0.9213(2) 0.17966(15) 0.1182(9) Uani 1 1 d . . . . .
Cl2 Cl 0.2350(2) 0.8107(3) 0.2943(2) 0.1811(16) Uani 1 1 d . . . . .
H H 0.675(3) 0.776(4) 0.519(3) 0.052(16) Uiso 1 1 d . . . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Os1 Os2 2.8249(3) . ?
Os1 Os3 2.7720(3) . ?
Os1 P1 2.3290(12) . ?
Os1 C1 1.879(5) . ?
Os1 C2 1.888(5) . ?
Os1 C10 2.232(4) . ?
Os1 H 1.71(5) . ?
Os2 Os3 2.8101(3) . ?
Os2 P2 2.3314(12) . ?
Os2 C3 1.919(6) . ?
Os2 C4 1.886(5) . ?
Os2 C5 1.917(5) . ?
Os3 Sb1 2.6343(4) . ?
Os3 C6 1.869(5) . ?
Os3 C7 1.832(5) . ?
Os3 C10 2.399(4) . ?
Os3 H 1.95(5) . ?
Sb1 C33 2.134(5) . ?
Sb1 C39 2.123(5) . ?
Sb1 C45 2.136(5) . ?
P1 C8 1.848(5) . ?
P1 C21 1.827(5) . ?
P1 C27 1.847(5) . ?
P2 C8 1.841(5) . ?
P2 C9 1.804(4) . ?
P2 C15 1.820(5) . ?
C1 O1 1.149(5) . ?
C2 O2 1.152(6) . ?
C3 O3 1.140(6) . ?
C4 O4 1.152(6) . ?
C5 O5 1.145(6) . ?
C6 O6 1.149(6) . ?
C7 O7 1.163(6) . ?
C8 H8A 0.9800 . ?
C8 H8B 0.9800 . ?
C9 C10 1.415(6) . ?
C9 C14 1.387(6) . ?
C10 C11 1.417(6) . ?
C11 H11 0.9400 . ?
C11 C12 1.380(6) . ?
C12 H12 0.9400 . ?
C12 C13 1.385(7) . ?
C13 H13 0.9400 . ?
C13 C14 1.381(7) . ?
C14 H14 0.9400 . ?
C15 C16 1.378(7) . ?
C15 C20 1.378(7) . ?
C16 H16 0.9400 . ?
C16 C17 1.394(8) . ?
C17 H17 0.9400 . ?
C17 C18 1.362(9) . ?
C18 H18 0.9400 . ?
C18 C19 1.366(9) . ?
C19 H19 0.9400 . ?
C19 C20 1.379(8) . ?
C20 H20 0.9400 . ?
C21 C22 1.381(7) . ?
C21 C26 1.378(7) . ?
C22 H22 0.9400 . ?
C22 C23 1.384(7) . ?
C23 H23 0.9400 . ?
C23 C24 1.369(8) . ?
C24 H24 0.9400 . ?
C24 C25 1.376(9) . ?
C25 H25 0.9400 . ?
C25 C26 1.380(8) . ?
C26 H26 0.9400 . ?
C27 C28 1.394(7) . ?
C27 C32 1.379(7) . ?
C28 H28 0.9400 . ?
C28 C29 1.373(7) . ?
C29 H29 0.9400 . ?
C29 C30 1.372(8) . ?
C30 H30 0.9400 . ?
C30 C31 1.363(8) . ?
C31 H31 0.9400 . ?
C31 C32 1.395(7) . ?
C32 H32 0.9400 . ?
C33 C34 1.388(7) . ?
C33 C38 1.379(7) . ?
C34 H34 0.9400 . ?
C34 C35 1.382(7) . ?
C35 H35 0.9400 . ?
C35 C36 1.365(9) . ?
C36 H36 0.9400 . ?
C36 C37 1.369(9) . ?
C37 H37 0.9400 . ?
C37 C38 1.384(7) . ?
C38 H38 0.9400 . ?
C39 C40 1.381(6) . ?
C39 C44 1.394(6) . ?
C40 H40 0.9400 . ?
C40 C41 1.385(7) . ?
C41 H41 0.9400 . ?
C41 C42 1.378(7) . ?
C42 H42 0.9400 . ?
C42 C43 1.376(7) . ?
C43 H43 0.9400 . ?
C43 C44 1.377(7) . ?
C44 H44 0.9400 . ?
C45 C46 1.382(7) . ?
C45 C50 1.385(7) . ?
C46 H46 0.9400 . ?
C46 C47 1.387(7) . ?
C47 H47 0.9400 . ?
C47 C48 1.365(8) . ?
C48 H48 0.9400 . ?
C48 C49 1.375(8) . ?
C49 H49 0.9400 . ?
C49 C50 1.381(7) . ?
C50 H50 0.9400 . ?
C51 H51A 0.9800 . ?
C51 H51B 0.9800 . ?
C51 Cl1 1.771(10) . ?
C51 Cl2 1.683(10) . ?

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
_geom_angle_publ_flag
Os2 Os1 H 87.3(18) . . ?
Os3 Os1 Os2 60.266(7) . . ?
Os3 Os1 H 44.0(18) . . ?
P1 Os1 Os2 90.71(3) . . ?
P1 Os1 Os3 131.53(3) . . ?
P1 Os1 H 175.4(17) . . ?
C1 Os1 Os2 175.52(14) . . ?
C1 Os1 Os3 115.54(13) . . ?
C1 Os1 P1 93.52(14) . . ?
C1 Os1 C2 96.2(2) . . ?
C1 Os1 C10 91.93(17) . . ?
C1 Os1 H 88.4(18) . . ?
C2 Os1 Os2 84.77(15) . . ?
C2 Os1 Os3 116.49(15) . . ?
C2 Os1 P1 96.26(15) . . ?
C2 Os1 C10 171.01(18) . . ?
C2 Os1 H 87.7(17) . . ?
C10 Os1 Os2 86.80(11) . . ?
C10 Os1 Os3 56.06(11) . . ?
C10 Os1 P1 86.94(11) . . ?
C10 Os1 H 88.8(17) . . ?
Os3 Os2 Os1 58.935(7) . . ?
P2 Os2 Os1 77.51(3) . . ?
P2 Os2 Os3 85.60(3) . . ?
C3 Os2 Os1 154.89(16) . . ?
C3 Os2 Os3 97.07(16) . . ?
C3 Os2 P2 94.53(17) . . ?
C4 Os2 Os1 100.33(15) . . ?
C4 Os2 Os3 159.26(15) . . ?
C4 Os2 P2 90.48(16) . . ?
C4 Os2 C3 103.5(2) . . ?
C4 Os2 C5 92.4(2) . . ?
C5 Os2 Os1 89.64(15) . . ?
C5 Os2 Os3 87.26(15) . . ?
C5 Os2 P2 167.13(16) . . ?
C5 Os2 C3 97.0(2) . . ?
Os1 Os3 Os2 60.799(6) . . ?
Os1 Os3 H 37.6(16) . . ?
Os2 Os3 H 83.5(15) . . ?
Sb1 Os3 Os1 109.604(9) . . ?
Sb1 Os3 Os2 169.035(10) . . ?
Sb1 Os3 H 85.6(16) . . ?
C6 Os3 Os1 139.65(15) . . ?
C6 Os3 Os2 94.36(15) . . ?
C6 Os3 Sb1 96.59(15) . . ?
C6 Os3 C10 99.19(19) . . ?
C6 Os3 H 177.2(16) . . ?
C7 Os3 Os1 120.42(16) . . ?
C7 Os3 Os2 88.00(15) . . ?
C7 Os3 Sb1 93.22(15) . . ?
C7 Os3 C6 86.9(2) . . ?
C7 Os3 C10 170.33(18) . . ?
C7 Os3 H 94.8(16) . . ?
C10 Os3 Os1 50.52(10) . . ?
C10 Os3 Os2 84.06(10) . . ?
C10 Os3 Sb1 93.54(10) . . ?
C10 Os3 H 78.9(16) . . ?
C33 Sb1 Os3 126.10(12) . . ?
C33 Sb1 C45 98.99(18) . . ?
C39 Sb1 Os3 114.72(13) . . ?
C39 Sb1 C33 99.55(18) . . ?
C39 Sb1 C45 98.13(18) . . ?
C45 Sb1 Os3 114.73(13) . . ?
C8 P1 Os1 110.49(15) . . ?
C21 P1 Os1 119.18(17) . . ?
C21 P1 C8 104.8(2) . . ?
C21 P1 C27 101.3(2) . . ?
C27 P1 Os1 115.60(15) . . ?
C27 P1 C8 103.9(2) . . ?
C8 P2 Os2 110.61(16) . . ?
C9 P2 Os2 112.56(15) . . ?
C9 P2 C8 100.6(2) . . ?
C9 P2 C15 108.2(2) . . ?
C15 P2 Os2 118.61(16) . . ?
C15 P2 C8 104.5(2) . . ?
O1 C1 Os1 176.4(4) . . ?
O2 C2 Os1 178.4(5) . . ?
O3 C3 Os2 179.2(5) . . ?
O4 C4 Os2 179.3(5) . . ?
O5 C5 Os2 178.1(5) . . ?
O6 C6 Os3 178.2(5) . . ?
O7 C7 Os3 178.8(5) . . ?
P1 C8 H8A 110.2 . . ?
P1 C8 H8B 110.2 . . ?
P2 C8 P1 107.6(2) . . ?
P2 C8 H8A 110.2 . . ?
P2 C8 H8B 110.2 . . ?
H8A C8 H8B 108.5 . . ?
C10 C9 P2 112.5(3) . . ?
C14 C9 P2 124.7(4) . . ?
C14 C9 C10 122.3(4) . . ?
Os1 C10 Os3 73.42(13) . . ?
C9 C10 Os1 120.0(3) . . ?
C9 C10 Os3 103.3(3) . . ?
C9 C10 C11 115.4(4) . . ?
C11 C10 Os1 121.4(3) . . ?
C11 C10 Os3 111.0(3) . . ?
C10 C11 H11 119.0 . . ?
C12 C11 C10 122.0(4) . . ?
C12 C11 H11 119.0 . . ?
C11 C12 H12 119.7 . . ?
C11 C12 C13 120.6(4) . . ?
C13 C12 H12 119.7 . . ?
C12 C13 H13 120.3 . . ?
C14 C13 C12 119.5(5) . . ?
C14 C13 H13 120.3 . . ?
C9 C14 H14 119.9 . . ?
C13 C14 C9 120.1(5) . . ?
C13 C14 H14 119.9 . . ?
C16 C15 P2 120.2(4) . . ?
C20 C15 P2 121.1(4) . . ?
C20 C15 C16 118.1(5) . . ?
C15 C16 H16 119.7 . . ?
C15 C16 C17 120.7(6) . . ?
C17 C16 H16 119.7 . . ?
C16 C17 H17 120.1 . . ?
C18 C17 C16 119.8(6) . . ?
C18 C17 H17 120.1 . . ?
C17 C18 H18 119.9 . . ?
C17 C18 C19 120.3(6) . . ?
C19 C18 H18 119.9 . . ?
C18 C19 H19 120.1 . . ?
C18 C19 C20 119.8(6) . . ?
C20 C19 H19 120.1 . . ?
C15 C20 C19 121.3(5) . . ?
C15 C20 H20 119.3 . . ?
C19 C20 H20 119.3 . . ?
C22 C21 P1 119.3(4) . . ?
C26 C21 P1 122.1(4) . . ?
C26 C21 C22 118.6(5) . . ?
C21 C22 H22 119.5 . . ?
C21 C22 C23 120.9(5) . . ?
C23 C22 H22 119.5 . . ?
C22 C23 H23 120.2 . . ?
C24 C23 C22 119.7(6) . . ?
C24 C23 H23 120.2 . . ?
C23 C24 H24 119.9 . . ?
C23 C24 C25 120.1(5) . . ?
C25 C24 H24 119.9 . . ?
C24 C25 H25 120.0 . . ?
C24 C25 C26 119.9(6) . . ?
C26 C25 H25 120.0 . . ?
C21 C26 C25 120.8(6) . . ?
C21 C26 H26 119.6 . . ?
C25 C26 H26 119.6 . . ?
C28 C27 P1 120.5(4) . . ?
C32 C27 P1 120.8(4) . . ?
C32 C27 C28 118.6(5) . . ?
C27 C28 H28 119.8 . . ?
C29 C28 C27 120.4(5) . . ?
C29 C28 H28 119.8 . . ?
C28 C29 H29 119.7 . . ?
C30 C29 C28 120.5(6) . . ?
C30 C29 H29 119.7 . . ?
C29 C30 H30 120.0 . . ?
C31 C30 C29 119.9(5) . . ?
C31 C30 H30 120.0 . . ?
C30 C31 H31 119.9 . . ?
C30 C31 C32 120.2(5) . . ?
C32 C31 H31 119.9 . . ?
C27 C32 C31 120.2(5) . . ?
C27 C32 H32 119.9 . . ?
C31 C32 H32 119.9 . . ?
C34 C33 Sb1 121.2(4) . . ?
C38 C33 Sb1 120.2(4) . . ?
C38 C33 C34 118.6(5) . . ?
C33 C34 H34 120.0 . . ?
C35 C34 C33 120.0(5) . . ?
C35 C34 H34 120.0 . . ?
C34 C35 H35 119.7 . . ?
C36 C35 C34 120.5(6) . . ?
C36 C35 H35 119.7 . . ?
C35 C36 H36 119.9 . . ?
C35 C36 C37 120.2(5) . . ?
C37 C36 H36 119.9 . . ?
C36 C37 H37 120.2 . . ?
C36 C37 C38 119.6(5) . . ?
C38 C37 H37 120.2 . . ?
C33 C38 C37 120.9(5) . . ?
C33 C38 H38 119.5 . . ?
C37 C38 H38 119.5 . . ?
C40 C39 Sb1 120.5(3) . . ?
C40 C39 C44 119.6(4) . . ?
C44 C39 Sb1 119.9(3) . . ?
C39 C40 H40 120.0 . . ?
C39 C40 C41 120.0(4) . . ?
C41 C40 H40 120.0 . . ?
C40 C41 H41 119.9 . . ?
C42 C41 C40 120.2(5) . . ?
C42 C41 H41 119.9 . . ?
C41 C42 H42 120.1 . . ?
C43 C42 C41 119.8(5) . . ?
C43 C42 H42 120.1 . . ?
C42 C43 H43 119.7 . . ?
C42 C43 C44 120.6(5) . . ?
C44 C43 H43 119.7 . . ?
C39 C44 H44 120.1 . . ?
C43 C44 C39 119.8(5) . . ?
C43 C44 H44 120.1 . . ?
C46 C45 Sb1 118.3(4) . . ?
C46 C45 C50 118.7(5) . . ?
C50 C45 Sb1 123.0(4) . . ?
C45 C46 H46 119.7 . . ?
C45 C46 C47 120.5(5) . . ?
C47 C46 H46 119.7 . . ?
C46 C47 H47 120.0 . . ?
C48 C47 C46 120.0(5) . . ?
C48 C47 H47 120.0 . . ?
C47 C48 H48 119.9 . . ?
C47 C48 C49 120.2(5) . . ?
C49 C48 H48 119.9 . . ?
C48 C49 H49 120.0 . . ?
C48 C49 C50 120.1(5) . . ?
C50 C49 H49 120.0 . . ?
C45 C50 H50 119.8 . . ?
C49 C50 C45 120.5(5) . . ?
C49 C50 H50 119.8 . . ?
H51A C51 H51B 107.7 . . ?
Cl1 C51 H51A 108.9 . . ?
Cl1 C51 H51B 108.9 . . ?
Cl2 C51 H51A 108.9 . . ?
Cl2 C51 H51B 108.9 . . ?
Cl2 C51 Cl1 113.5(6) . . ?

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_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
Os1 P1 C8 P2 -3.7(3) . . . . ?
Os1 P1 C21 C22 36.3(5) . . . . ?
Os1 P1 C21 C26 -146.4(4) . . . . ?
Os1 P1 C27 C28 77.9(4) . . . . ?
Os1 P1 C27 C32 -100.4(4) . . . . ?
Os1 C10 C11 C12 -161.2(4) . . . . ?
Os2 P2 C8 P1 52.6(2) . . . . ?
Os2 P2 C9 C10 -35.5(3) . . . . ?
Os2 P2 C9 C14 152.9(4) . . . . ?
Os2 P2 C15 C16 87.8(5) . . . . ?
Os2 P2 C15 C20 -83.8(5) . . . . ?
Os3 C10 C11 C12 115.9(4) . . . . ?
Sb1 C33 C34 C35 -176.9(4) . . . . ?
Sb1 C33 C38 C37 177.0(4) . . . . ?
Sb1 C39 C40 C41 -176.6(4) . . . . ?
Sb1 C39 C44 C43 177.6(4) . . . . ?
Sb1 C45 C46 C47 179.5(4) . . . . ?
Sb1 C45 C50 C49 -179.9(4) . . . . ?
P1 C21 C22 C23 177.4(5) . . . . ?
P1 C21 C26 C25 -178.6(5) . . . . ?
P1 C27 C28 C29 -179.7(4) . . . . ?
P1 C27 C32 C31 179.5(4) . . . . ?
P2 C9 C10 Os1 -10.8(4) . . . . ?
P2 C9 C10 Os3 67.5(3) . . . . ?
P2 C9 C10 C11 -171.0(3) . . . . ?
P2 C9 C14 C13 171.2(4) . . . . ?
P2 C15 C16 C17 -172.7(5) . . . . ?
P2 C15 C20 C19 174.0(5) . . . . ?
C8 P1 C21 C22 160.5(4) . . . . ?
C8 P1 C21 C26 -22.2(5) . . . . ?
C8 P1 C27 C28 -43.3(4) . . . . ?
C8 P1 C27 C32 138.4(4) . . . . ?
C8 P2 C9 C10 82.3(3) . . . . ?
C8 P2 C9 C14 -89.4(4) . . . . ?
C8 P2 C15 C16 -35.9(5) . . . . ?
C8 P2 C15 C20 152.5(4) . . . . ?
C9 P2 C8 P1 -66.6(3) . . . . ?
C9 P2 C15 C16 -142.4(5) . . . . ?
C9 P2 C15 C20 46.0(5) . . . . ?
C9 C10 C11 C12 -1.3(6) . . . . ?
C10 C9 C14 C13 0.3(7) . . . . ?
C10 C11 C12 C13 0.6(7) . . . . ?
C11 C12 C13 C14 0.6(7) . . . . ?
C12 C13 C14 C9 -1.1(7) . . . . ?
C14 C9 C10 Os1 161.0(3) . . . . ?
C14 C9 C10 Os3 -120.6(4) . . . . ?
C14 C9 C10 C11 0.8(6) . . . . ?
C15 P2 C8 P1 -178.7(2) . . . . ?
C15 P2 C9 C10 -168.5(3) . . . . ?
C15 P2 C9 C14 19.8(5) . . . . ?
C15 C16 C17 C18 -0.8(11) . . . . ?
C16 C15 C20 C19 2.3(9) . . . . ?
C16 C17 C18 C19 1.2(12) . . . . ?
C17 C18 C19 C20 0.2(11) . . . . ?
C18 C19 C20 C15 -2.0(10) . . . . ?
C20 C15 C16 C17 -0.9(9) . . . . ?
C21 P1 C8 P2 -133.2(2) . . . . ?
C21 P1 C27 C28 -151.8(4) . . . . ?
C21 P1 C27 C32 29.9(4) . . . . ?
C21 C22 C23 C24 1.7(10) . . . . ?
C22 C21 C26 C25 -1.3(9) . . . . ?
C22 C23 C24 C25 -2.2(11) . . . . ?
C23 C24 C25 C26 0.9(11) . . . . ?
C24 C25 C26 C21 0.8(10) . . . . ?
C26 C21 C22 C23 0.0(9) . . . . ?
C27 P1 C8 P2 120.9(2) . . . . ?
C27 P1 C21 C22 -91.7(5) . . . . ?
C27 P1 C21 C26 85.5(5) . . . . ?
C27 C28 C29 C30 0.7(9) . . . . ?
C28 C27 C32 C31 1.2(8) . . . . ?
C28 C29 C30 C31 0.2(9) . . . . ?
C29 C30 C31 C32 -0.4(9) . . . . ?
C30 C31 C32 C27 -0.4(9) . . . . ?
C32 C27 C28 C29 -1.4(7) . . . . ?
C33 C34 C35 C36 -0.1(9) . . . . ?
C34 C33 C38 C37 -1.5(8) . . . . ?
C34 C35 C36 C37 -1.5(10) . . . . ?
C35 C36 C37 C38 1.5(9) . . . . ?
C36 C37 C38 C33 0.0(8) . . . . ?
C38 C33 C34 C35 1.6(8) . . . . ?
C39 C40 C41 C42 -0.9(8) . . . . ?
C40 C39 C44 C43 -0.7(7) . . . . ?
C40 C41 C42 C43 -0.9(8) . . . . ?
C41 C42 C43 C44 1.9(8) . . . . ?
C42 C43 C44 C39 -1.1(8) . . . . ?
C44 C39 C40 C41 1.7(7) . . . . ?
C45 C46 C47 C48 0.7(8) . . . . ?
C46 C45 C50 C49 0.2(8) . . . . ?
C46 C47 C48 C49 -0.4(9) . . . . ?
C47 C48 C49 C50 0.0(9) . . . . ?
C48 C49 C50 C45 0.1(8) . . . . ?
C50 C45 C46 C47 -0.6(8) . . . . ?

_olex2_submission_special_instructions 'No special instructions were received'
####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_fi_2c_a
_database_code_depnum_ccdc_archive 'CCDC 2152367'
loop_
_audit_author_name
_audit_author_address
'Shishir Ghosh'
;Jahangirnagar University
Bangladesh
;
_audit_update_record             
;
2022-02-16 deposited with the CCDC.	2022-12-19 downloaded from the CCDC.
;
_audit_creation_date             2021-09-28
_audit_creation_method           
;
Olex2 1.3
(compiled 2020.11.12 svn.r5f609507 for OlexSys, GUI svn.r6403)
;
_shelx_SHELXL_version_number     2014/7
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C69 H52 O8 Os3 P2 Sb2'
_chemical_formula_sum            'C69 H52 O8 Os3 P2 Sb2'
_chemical_formula_weight         1885.14
_chemical_melting_point          ?
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'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Os Os -1.2165 7.6030 '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'
Sb Sb -0.5866 1.5461 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   11.9842(5)
_cell_length_b                   12.2615(4)
_cell_length_c                   22.7266(9)
_cell_angle_alpha                101.908(2)
_cell_angle_beta                 98.475(2)
_cell_angle_gamma                94.176(2)
_cell_volume                     3213.6(2)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    9803
_cell_measurement_temperature    193(1)
_cell_measurement_theta_max      28.29
_cell_measurement_theta_min      2.44
_shelx_estimated_absorpt_T_max   0.781
_shelx_estimated_absorpt_T_min   0.308
_exptl_absorpt_coefficient_mu    6.843
_exptl_absorpt_correction_T_max  0.7457
_exptl_absorpt_correction_T_min  0.4989
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
SADABS-2014/5 (Bruker,2014/5) was used for absorption correction.
wR2(int) was 0.1020 before and 0.0517 after correction.
The Ratio of minimum to maximum transmission is 0.6690.
The λ/2 correction factor is Not present.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            orange
_exptl_crystal_colour_primary    orange
_exptl_crystal_density_diffrn    1.948
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       plate
_exptl_crystal_F_000             1780
_exptl_crystal_size_max          0.225
_exptl_crystal_size_mid          0.108
_exptl_crystal_size_min          0.038
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0447
_diffrn_reflns_av_unetI/netI     0.0425
_diffrn_reflns_Laue_measured_fraction_full 0.997
_diffrn_reflns_Laue_measured_fraction_max 0.993
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       30
_diffrn_reflns_limit_l_min       -30
_diffrn_reflns_number            74004
_diffrn_reflns_point_group_measured_fraction_full 0.997
_diffrn_reflns_point_group_measured_fraction_max 0.993
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         28.346
_diffrn_reflns_theta_min         2.229
_diffrn_ambient_temperature      193(1)
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.993
_diffrn_measurement_device_type  'Bruker D8 Venture'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   ?
_diffrn_source_current           1.0
_diffrn_source_power             0.05
_diffrn_source_voltage           50.0
_diffrn_standards_number         0
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                12641
_reflns_number_total             15929
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 Structure factors included contributions from the .fab file.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       ?
_computing_data_collection       ?
_computing_data_reduction        ?
_computing_molecular_graphics    'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_structure_refinement  'XL  (Sheldrick, 2008)'
_computing_structure_solution    'SHELXT 2014/5 (Sheldrick, 2014)'
_refine_diff_density_max         1.135
_refine_diff_density_min         -0.902
_refine_diff_density_rms         0.165
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.026
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     757
_refine_ls_number_reflns         15929
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0482
_refine_ls_R_factor_gt           0.0298
_refine_ls_restrained_S_all      1.026
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0248P)²+6.6432P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0589
_refine_ls_wR_factor_ref         0.0642
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
2.a Secondary CH2 refined with riding coordinates:
 C15(H15A,H15B)
2.b Aromatic/amide H refined with riding coordinates:
 C10(H10), C11(H11), C12(H12), C13(H13), C014(H014), C14(H14), C17(H17),
 C18(H18), C19(H19), C20(H20), C21(H21), C23(H23), C24(H24), C25(H25), C26(H26),
  C27(H27), C29(H29), C30(H30), C31(H31), C32(H32), C34(H34), C35(H35),
 C36(H36), C37(H37), C38(H38), C40(H40), C41(H41), C42(H42), C43(H43), C44(H44),
  C46(H46), C47(H47), C48(H48), C49(H49), C50(H50), C52(H52), C53(H53),
 C54(H54), C55(H55), C56(H56), C58(H58), C59(H59), C60(H60), C61(H61), C62(H62),
  C64(H64), C65(H65), C66(H66), C67(H67), C68(H68)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     dual
_atom_sites_solution_secondary   ?
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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Os1 Os 0.31541(2) 0.33170(2) 0.20358(2) 0.01823(4) Uani 1 1 d . . . . .
Os2 Os 0.56046(2) 0.36956(2) 0.26532(2) 0.01809(4) Uani 1 1 d . . . . .
Os3 Os 0.54654(2) 0.14823(2) 0.30228(2) 0.01832(4) Uani 1 1 d . . . . .
Sb1 Sb 0.36939(3) 0.12981(2) 0.21327(2) 0.01869(7) Uani 1 1 d . . . . .
Sb2 Sb 0.70784(3) 0.20932(2) 0.39923(2) 0.02051(7) Uani 1 1 d . . . . .
P1 P 0.29622(10) 0.52116(9) 0.21402(5) 0.0202(2) Uani 1 1 d . . . . .
P2 P 0.56030(10) 0.54257(9) 0.24004(5) 0.0195(2) Uani 1 1 d . . . . .
C1 C 0.2673(4) 0.3331(4) 0.2809(2) 0.0268(11) Uani 1 1 d . . . . .
C2 C 0.3577(4) 0.3211(4) 0.1247(2) 0.0262(10) Uani 1 1 d . . . . .
C3 C 0.4991(4) 0.4298(4) 0.3371(2) 0.0235(10) Uani 1 1 d . . . . .
C4 C 0.7177(4) 0.3885(4) 0.2955(2) 0.0240(10) Uani 1 1 d . . . . .
C5 C 0.5781(4) 0.2920(4) 0.1840(2) 0.0259(10) Uani 1 1 d . . . . .
C6 C 0.4475(4) 0.2024(3) 0.3593(2) 0.0232(10) Uani 1 1 d . . . . .
C7 C 0.5293(4) -0.0037(4) 0.3078(2) 0.0250(10) Uani 1 1 d . . . . .
C8 C 0.6546(4) 0.1224(4) 0.2460(2) 0.0252(10) Uani 1 1 d . . . . .
O1 O 0.2343(3) 0.3319(3) 0.32568(16) 0.0376(9) Uani 1 1 d . . . . .
O2 O 0.3788(3) 0.3129(3) 0.07647(16) 0.0371(9) Uani 1 1 d . . . . .
O3 O 0.4641(3) 0.4721(3) 0.37973(15) 0.0325(8) Uani 1 1 d . . . . .
O4 O 0.8141(3) 0.3999(3) 0.30992(16) 0.0351(8) Uani 1 1 d . . . . .
O5 O 0.5937(3) 0.2474(3) 0.13711(15) 0.0352(8) Uani 1 1 d . . . . .
O6 O 0.3922(3) 0.2300(3) 0.39523(16) 0.0343(8) Uani 1 1 d . . . . .
O7 O 0.5174(3) -0.0960(3) 0.30956(18) 0.0403(9) Uani 1 1 d . . . . .
O8 O 0.7192(3) 0.1055(3) 0.21456(17) 0.0407(9) Uani 1 1 d . . . . .
C9 C 0.1415(4) 0.2829(4) 0.1623(2) 0.0254(10) Uani 1 1 d . . . . .
C10 C 0.0506(4) 0.3054(4) 0.1944(3) 0.0343(12) Uani 1 1 d . . . . .
H10 H 0.0673 0.3457 0.2357 0.041 Uiso 1 1 calc R U . . .
C11 C -0.0618(5) 0.2714(5) 0.1685(3) 0.0474(15) Uani 1 1 d . . . . .
H11 H -0.1197 0.2881 0.1923 0.057 Uiso 1 1 calc R U . . .
C12 C -0.0904(5) 0.2145(5) 0.1094(3) 0.0523(17) Uani 1 1 d . . . . .
H12 H -0.1675 0.1903 0.0920 0.063 Uiso 1 1 calc R U . . .
C13 C -0.0054(5) 0.1927(5) 0.0752(3) 0.0432(14) Uani 1 1 d . . . . .
H13 H -0.0242 0.1544 0.0336 0.052 Uiso 1 1 calc R U . . .
C014 C 0.7012(4) 0.6591(4) 0.3485(2) 0.0317(12) Uani 1 1 d . . . . .
H014 H 0.6750 0.6001 0.3660 0.038 Uiso 1 1 calc R U . . .
C14 C 0.1073(5) 0.2260(4) 0.1009(2) 0.0334(12) Uani 1 1 d . . . . .
H14 H 0.1640 0.2097 0.0762 0.040 Uiso 1 1 calc R U . . .
C15 C 0.4300(4) 0.6105(4) 0.2486(2) 0.0211(9) Uani 1 1 d . . . . .
H15A H 0.4329 0.6769 0.2302 0.025 Uiso 1 1 calc R U . . .
H15B H 0.4290 0.6376 0.2927 0.025 Uiso 1 1 calc R U . . .
C16 C 0.1960(4) 0.5719(4) 0.2646(2) 0.0253(10) Uani 1 1 d . . . . .
C17 C 0.2233(4) 0.5845(4) 0.3272(2) 0.0313(11) Uani 1 1 d . . . . .
H17 H 0.2989 0.5787 0.3450 0.038 Uiso 1 1 calc R U . . .
C18 C 0.1411(5) 0.6057(5) 0.3643(3) 0.0419(14) Uani 1 1 d . . . . .
H18 H 0.1606 0.6124 0.4070 0.050 Uiso 1 1 calc R U . . .
C19 C 0.0324(5) 0.6168(5) 0.3395(3) 0.0434(14) Uani 1 1 d . . . . .
H19 H -0.0233 0.6320 0.3650 0.052 Uiso 1 1 calc R U . . .
C20 C 0.0044(5) 0.6060(4) 0.2776(3) 0.0400(14) Uani 1 1 d . . . . .
H20 H -0.0709 0.6138 0.2603 0.048 Uiso 1 1 calc R U . . .
C21 C 0.0855(4) 0.5836(4) 0.2401(2) 0.0297(11) Uani 1 1 d . . . . .
H21 H 0.0652 0.5764 0.1974 0.036 Uiso 1 1 calc R U . . .
C22 C 0.2452(4) 0.5775(4) 0.1479(2) 0.0221(10) Uani 1 1 d . . . . .
C23 C 0.1894(4) 0.5066(4) 0.0941(2) 0.0285(11) Uani 1 1 d . . . . .
H23 H 0.1798 0.4279 0.0912 0.034 Uiso 1 1 calc R U . . .
C24 C 0.1480(5) 0.5505(5) 0.0447(2) 0.0363(12) Uani 1 1 d . . . . .
H24 H 0.1100 0.5014 0.0081 0.044 Uiso 1 1 calc R U . . .
C25 C 0.1609(5) 0.6642(5) 0.0478(3) 0.0395(13) Uani 1 1 d . . . . .
H25 H 0.1332 0.6935 0.0136 0.047 Uiso 1 1 calc R U . . .
C26 C 0.2146(5) 0.7344(4) 0.1012(3) 0.0384(13) Uani 1 1 d . . . . .
H26 H 0.2244 0.8129 0.1038 0.046 Uiso 1 1 calc R U . . .
C27 C 0.2540(4) 0.6926(4) 0.1505(2) 0.0311(11) Uani 1 1 d . . . . .
H27 H 0.2882 0.7429 0.1875 0.037 Uiso 1 1 calc R U . . .
C28 C 0.6645(4) 0.6559(4) 0.2881(2) 0.0229(10) Uani 1 1 d . . . . .
C29 C 0.7029(4) 0.7435(4) 0.2629(2) 0.0308(11) Uani 1 1 d . . . . .
H29 H 0.6773 0.7429 0.2213 0.037 Uiso 1 1 calc R U . . .
C30 C 0.7786(5) 0.8316(4) 0.2990(3) 0.0382(13) Uani 1 1 d . . . . .
H30 H 0.8048 0.8913 0.2820 0.046 Uiso 1 1 calc R U . . .
C31 C 0.8152(5) 0.8323(4) 0.3591(3) 0.0421(15) Uani 1 1 d . . . . .
H31 H 0.8679 0.8920 0.3834 0.050 Uiso 1 1 calc R U . . .
C32 C 0.7763(5) 0.7476(4) 0.3845(3) 0.0399(14) Uani 1 1 d . . . . .
H32 H 0.8006 0.7494 0.4264 0.048 Uiso 1 1 calc R U . . .
C33 C 0.5924(4) 0.5441(4) 0.1646(2) 0.0245(10) Uani 1 1 d . . . . .
C34 C 0.5272(4) 0.5882(4) 0.1220(2) 0.0302(11) Uani 1 1 d . . . . .
H34 H 0.4599 0.6197 0.1311 0.036 Uiso 1 1 calc R U . . .
C35 C 0.5600(5) 0.5866(4) 0.0656(2) 0.0389(13) Uani 1 1 d . . . . .
H35 H 0.5149 0.6174 0.0364 0.047 Uiso 1 1 calc R U . . .
C36 C 0.6564(6) 0.5410(5) 0.0517(3) 0.0516(17) Uani 1 1 d . . . . .
H36 H 0.6774 0.5390 0.0128 0.062 Uiso 1 1 calc R U . . .
C37 C 0.7228(5) 0.4982(5) 0.0945(3) 0.0488(16) Uani 1 1 d . . . . .
H37 H 0.7903 0.4674 0.0852 0.059 Uiso 1 1 calc R U . . .
C38 C 0.6918(4) 0.4998(4) 0.1508(2) 0.0332(12) Uani 1 1 d . . . . .
H38 H 0.7382 0.4707 0.1803 0.040 Uiso 1 1 calc R U . . .
C39 C 0.2311(4) 0.0234(4) 0.2296(2) 0.0242(10) Uani 1 1 d . . . . .
C40 C 0.2419(4) -0.0435(4) 0.2716(2) 0.0299(11) Uani 1 1 d . . . . .
H40 H 0.3129 -0.0405 0.2970 0.036 Uiso 1 1 calc R U . . .
C41 C 0.1506(5) -0.1156(4) 0.2775(3) 0.0398(13) Uani 1 1 d . . . . .
H41 H 0.1599 -0.1628 0.3057 0.048 Uiso 1 1 calc R U . . .
C42 C 0.0487(5) -0.1173(5) 0.2424(3) 0.0514(17) Uani 1 1 d . . . . .
H42 H -0.0136 -0.1668 0.2457 0.062 Uiso 1 1 calc R U . . .
C43 C 0.0345(5) -0.0487(6) 0.2021(4) 0.061(2) Uani 1 1 d . . . . .
H43 H -0.0382 -0.0486 0.1789 0.073 Uiso 1 1 calc R U . . .
C44 C 0.1256(5) 0.0207(5) 0.1949(3) 0.0457(15) Uani 1 1 d . . . . .
H44 H 0.1156 0.0666 0.1660 0.055 Uiso 1 1 calc R U . . .
C45 C 0.4023(4) 0.0184(4) 0.1328(2) 0.0265(11) Uani 1 1 d . . . . .
C46 C 0.4791(5) -0.0589(4) 0.1370(3) 0.0386(13) Uani 1 1 d . . . . .
H46 H 0.5199 -0.0615 0.1758 0.046 Uiso 1 1 calc R U . . .
C47 C 0.4975(6) -0.1330(5) 0.0853(3) 0.0556(18) Uani 1 1 d . . . . .
H47 H 0.5504 -0.1863 0.0888 0.067 Uiso 1 1 calc R U . . .
C48 C 0.4397(7) -0.1298(5) 0.0291(3) 0.060(2) Uani 1 1 d . . . . .
H48 H 0.4531 -0.1798 -0.0065 0.072 Uiso 1 1 calc R U . . .
C49 C 0.3624(7) -0.0538(5) 0.0247(3) 0.0585(19) Uani 1 1 d . . . . .
H49 H 0.3214 -0.0520 -0.0141 0.070 Uiso 1 1 calc R U . . .
C50 C 0.3429(5) 0.0209(4) 0.0764(2) 0.0412(14) Uani 1 1 d . . . . .
H50 H 0.2890 0.0733 0.0728 0.049 Uiso 1 1 calc R U . . .
C51 C 0.6717(4) 0.1307(4) 0.4708(2) 0.0241(10) Uani 1 1 d . . . . .
C52 C 0.6584(5) 0.1885(4) 0.5269(2) 0.0347(12) Uani 1 1 d . . . . .
H52 H 0.6626 0.2680 0.5349 0.042 Uiso 1 1 calc R U . . .
C53 C 0.6389(5) 0.1332(5) 0.5725(3) 0.0441(15) Uani 1 1 d . . . . .
H53 H 0.6304 0.1744 0.6115 0.053 Uiso 1 1 calc R U . . .
C54 C 0.6319(5) 0.0182(5) 0.5605(2) 0.0370(13) Uani 1 1 d . . . . .
H54 H 0.6189 -0.0203 0.5915 0.044 Uiso 1 1 calc R U . . .
C55 C 0.6437(4) -0.0410(4) 0.5042(2) 0.0336(12) Uani 1 1 d . . . . .
H55 H 0.6390 -0.1205 0.4962 0.040 Uiso 1 1 calc R U . . .
C56 C 0.6626(4) 0.0149(4) 0.4590(2) 0.0321(12) Uani 1 1 d . . . . .
H56 H 0.6694 -0.0264 0.4196 0.039 Uiso 1 1 calc R U . . .
C57 C 0.8764(4) 0.1662(4) 0.3973(2) 0.0234(10) Uani 1 1 d . . . . .
C58 C 0.9355(4) 0.1368(4) 0.4484(2) 0.0334(12) Uani 1 1 d . . . . .
H58 H 0.9010 0.1366 0.4834 0.040 Uiso 1 1 calc R U . . .
C59 C 1.0449(5) 0.1078(4) 0.4475(3) 0.0400(14) Uani 1 1 d . . . . .
H59 H 1.0857 0.0873 0.4820 0.048 Uiso 1 1 calc R U . . .
C60 C 1.0946(5) 0.1088(4) 0.3971(3) 0.0436(15) Uani 1 1 d . . . . .
H60 H 1.1696 0.0885 0.3968 0.052 Uiso 1 1 calc R U . . .
C61 C 1.0376(5) 0.1385(5) 0.3472(3) 0.0444(15) Uani 1 1 d . . . . .
H61 H 1.0731 0.1387 0.3126 0.053 Uiso 1 1 calc R U . . .
C62 C 0.9279(4) 0.1683(4) 0.3468(2) 0.0346(12) Uani 1 1 d . . . . .
H62 H 0.8887 0.1899 0.3123 0.042 Uiso 1 1 calc R U . . .
C63 C 0.7396(4) 0.3794(4) 0.4473(2) 0.0223(10) Uani 1 1 d . . . . .
C64 C 0.6571(4) 0.4303(4) 0.4763(2) 0.0311(11) Uani 1 1 d . . . . .
H64 H 0.5850 0.3898 0.4733 0.037 Uiso 1 1 calc R U . . .
C65 C 0.6791(5) 0.5403(4) 0.5098(2) 0.0354(12) Uani 1 1 d . . . . .
H65 H 0.6225 0.5744 0.5302 0.042 Uiso 1 1 calc R U . . .
C66 C 0.7826(5) 0.5999(4) 0.5136(2) 0.0405(14) Uani 1 1 d . . . . .
H66 H 0.7978 0.6748 0.5367 0.049 Uiso 1 1 calc R U . . .
C67 C 0.8642(5) 0.5505(4) 0.4837(2) 0.0382(13) Uani 1 1 d . . . . .
H67 H 0.9352 0.5920 0.4854 0.046 Uiso 1 1 calc R U . . .
C68 C 0.8430(4) 0.4403(4) 0.4510(2) 0.0294(11) Uani 1 1 d . . . . .
H68 H 0.9001 0.4064 0.4310 0.035 Uiso 1 1 calc R U . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Os1 Os2 3.0211(3) . ?
Os1 Sb1 2.6479(3) . ?
Os1 P1 2.3177(11) . ?
Os1 C1 1.926(5) . ?
Os1 C2 1.916(5) . ?
Os1 C9 2.143(5) . ?
Os2 Os3 3.0024(3) . ?
Os2 P2 2.3096(12) . ?
Os2 C3 1.919(5) . ?
Os2 C4 1.888(5) . ?
Os2 C5 1.945(5) . ?
Os3 Sb1 2.6695(4) . ?
Os3 Sb2 2.6468(4) . ?
Os3 C6 1.935(5) . ?
Os3 C7 1.891(5) . ?
Os3 C8 1.947(5) . ?
Sb1 C39 2.157(5) . ?
Sb1 C45 2.150(4) . ?
Sb2 C51 2.135(5) . ?
Sb2 C57 2.129(4) . ?
Sb2 C63 2.123(4) . ?
P1 C15 1.846(4) . ?
P1 C16 1.836(5) . ?
P1 C22 1.825(5) . ?
P2 C15 1.839(4) . ?
P2 C28 1.845(5) . ?
P2 C33 1.816(5) . ?
C1 O1 1.146(6) . ?
C2 O2 1.147(6) . ?
C3 O3 1.153(5) . ?
C4 O4 1.144(5) . ?
C5 O5 1.141(5) . ?
C6 O6 1.139(5) . ?
C7 O7 1.140(5) . ?
C8 O8 1.131(5) . ?
C9 C10 1.411(7) . ?
C9 C14 1.410(7) . ?
C10 H10 0.9500 . ?
C10 C11 1.385(7) . ?
C11 H11 0.9500 . ?
C11 C12 1.361(9) . ?
C12 H12 0.9500 . ?
C12 C13 1.379(9) . ?
C13 H13 0.9500 . ?
C13 C14 1.386(7) . ?
C014 H014 0.9500 . ?
C014 C28 1.369(7) . ?
C014 C32 1.389(7) . ?
C14 H14 0.9500 . ?
C15 H15A 0.9900 . ?
C15 H15B 0.9900 . ?
C16 C17 1.386(7) . ?
C16 C21 1.388(7) . ?
C17 H17 0.9500 . ?
C17 C18 1.392(7) . ?
C18 H18 0.9500 . ?
C18 C19 1.369(8) . ?
C19 H19 0.9500 . ?
C19 C20 1.373(8) . ?
C20 H20 0.9500 . ?
C20 C21 1.390(7) . ?
C21 H21 0.9500 . ?
C22 C23 1.391(7) . ?
C22 C27 1.396(6) . ?
C23 H23 0.9500 . ?
C23 C24 1.386(7) . ?
C24 H24 0.9500 . ?
C24 C25 1.377(7) . ?
C25 H25 0.9500 . ?
C25 C26 1.373(8) . ?
C26 H26 0.9500 . ?
C26 C27 1.362(7) . ?
C27 H27 0.9500 . ?
C28 C29 1.397(7) . ?
C29 H29 0.9500 . ?
C29 C30 1.391(7) . ?
C30 H30 0.9500 . ?
C30 C31 1.368(8) . ?
C31 H31 0.9500 . ?
C31 C32 1.374(8) . ?
C32 H32 0.9500 . ?
C33 C34 1.376(7) . ?
C33 C38 1.394(7) . ?
C34 H34 0.9500 . ?
C34 C35 1.392(7) . ?
C35 H35 0.9500 . ?
C35 C36 1.370(8) . ?
C36 H36 0.9500 . ?
C36 C37 1.377(8) . ?
C37 H37 0.9500 . ?
C37 C38 1.382(7) . ?
C38 H38 0.9500 . ?
C39 C40 1.379(7) . ?
C39 C44 1.382(7) . ?
C40 H40 0.9500 . ?
C40 C41 1.395(7) . ?
C41 H41 0.9500 . ?
C41 C42 1.353(8) . ?
C42 H42 0.9500 . ?
C42 C43 1.367(9) . ?
C43 H43 0.9500 . ?
C43 C44 1.384(8) . ?
C44 H44 0.9500 . ?
C45 C46 1.376(7) . ?
C45 C50 1.379(7) . ?
C46 H46 0.9500 . ?
C46 C47 1.387(7) . ?
C47 H47 0.9500 . ?
C47 C48 1.370(9) . ?
C48 H48 0.9500 . ?
C48 C49 1.368(9) . ?
C49 H49 0.9500 . ?
C49 C50 1.394(8) . ?
C50 H50 0.9500 . ?
C51 C52 1.361(7) . ?
C51 C56 1.383(7) . ?
C52 H52 0.9500 . ?
C52 C53 1.388(7) . ?
C53 H53 0.9500 . ?
C53 C54 1.373(7) . ?
C54 H54 0.9500 . ?
C54 C55 1.366(7) . ?
C55 H55 0.9500 . ?
C55 C56 1.385(7) . ?
C56 H56 0.9500 . ?
C57 C58 1.395(7) . ?
C57 C62 1.385(7) . ?
C58 H58 0.9500 . ?
C58 C59 1.385(7) . ?
C59 H59 0.9500 . ?
C59 C60 1.369(8) . ?
C60 H60 0.9500 . ?
C60 C61 1.364(8) . ?
C61 H61 0.9500 . ?
C61 C62 1.389(7) . ?
C62 H62 0.9500 . ?
C63 C64 1.383(6) . ?
C63 C68 1.381(7) . ?
C64 H64 0.9500 . ?
C64 C65 1.391(7) . ?
C65 H65 0.9500 . ?
C65 C66 1.375(8) . ?
C66 H66 0.9500 . ?
C66 C67 1.377(8) . ?
C67 H67 0.9500 . ?
C67 C68 1.386(7) . ?
C68 H68 0.9500 . ?

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
_geom_angle_publ_flag
Sb1 Os1 Os2 75.271(9) . . ?
P1 Os1 Os2 94.12(3) . . ?
P1 Os1 Sb1 167.76(3) . . ?
C1 Os1 Os2 90.19(14) . . ?
C1 Os1 Sb1 83.07(13) . . ?
C1 Os1 P1 90.99(14) . . ?
C1 Os1 C9 87.21(19) . . ?
C2 Os1 Os2 91.95(14) . . ?
C2 Os1 Sb1 94.54(13) . . ?
C2 Os1 P1 91.87(14) . . ?
C2 Os1 C1 176.30(19) . . ?
C2 Os1 C9 90.28(19) . . ?
C9 Os1 Os2 172.35(12) . . ?
C9 Os1 Sb1 97.26(12) . . ?
C9 Os1 P1 93.11(12) . . ?
Os3 Os2 Os1 92.473(7) . . ?
P2 Os2 Os1 85.14(3) . . ?
P2 Os2 Os3 176.03(3) . . ?
C3 Os2 Os1 84.20(14) . . ?
C3 Os2 Os3 87.35(13) . . ?
C3 Os2 P2 89.26(13) . . ?
C3 Os2 C5 163.8(2) . . ?
C4 Os2 Os1 173.88(13) . . ?
C4 Os2 Os3 88.64(14) . . ?
C4 Os2 P2 94.07(14) . . ?
C4 Os2 C3 101.86(19) . . ?
C4 Os2 C5 93.91(19) . . ?
C5 Os2 Os1 80.10(14) . . ?
C5 Os2 Os3 89.19(13) . . ?
C5 Os2 P2 93.52(14) . . ?
Sb1 Os3 Os2 75.292(8) . . ?
Sb2 Os3 Os2 95.815(9) . . ?
Sb2 Os3 Sb1 167.637(11) . . ?
C6 Os3 Os2 90.47(13) . . ?
C6 Os3 Sb1 87.56(14) . . ?
C6 Os3 Sb2 83.89(14) . . ?
C6 Os3 C8 169.60(19) . . ?
C7 Os3 Os2 167.95(14) . . ?
C7 Os3 Sb1 95.44(14) . . ?
C7 Os3 Sb2 94.44(14) . . ?
C7 Os3 C6 96.90(19) . . ?
C7 Os3 C8 93.3(2) . . ?
C8 Os3 Os2 79.85(14) . . ?
C8 Os3 Sb1 93.58(14) . . ?
C8 Os3 Sb2 93.25(14) . . ?
Os1 Sb1 Os3 109.790(11) . . ?
C39 Sb1 Os1 113.40(12) . . ?
C39 Sb1 Os3 109.56(13) . . ?
C45 Sb1 Os1 117.84(13) . . ?
C45 Sb1 Os3 108.87(14) . . ?
C45 Sb1 C39 96.61(17) . . ?
C51 Sb2 Os3 111.26(12) . . ?
C57 Sb2 Os3 121.93(12) . . ?
C57 Sb2 C51 97.95(18) . . ?
C63 Sb2 Os3 120.36(12) . . ?
C63 Sb2 C51 100.26(18) . . ?
C63 Sb2 C57 100.94(17) . . ?
C15 P1 Os1 112.69(14) . . ?
C16 P1 Os1 113.63(15) . . ?
C16 P1 C15 103.9(2) . . ?
C22 P1 Os1 120.73(15) . . ?
C22 P1 C15 103.4(2) . . ?
C22 P1 C16 100.5(2) . . ?
C15 P2 Os2 114.79(15) . . ?
C15 P2 C28 98.9(2) . . ?
C28 P2 Os2 116.74(16) . . ?
C33 P2 Os2 114.67(15) . . ?
C33 P2 C15 108.4(2) . . ?
C33 P2 C28 101.5(2) . . ?
O1 C1 Os1 177.2(4) . . ?
O2 C2 Os1 177.3(4) . . ?
O3 C3 Os2 176.0(4) . . ?
O4 C4 Os2 175.4(4) . . ?
O5 C5 Os2 176.8(4) . . ?
O6 C6 Os3 175.6(4) . . ?
O7 C7 Os3 178.2(5) . . ?
O8 C8 Os3 177.8(4) . . ?
C10 C9 Os1 122.7(4) . . ?
C14 C9 Os1 123.4(4) . . ?
C14 C9 C10 113.9(5) . . ?
C9 C10 H10 118.5 . . ?
C11 C10 C9 123.0(5) . . ?
C11 C10 H10 118.5 . . ?
C10 C11 H11 119.5 . . ?
C12 C11 C10 120.9(6) . . ?
C12 C11 H11 119.5 . . ?
C11 C12 H12 120.6 . . ?
C11 C12 C13 118.8(6) . . ?
C13 C12 H12 120.6 . . ?
C12 C13 H13 119.7 . . ?
C12 C13 C14 120.6(6) . . ?
C14 C13 H13 119.7 . . ?
C28 C014 H014 119.6 . . ?
C28 C014 C32 120.9(5) . . ?
C32 C014 H014 119.6 . . ?
C9 C14 H14 118.6 . . ?
C13 C14 C9 122.8(5) . . ?
C13 C14 H14 118.6 . . ?
P1 C15 H15A 108.4 . . ?
P1 C15 H15B 108.4 . . ?
P2 C15 P1 115.4(2) . . ?
P2 C15 H15A 108.4 . . ?
P2 C15 H15B 108.4 . . ?
H15A C15 H15B 107.5 . . ?
C17 C16 P1 121.1(4) . . ?
C17 C16 C21 118.2(4) . . ?
C21 C16 P1 120.1(4) . . ?
C16 C17 H17 119.7 . . ?
C16 C17 C18 120.7(5) . . ?
C18 C17 H17 119.7 . . ?
C17 C18 H18 119.8 . . ?
C19 C18 C17 120.4(5) . . ?
C19 C18 H18 119.8 . . ?
C18 C19 H19 120.2 . . ?
C18 C19 C20 119.5(5) . . ?
C20 C19 H19 120.2 . . ?
C19 C20 H20 119.8 . . ?
C19 C20 C21 120.5(5) . . ?
C21 C20 H20 119.8 . . ?
C16 C21 C20 120.6(5) . . ?
C16 C21 H21 119.7 . . ?
C20 C21 H21 119.7 . . ?
C23 C22 P1 120.5(3) . . ?
C23 C22 C27 117.8(4) . . ?
C27 C22 P1 121.6(4) . . ?
C22 C23 H23 120.0 . . ?
C24 C23 C22 120.0(5) . . ?
C24 C23 H23 120.0 . . ?
C23 C24 H24 119.5 . . ?
C25 C24 C23 121.0(5) . . ?
C25 C24 H24 119.5 . . ?
C24 C25 H25 120.5 . . ?
C26 C25 C24 119.0(5) . . ?
C26 C25 H25 120.5 . . ?
C25 C26 H26 119.7 . . ?
C27 C26 C25 120.7(5) . . ?
C27 C26 H26 119.7 . . ?
C22 C27 H27 119.3 . . ?
C26 C27 C22 121.4(5) . . ?
C26 C27 H27 119.3 . . ?
C014 C28 P2 121.8(4) . . ?
C014 C28 C29 119.1(4) . . ?
C29 C28 P2 119.0(4) . . ?
C28 C29 H29 120.1 . . ?
C30 C29 C28 119.9(5) . . ?
C30 C29 H29 120.1 . . ?
C29 C30 H30 120.0 . . ?
C31 C30 C29 119.9(5) . . ?
C31 C30 H30 120.0 . . ?
C30 C31 H31 119.7 . . ?
C30 C31 C32 120.6(5) . . ?
C32 C31 H31 119.7 . . ?
C014 C32 H32 120.2 . . ?
C31 C32 C014 119.6(5) . . ?
C31 C32 H32 120.2 . . ?
C34 C33 P2 124.2(4) . . ?
C34 C33 C38 119.3(4) . . ?
C38 C33 P2 116.4(4) . . ?
C33 C34 H34 120.1 . . ?
C33 C34 C35 119.8(5) . . ?
C35 C34 H34 120.1 . . ?
C34 C35 H35 119.6 . . ?
C36 C35 C34 120.8(5) . . ?
C36 C35 H35 119.6 . . ?
C35 C36 H36 120.2 . . ?
C35 C36 C37 119.6(5) . . ?
C37 C36 H36 120.2 . . ?
C36 C37 H37 119.9 . . ?
C36 C37 C38 120.3(5) . . ?
C38 C37 H37 119.9 . . ?
C33 C38 H38 119.9 . . ?
C37 C38 C33 120.2(5) . . ?
C37 C38 H38 119.9 . . ?
C40 C39 Sb1 124.1(4) . . ?
C40 C39 C44 118.1(5) . . ?
C44 C39 Sb1 117.7(4) . . ?
C39 C40 H40 119.3 . . ?
C39 C40 C41 121.4(5) . . ?
C41 C40 H40 119.3 . . ?
C40 C41 H41 120.4 . . ?
C42 C41 C40 119.1(5) . . ?
C42 C41 H41 120.4 . . ?
C41 C42 H42 119.6 . . ?
C41 C42 C43 120.7(5) . . ?
C43 C42 H42 119.6 . . ?
C42 C43 H43 119.9 . . ?
C42 C43 C44 120.3(6) . . ?
C44 C43 H43 119.9 . . ?
C39 C44 C43 120.3(6) . . ?
C39 C44 H44 119.9 . . ?
C43 C44 H44 119.9 . . ?
C46 C45 Sb1 120.8(4) . . ?
C46 C45 C50 119.2(5) . . ?
C50 C45 Sb1 120.0(4) . . ?
C45 C46 H46 119.7 . . ?
C45 C46 C47 120.7(6) . . ?
C47 C46 H46 119.7 . . ?
C46 C47 H47 119.9 . . ?
C48 C47 C46 120.3(6) . . ?
C48 C47 H47 119.9 . . ?
C47 C48 H48 120.3 . . ?
C49 C48 C47 119.3(6) . . ?
C49 C48 H48 120.3 . . ?
C48 C49 H49 119.5 . . ?
C48 C49 C50 120.9(6) . . ?
C50 C49 H49 119.5 . . ?
C45 C50 C49 119.6(6) . . ?
C45 C50 H50 120.2 . . ?
C49 C50 H50 120.2 . . ?
C52 C51 Sb2 123.5(4) . . ?
C52 C51 C56 119.1(4) . . ?
C56 C51 Sb2 117.3(3) . . ?
C51 C52 H52 119.5 . . ?
C51 C52 C53 121.1(5) . . ?
C53 C52 H52 119.5 . . ?
C52 C53 H53 120.4 . . ?
C54 C53 C52 119.2(5) . . ?
C54 C53 H53 120.4 . . ?
C53 C54 H54 119.8 . . ?
C55 C54 C53 120.4(5) . . ?
C55 C54 H54 119.8 . . ?
C54 C55 H55 120.0 . . ?
C54 C55 C56 119.9(5) . . ?
C56 C55 H55 120.0 . . ?
C51 C56 C55 120.2(5) . . ?
C51 C56 H56 119.9 . . ?
C55 C56 H56 119.9 . . ?
C58 C57 Sb2 118.9(4) . . ?
C62 C57 Sb2 121.1(4) . . ?
C62 C57 C58 120.0(5) . . ?
C57 C58 H58 120.3 . . ?
C59 C58 C57 119.4(5) . . ?
C59 C58 H58 120.3 . . ?
C58 C59 H59 119.9 . . ?
C60 C59 C58 120.2(5) . . ?
C60 C59 H59 119.9 . . ?
C59 C60 H60 119.7 . . ?
C61 C60 C59 120.7(5) . . ?
C61 C60 H60 119.7 . . ?
C60 C61 H61 119.8 . . ?
C60 C61 C62 120.5(5) . . ?
C62 C61 H61 119.8 . . ?
C57 C62 C61 119.3(5) . . ?
C57 C62 H62 120.4 . . ?
C61 C62 H62 120.4 . . ?
C64 C63 Sb2 120.1(4) . . ?
C68 C63 Sb2 120.8(3) . . ?
C68 C63 C64 119.0(4) . . ?
C63 C64 H64 119.8 . . ?
C63 C64 C65 120.3(5) . . ?
C65 C64 H64 119.8 . . ?
C64 C65 H65 119.9 . . ?
C66 C65 C64 120.2(5) . . ?
C66 C65 H65 119.9 . . ?
C65 C66 H66 120.1 . . ?
C65 C66 C67 119.8(5) . . ?
C67 C66 H66 120.1 . . ?
C66 C67 H67 119.9 . . ?
C66 C67 C68 120.1(5) . . ?
C68 C67 H67 119.9 . . ?
C63 C68 C67 120.6(5) . . ?
C63 C68 H68 119.7 . . ?
C67 C68 H68 119.7 . . ?

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_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
Os1 P1 C15 P2 23.8(3) . . . . ?
Os1 P1 C16 C17 72.7(4) . . . . ?
Os1 P1 C16 C21 -98.5(4) . . . . ?
Os1 P1 C22 C23 17.0(4) . . . . ?
Os1 P1 C22 C27 -167.1(3) . . . . ?
Os1 C9 C10 C11 -178.2(4) . . . . ?
Os1 C9 C14 C13 178.5(4) . . . . ?
Os2 P2 C15 P1 -48.6(3) . . . . ?
Os2 P2 C28 C014 -29.9(4) . . . . ?
Os2 P2 C28 C29 153.2(3) . . . . ?
Os2 P2 C33 C34 128.9(4) . . . . ?
Os2 P2 C33 C38 -52.9(4) . . . . ?
Sb1 C39 C40 C41 -176.1(4) . . . . ?
Sb1 C39 C44 C43 178.0(5) . . . . ?
Sb1 C45 C46 C47 177.9(4) . . . . ?
Sb1 C45 C50 C49 -178.1(5) . . . . ?
Sb2 C51 C52 C53 -177.7(4) . . . . ?
Sb2 C51 C56 C55 177.5(4) . . . . ?
Sb2 C57 C58 C59 179.6(4) . . . . ?
Sb2 C57 C62 C61 -179.4(4) . . . . ?
Sb2 C63 C64 C65 177.5(4) . . . . ?
Sb2 C63 C68 C67 -178.5(4) . . . . ?
P1 C16 C17 C18 -169.7(4) . . . . ?
P1 C16 C21 C20 170.5(4) . . . . ?
P1 C22 C23 C24 178.0(4) . . . . ?
P1 C22 C27 C26 -179.2(4) . . . . ?
P2 C28 C29 C30 177.9(4) . . . . ?
P2 C33 C34 C35 179.2(4) . . . . ?
P2 C33 C38 C37 -179.7(4) . . . . ?
C9 C10 C11 C12 -0.7(9) . . . . ?
C10 C9 C14 C13 -1.6(7) . . . . ?
C10 C11 C12 C13 -1.0(9) . . . . ?
C11 C12 C13 C14 1.4(9) . . . . ?
C12 C13 C14 C9 0.0(8) . . . . ?
C014 C28 C29 C30 0.8(7) . . . . ?
C14 C9 C10 C11 1.9(7) . . . . ?
C15 P1 C16 C17 -50.1(4) . . . . ?
C15 P1 C16 C21 138.7(4) . . . . ?
C15 P1 C22 C23 144.2(4) . . . . ?
C15 P1 C22 C27 -40.0(4) . . . . ?
C15 P2 C28 C014 93.8(4) . . . . ?
C15 P2 C28 C29 -83.2(4) . . . . ?
C15 P2 C33 C34 -0.8(5) . . . . ?
C15 P2 C33 C38 177.4(4) . . . . ?
C16 P1 C15 P2 147.2(3) . . . . ?
C16 P1 C22 C23 -108.7(4) . . . . ?
C16 P1 C22 C27 67.2(4) . . . . ?
C16 C17 C18 C19 -1.5(8) . . . . ?
C17 C16 C21 C20 -0.9(7) . . . . ?
C17 C18 C19 C20 0.6(8) . . . . ?
C18 C19 C20 C21 0.1(8) . . . . ?
C19 C20 C21 C16 0.1(8) . . . . ?
C21 C16 C17 C18 1.6(7) . . . . ?
C22 P1 C15 P2 -108.2(3) . . . . ?
C22 P1 C16 C17 -156.9(4) . . . . ?
C22 P1 C16 C21 31.9(4) . . . . ?
C22 C23 C24 C25 0.0(8) . . . . ?
C23 C22 C27 C26 -3.3(7) . . . . ?
C23 C24 C25 C26 -0.9(8) . . . . ?
C24 C25 C26 C27 -0.4(8) . . . . ?
C25 C26 C27 C22 2.5(8) . . . . ?
C27 C22 C23 C24 2.0(7) . . . . ?
C28 P2 C15 P1 -173.7(3) . . . . ?
C28 P2 C33 C34 -104.3(4) . . . . ?
C28 P2 C33 C38 73.9(4) . . . . ?
C28 C014 C32 C31 -0.7(8) . . . . ?
C28 C29 C30 C31 -0.1(7) . . . . ?
C29 C30 C31 C32 -1.1(8) . . . . ?
C30 C31 C32 C014 1.5(8) . . . . ?
C32 C014 C28 P2 -177.4(4) . . . . ?
C32 C014 C28 C29 -0.5(7) . . . . ?
C33 P2 C15 P1 81.0(3) . . . . ?
C33 P2 C28 C014 -155.3(4) . . . . ?
C33 P2 C28 C29 27.7(4) . . . . ?
C33 C34 C35 C36 0.3(8) . . . . ?
C34 C33 C38 C37 -1.4(8) . . . . ?
C34 C35 C36 C37 -1.2(9) . . . . ?
C35 C36 C37 C38 0.8(10) . . . . ?
C36 C37 C38 C33 0.5(9) . . . . ?
C38 C33 C34 C35 1.0(7) . . . . ?
C39 C40 C41 C42 -1.8(8) . . . . ?
C40 C39 C44 C43 -0.7(9) . . . . ?
C40 C41 C42 C43 -0.7(9) . . . . ?
C41 C42 C43 C44 2.6(11) . . . . ?
C42 C43 C44 C39 -1.8(10) . . . . ?
C44 C39 C40 C41 2.5(7) . . . . ?
C45 C46 C47 C48 0.4(10) . . . . ?
C46 C45 C50 C49 -0.6(8) . . . . ?
C46 C47 C48 C49 -1.0(10) . . . . ?
C47 C48 C49 C50 0.8(11) . . . . ?
C48 C49 C50 C45 0.0(10) . . . . ?
C50 C45 C46 C47 0.5(8) . . . . ?
C51 C52 C53 C54 -0.5(9) . . . . ?
C52 C51 C56 C55 -1.9(8) . . . . ?
C52 C53 C54 C55 -0.2(9) . . . . ?
C53 C54 C55 C56 -0.1(8) . . . . ?
C54 C55 C56 C51 1.2(8) . . . . ?
C56 C51 C52 C53 1.6(8) . . . . ?
C57 C58 C59 C60 0.3(8) . . . . ?
C58 C57 C62 C61 1.4(7) . . . . ?
C58 C59 C60 C61 0.3(8) . . . . ?
C59 C60 C61 C62 0.0(9) . . . . ?
C60 C61 C62 C57 -0.8(8) . . . . ?
C62 C57 C58 C59 -1.2(7) . . . . ?
C63 C64 C65 C66 1.0(8) . . . . ?
C64 C63 C68 C67 0.5(7) . . . . ?
C64 C65 C66 C67 0.5(8) . . . . ?
C65 C66 C67 C68 -1.5(8) . . . . ?
C66 C67 C68 C63 1.0(8) . . . . ?
C68 C63 C64 C65 -1.5(7) . . . . ?

_smtbx_masks_special_details     ?
loop_
_smtbx_masks_void_nr
_smtbx_masks_void_average_x
_smtbx_masks_void_average_y
_smtbx_masks_void_average_z
_smtbx_masks_void_volume
_smtbx_masks_void_count_electrons
_smtbx_masks_void_content
1 0.000 0.000 0.000 255.2 44.5 ?
2 -0.090 0.139 0.594 12.4 0.0 ?
3 0.090 0.861 0.406 12.4 0.0 ?
4 0.460 0.303 0.556 10.4 0.2 ?
5 0.540 0.697 0.444 10.4 0.0 ?

_smtbx_masks_void_probe_radius   1.2
_smtbx_masks_void_truncation_radius 1.2
_olex2_submission_special_instructions 'No special instructions were received'
####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_fi_1c_a
_database_code_depnum_ccdc_archive 'CCDC 2152366'
loop_
_audit_author_name
_audit_author_address
'Shishir Ghosh'
;Jahangirnagar University
Bangladesh
;
_audit_update_record             
;
2022-02-16 deposited with the CCDC.	2022-12-19 downloaded from the CCDC.
;
_audit_creation_date             2021-09-26
_audit_creation_method           
;
Olex2 1.3
(compiled 2020.11.12 svn.r5f609507 for OlexSys, GUI svn.r6272)
;
_shelx_SHELXL_version_number     2014/7
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C68 H52 O7 Os3 P2 Sb2'
_chemical_formula_sum            'C68 H52 O7 Os3 P2 Sb2'
_chemical_formula_weight         1857.13
_chemical_absolute_configuration ?
_chemical_melting_point          ?
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'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Os Os -1.2165 7.6030 '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'
Sb Sb -0.5866 1.5461 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_space_group_crystal_system      orthorhombic
_space_group_IT_number           19
_space_group_name_H-M_alt        'P 21 21 21'
_space_group_name_Hall           'P 2ac 2ab'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, -y, z+1/2'
'-x, y+1/2, -z+1/2'
'x+1/2, -y+1/2, -z'

_cell_length_a                   15.1736(4)
_cell_length_b                   20.3459(6)
_cell_length_c                   21.9689(6)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_volume                     6782.3(3)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    9926
_cell_measurement_temperature    210(1)
_cell_measurement_theta_max      27.18
_cell_measurement_theta_min      2.50
_shelx_estimated_absorpt_T_max   0.541
_shelx_estimated_absorpt_T_min   0.182
_exptl_absorpt_coefficient_mu    6.482
_exptl_absorpt_correction_T_max  0.7455
_exptl_absorpt_correction_T_min  0.3676
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
SADABS-2014/5 (Bruker,2014/5) was used for absorption correction.
wR2(int) was 0.1338 before and 0.0708 after correction.
The Ratio of minimum to maximum transmission is 0.4931.
The λ/2 correction factor is Not present.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            yellow
_exptl_crystal_colour_primary    yellow
_exptl_crystal_density_diffrn    1.819
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       block
_exptl_crystal_F_000             3504
_exptl_crystal_size_max          0.398
_exptl_crystal_size_mid          0.305
_exptl_crystal_size_min          0.108
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0490
_diffrn_reflns_av_unetI/netI     0.0245
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.997
_diffrn_reflns_limit_h_max       19
_diffrn_reflns_limit_h_min       -19
_diffrn_reflns_limit_k_max       26
_diffrn_reflns_limit_k_min       -26
_diffrn_reflns_limit_l_max       28
_diffrn_reflns_limit_l_min       -28
_diffrn_reflns_number            197248
_diffrn_reflns_point_group_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.997
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         27.233
_diffrn_reflns_theta_min         2.206
_diffrn_ambient_temperature      210(1)
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_device_type  'Bruker D8 Venture'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   ?
_diffrn_source_current           1.0
_diffrn_source_power             0.05
_diffrn_source_voltage           50.0
_diffrn_standards_number         0
_reflns_Friedel_coverage         0.832
_reflns_Friedel_fraction_full    0.999
_reflns_Friedel_fraction_max     0.997
_reflns_number_gt                14525
_reflns_number_total             15130
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 Structure factors included contributions from the .fab file.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       ?
_computing_data_collection       ?
_computing_data_reduction        ?
_computing_molecular_graphics    'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_structure_refinement  'XL  (Sheldrick, 2008)'
_computing_structure_solution    'SHELXT 2014/5 (Sheldrick, 2014)'
_refine_diff_density_max         0.979
_refine_diff_density_min         -1.391
_refine_diff_density_rms         0.127
_refine_ls_abs_structure_details 
;
 Flack x determined using 6318 quotients [(I+)-(I-)]/[(I+)+(I-)]
 (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259).
;
_refine_ls_abs_structure_Flack   0.0833(19)
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.116
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     743
_refine_ls_number_reflns         15130
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0286
_refine_ls_R_factor_gt           0.0265
_refine_ls_restrained_S_all      1.116
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0107P)²+30.1444P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0596
_refine_ls_wR_factor_ref         0.0603
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
2.a Secondary CH2 refined with riding coordinates:
 C14(H14A,H14B)
2.b Aromatic/amide H refined with riding coordinates:
 C10(H10), C11(H11), C12(H12), C13(H13), C16(H16), C17(H17), C18(H18),
 C19(H19), C20(H20), C22(H22), C23(H23), C24(H24), C25(H25), C26(H26), C28(H28),
  C29(H29), C30(H30), C31(H31), C32(H32), C34(H34), C35(H35), C36(H36),
 C37(H37), C38(H38), C40(H40), C41(H41), C42(H42), C43(H43), C44(H44), C46(H46),
  C47(H47), C48(H48), C49(H49), C50(H50), C52(H52), C53(H53), C54(H54),
 C55(H55), C56(H56), C58(H58), C59(H59), C60(H60), C61(H61), C62(H62), C64(H64),
  C65(H65), C66(H66), C67(H67), C68(H68)
;
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     dual
_atom_sites_solution_secondary   ?
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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Os1 Os 0.69108(2) 0.78373(2) 0.35894(2) 0.02178(7) Uani 1 1 d . . . . .
Os2 Os 0.82487(2) 0.76099(2) 0.24995(2) 0.02363(7) Uani 1 1 d . . . . .
Os3 Os 0.67231(2) 0.75196(2) 0.16549(2) 0.02501(7) Uani 1 1 d . . . . .
Sb1 Sb 0.58310(3) 0.74442(3) 0.27203(2) 0.02285(10) Uani 1 1 d . . . . .
Sb2 Sb 0.54361(3) 0.73803(3) 0.08747(2) 0.02784(12) Uani 1 1 d . . . . .
P1 P 0.81363(14) 0.79559(10) 0.42230(9) 0.0238(4) Uani 1 1 d . . . . .
P2 P 0.94165(13) 0.76107(11) 0.31901(9) 0.0259(4) Uani 1 1 d . . . . .
C1 C 0.6117(5) 0.7595(5) 0.4213(4) 0.037(2) Uani 1 1 d . . . . .
C2 C 0.6580(6) 0.8733(5) 0.3629(5) 0.042(2) Uani 1 1 d . . . . .
C3 C 0.8920(5) 0.7132(5) 0.1924(4) 0.0320(19) Uani 1 1 d . . . . .
C4 C 0.8421(6) 0.8434(6) 0.2126(5) 0.045(3) Uani 1 1 d . . . . .
C5 C 0.6530(6) 0.8429(6) 0.1841(4) 0.039(2) Uani 1 1 d . . . . .
C6 C 0.7583(6) 0.7738(5) 0.1056(4) 0.036(2) Uani 1 1 d . . . . .
C7 C 0.7020(6) 0.6585(4) 0.1642(4) 0.0291(18) Uani 1 1 d . . . . .
O1 O 0.5628(4) 0.7466(4) 0.4584(3) 0.0484(17) Uani 1 1 d . . . . .
O2 O 0.6380(6) 0.9272(4) 0.3660(5) 0.073(3) Uani 1 1 d . . . . .
O3 O 0.9322(5) 0.6852(4) 0.1573(3) 0.059(2) Uani 1 1 d . . . . .
O4 O 0.8491(5) 0.8956(4) 0.1907(4) 0.064(2) Uani 1 1 d . . . . .
O5 O 0.6432(5) 0.8968(3) 0.1983(4) 0.0458(18) Uani 1 1 d . . . . .
O6 O 0.8125(5) 0.7876(4) 0.0719(3) 0.0551(19) Uani 1 1 d . . . . .
O7 O 0.7216(5) 0.6047(4) 0.1633(4) 0.054(2) Uani 1 1 d . . . . .
C8 C 0.7334(5) 0.6844(3) 0.3481(4) 0.0234(16) Uani 1 1 d . . . . .
C9 C 0.7896(5) 0.6734(4) 0.2969(3) 0.0213(15) Uani 1 1 d . . . . .
C10 C 0.8168(6) 0.6090(4) 0.2879(4) 0.0344(19) Uani 1 1 d . . . . .
H10 H 0.8512 0.6000 0.2532 0.041 Uiso 1 1 calc R U . . .
C11 C 0.7973(7) 0.5579(5) 0.3258(5) 0.047(2) Uani 1 1 d . . . . .
H11 H 0.8174 0.5153 0.3168 0.056 Uiso 1 1 calc R U . . .
C12 C 0.7478(7) 0.5694(4) 0.3771(5) 0.042(2) Uani 1 1 d . . . . .
H12 H 0.7358 0.5351 0.4046 0.051 Uiso 1 1 calc R U . . .
C13 C 0.7157(5) 0.6325(4) 0.3879(4) 0.0296(18) Uani 1 1 d . . . . .
H13 H 0.6815 0.6403 0.4228 0.035 Uiso 1 1 calc R U . . .
C14 C 0.9076(5) 0.7458(4) 0.3976(3) 0.0240(15) Uani 1 1 d . . . . .
H14A H 0.9576 0.7547 0.4247 0.029 Uiso 1 1 calc R U . . .
H14B H 0.8923 0.6992 0.4019 0.029 Uiso 1 1 calc R U . . .
C15 C 0.7952(5) 0.7711(5) 0.5008(3) 0.033(2) Uani 1 1 d . . . . .
C16 C 0.7354(6) 0.8078(5) 0.5339(4) 0.038(2) Uani 1 1 d . . . . .
H16 H 0.7071 0.8441 0.5160 0.046 Uiso 1 1 calc R U . . .
C17 C 0.7173(7) 0.7904(6) 0.5938(4) 0.051(3) Uani 1 1 d . . . . .
H17 H 0.6777 0.8159 0.6167 0.062 Uiso 1 1 calc R U . . .
C18 C 0.7555(7) 0.7380(8) 0.6192(4) 0.073(5) Uani 1 1 d . . . . .
H18 H 0.7423 0.7270 0.6598 0.087 Uiso 1 1 calc R U . . .
C19 C 0.8134(8) 0.7001(7) 0.5871(5) 0.064(3) Uani 1 1 d . . . . .
H19 H 0.8394 0.6631 0.6053 0.077 Uiso 1 1 calc R U . . .
C20 C 0.8340(6) 0.7168(5) 0.5269(4) 0.044(2) Uani 1 1 d . . . . .
H20 H 0.8740 0.6911 0.5045 0.053 Uiso 1 1 calc R U . . .
C21 C 0.8620(5) 0.8773(4) 0.4306(4) 0.0276(17) Uani 1 1 d . . . . .
C22 C 0.8586(6) 0.9217(5) 0.3830(5) 0.040(2) Uani 1 1 d . . . . .
H22 H 0.8266 0.9111 0.3477 0.048 Uiso 1 1 calc R U . . .
C23 C 0.9013(8) 0.9811(5) 0.3866(6) 0.055(3) Uani 1 1 d . . . . .
H23 H 0.9002 1.0101 0.3533 0.067 Uiso 1 1 calc R U . . .
C24 C 0.9449(9) 0.9980(5) 0.4380(7) 0.063(3) Uani 1 1 d . . . . .
H24 H 0.9723 1.0393 0.4410 0.076 Uiso 1 1 calc R U . . .
C25 C 0.9493(8) 0.9545(6) 0.4860(6) 0.064(4) Uani 1 1 d . . . . .
H25 H 0.9807 0.9659 0.5213 0.077 Uiso 1 1 calc R U . . .
C26 C 0.9077(7) 0.8944(6) 0.4824(5) 0.048(3) Uani 1 1 d . . . . .
H26 H 0.9106 0.8651 0.5153 0.058 Uiso 1 1 calc R U . . .
C27 C 1.0205(6) 0.6942(5) 0.3061(4) 0.033(2) Uani 1 1 d . . . . .
C28 C 1.0133(7) 0.6327(5) 0.3324(5) 0.041(2) Uani 1 1 d . . . . .
H28 H 0.9676 0.6245 0.3602 0.049 Uiso 1 1 calc R U . . .
C29 C 1.0718(8) 0.5835(6) 0.3185(6) 0.062(3) Uani 1 1 d . . . . .
H29 H 1.0649 0.5422 0.3369 0.074 Uiso 1 1 calc R U . . .
C30 C 1.1393(8) 0.5928(8) 0.2788(7) 0.069(4) Uani 1 1 d . . . . .
H30 H 1.1788 0.5586 0.2695 0.083 Uiso 1 1 calc R U . . .
C31 C 1.1483(8) 0.6553(8) 0.2521(6) 0.070(4) Uani 1 1 d . . . . .
H31 H 1.1955 0.6635 0.2255 0.084 Uiso 1 1 calc R U . . .
C32 C 1.0896(7) 0.7039(6) 0.2642(4) 0.045(3) Uani 1 1 d . . . . .
H32 H 1.0952 0.7446 0.2444 0.054 Uiso 1 1 calc R U . . .
C33 C 1.0151(6) 0.8327(4) 0.3240(4) 0.0313(19) Uani 1 1 d . . . . .
C34 C 1.0625(6) 0.8449(5) 0.3766(5) 0.040(2) Uani 1 1 d . . . . .
H34 H 1.0588 0.8163 0.4102 0.048 Uiso 1 1 calc R U . . .
C35 C 1.1164(7) 0.9011(6) 0.3787(6) 0.052(3) Uani 1 1 d . . . . .
H35 H 1.1492 0.9098 0.4141 0.062 Uiso 1 1 calc R U . . .
C36 C 1.1222(7) 0.9432(6) 0.3308(6) 0.058(3) Uani 1 1 d . . . . .
H36 H 1.1568 0.9813 0.3337 0.070 Uiso 1 1 calc R U . . .
C37 C 1.0771(7) 0.9295(7) 0.2787(6) 0.063(3) Uani 1 1 d . . . . .
H37 H 1.0818 0.9577 0.2450 0.076 Uiso 1 1 calc R U . . .
C38 C 1.0255(7) 0.8750(6) 0.2752(5) 0.049(3) Uani 1 1 d . . . . .
H38 H 0.9959 0.8658 0.2385 0.058 Uiso 1 1 calc R U . . .
C39 C 0.4630(5) 0.8013(4) 0.2624(4) 0.0290(18) Uani 1 1 d . . . . .
C40 C 0.4571(7) 0.8646(5) 0.2822(5) 0.041(2) Uani 1 1 d . . . . .
H40 H 0.5055 0.8844 0.3016 0.049 Uiso 1 1 calc R U . . .
C41 C 0.3808(7) 0.8994(5) 0.2740(5) 0.047(3) Uani 1 1 d . . . . .
H41 H 0.3771 0.9425 0.2891 0.057 Uiso 1 1 calc R U . . .
C42 C 0.3101(7) 0.8730(7) 0.2444(5) 0.058(3) Uani 1 1 d . . . . .
H42 H 0.2587 0.8979 0.2382 0.070 Uiso 1 1 calc R U . . .
C43 C 0.3156(7) 0.8088(6) 0.2234(5) 0.051(3) Uani 1 1 d . . . . .
H43 H 0.2674 0.7897 0.2031 0.061 Uiso 1 1 calc R U . . .
C44 C 0.3907(5) 0.7731(6) 0.2324(4) 0.040(2) Uani 1 1 d . . . . .
H44 H 0.3940 0.7295 0.2184 0.047 Uiso 1 1 calc R U . . .
C45 C 0.5207(6) 0.6542(4) 0.2982(4) 0.0284(18) Uani 1 1 d . . . . .
C46 C 0.4428(6) 0.6570(5) 0.3305(5) 0.040(2) Uani 1 1 d . . . . .
H46 H 0.4176 0.6982 0.3389 0.048 Uiso 1 1 calc R U . . .
C47 C 0.4018(8) 0.6023(6) 0.3502(5) 0.053(3) Uani 1 1 d . . . . .
H47 H 0.3490 0.6057 0.3724 0.064 Uiso 1 1 calc R U . . .
C48 C 0.4368(8) 0.5419(5) 0.3379(5) 0.050(3) Uani 1 1 d . . . . .
H48 H 0.4082 0.5035 0.3514 0.060 Uiso 1 1 calc R U . . .
C49 C 0.5153(8) 0.5377(5) 0.3052(5) 0.052(3) Uani 1 1 d . . . . .
H49 H 0.5400 0.4964 0.2964 0.062 Uiso 1 1 calc R U . . .
C50 C 0.5560(7) 0.5932(5) 0.2861(5) 0.040(2) Uani 1 1 d . . . . .
H50 H 0.6091 0.5901 0.2643 0.048 Uiso 1 1 calc R U . . .
C51 C 0.4716(6) 0.8203(4) 0.0572(4) 0.0313(19) Uani 1 1 d . . . . .
C52 C 0.4500(7) 0.8707(5) 0.0988(4) 0.039(2) Uani 1 1 d . . . . .
H52 H 0.4707 0.8686 0.1391 0.046 Uiso 1 1 calc R U . . .
C53 C 0.3988(8) 0.9231(5) 0.0804(5) 0.050(3) Uani 1 1 d . . . . .
H53 H 0.3844 0.9565 0.1082 0.059 Uiso 1 1 calc R U . . .
C54 C 0.3689(7) 0.9262(6) 0.0218(5) 0.048(3) Uani 1 1 d . . . . .
H54 H 0.3335 0.9618 0.0097 0.057 Uiso 1 1 calc R U . . .
C55 C 0.3898(7) 0.8783(5) -0.0198(4) 0.041(2) Uani 1 1 d . . . . .
H55 H 0.3684 0.8811 -0.0598 0.050 Uiso 1 1 calc R U . . .
C56 C 0.4409(6) 0.8272(6) -0.0030(4) 0.041(2) Uani 1 1 d . . . . .
H56 H 0.4564 0.7955 -0.0322 0.049 Uiso 1 1 calc R U . . .
C57 C 0.4383(6) 0.6733(5) 0.1091(4) 0.0328(19) Uani 1 1 d . . . . .
C58 C 0.4553(7) 0.6203(5) 0.1457(5) 0.046(2) Uani 1 1 d . . . . .
H58 H 0.5131 0.6130 0.1596 0.055 Uiso 1 1 calc R U . . .
C59 C 0.3893(9) 0.5774(6) 0.1627(6) 0.060(3) Uani 1 1 d . . . . .
H59 H 0.4017 0.5412 0.1878 0.072 Uiso 1 1 calc R U . . .
C60 C 0.3050(9) 0.5888(6) 0.1421(6) 0.062(3) Uani 1 1 d . . . . .
H60 H 0.2596 0.5596 0.1530 0.074 Uiso 1 1 calc R U . . .
C61 C 0.2865(7) 0.6405(7) 0.1069(6) 0.061(3) Uani 1 1 d . . . . .
H61 H 0.2283 0.6471 0.0936 0.073 Uiso 1 1 calc R U . . .
C62 C 0.3522(7) 0.6852(6) 0.0894(5) 0.049(3) Uani 1 1 d . . . . .
H62 H 0.3387 0.7220 0.0652 0.058 Uiso 1 1 calc R U . . .
C63 C 0.5778(6) 0.6945(5) 0.0017(4) 0.0330(19) Uani 1 1 d . . . . .
C64 C 0.5170(7) 0.6638(7) -0.0324(5) 0.054(3) Uani 1 1 d . . . . .
H64 H 0.4584 0.6616 -0.0186 0.065 Uiso 1 1 calc R U . . .
C65 C 0.5390(9) 0.6353(7) -0.0874(6) 0.067(4) Uani 1 1 d . . . . .
H65 H 0.4961 0.6126 -0.1101 0.081 Uiso 1 1 calc R U . . .
C66 C 0.6231(9) 0.6402(7) -0.1088(5) 0.061(3) Uani 1 1 d . . . . .
H66 H 0.6382 0.6218 -0.1467 0.073 Uiso 1 1 calc R U . . .
C67 C 0.6838(9) 0.6712(8) -0.0758(6) 0.076(4) Uani 1 1 d . . . . .
H67 H 0.7418 0.6746 -0.0906 0.091 Uiso 1 1 calc R U . . .
C68 C 0.6626(8) 0.6979(7) -0.0208(5) 0.064(4) Uani 1 1 d . . . . .
H68 H 0.7065 0.7190 0.0022 0.076 Uiso 1 1 calc R U . . .
H H 0.757(4) 0.807(3) 0.297(3) 0.003(17) Uiso 1 1 d . . . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Os1 Os2 3.1729(4) . ?
Os1 Sb1 2.6400(6) . ?
Os1 P1 2.335(2) . ?
Os1 C1 1.890(9) . ?
Os1 C2 1.892(10) . ?
Os1 C8 2.134(7) . ?
Os1 H 1.75(7) . ?
Os2 Os3 2.9725(4) . ?
Os2 P2 2.3328(19) . ?
Os2 C3 1.892(9) . ?
Os2 C4 1.885(11) . ?
Os2 C9 2.128(7) . ?
Os2 H 1.73(7) . ?
Os3 Sb1 2.7081(5) . ?
Os3 Sb2 2.6137(6) . ?
Os3 C5 1.917(12) . ?
Os3 C6 1.907(9) . ?
Os3 C7 1.954(7) . ?
Sb1 C39 2.170(8) . ?
Sb1 C45 2.145(8) . ?
Sb2 C51 2.106(9) . ?
Sb2 C57 2.124(9) . ?
Sb2 C63 2.146(9) . ?
P1 C14 1.831(7) . ?
P1 C15 1.816(8) . ?
P1 C21 1.826(8) . ?
P2 C14 1.830(7) . ?
P2 C27 1.834(9) . ?
P2 C33 1.838(9) . ?
C1 O1 1.132(10) . ?
C2 O2 1.139(12) . ?
C3 O3 1.137(11) . ?
C4 O4 1.171(13) . ?
C5 O5 1.149(13) . ?
C6 O6 1.140(11) . ?
C7 O7 1.135(10) . ?
C8 C9 1.428(11) . ?
C8 C13 1.397(11) . ?
C9 C10 1.387(11) . ?
C10 H10 0.9400 . ?
C10 C11 1.365(13) . ?
C11 H11 0.9400 . ?
C11 C12 1.374(15) . ?
C12 H12 0.9400 . ?
C12 C13 1.394(12) . ?
C13 H13 0.9400 . ?
C14 H14A 0.9800 . ?
C14 H14B 0.9800 . ?
C15 C16 1.382(13) . ?
C15 C20 1.376(13) . ?
C16 H16 0.9400 . ?
C16 C17 1.391(13) . ?
C17 H17 0.9400 . ?
C17 C18 1.337(19) . ?
C18 H18 0.9400 . ?
C18 C19 1.364(19) . ?
C19 H19 0.9400 . ?
C19 C20 1.402(13) . ?
C20 H20 0.9400 . ?
C21 C22 1.384(13) . ?
C21 C26 1.377(13) . ?
C22 H22 0.9400 . ?
C22 C23 1.373(14) . ?
C23 H23 0.9400 . ?
C23 C24 1.354(18) . ?
C24 H24 0.9400 . ?
C24 C25 1.377(19) . ?
C25 H25 0.9400 . ?
C25 C26 1.378(16) . ?
C26 H26 0.9400 . ?
C27 C28 1.382(14) . ?
C27 C32 1.409(14) . ?
C28 H28 0.9400 . ?
C28 C29 1.373(14) . ?
C29 H29 0.9400 . ?
C29 C30 1.358(19) . ?
C30 H30 0.9400 . ?
C30 C31 1.41(2) . ?
C31 H31 0.9400 . ?
C31 C32 1.357(15) . ?
C32 H32 0.9400 . ?
C33 C34 1.384(13) . ?
C33 C38 1.385(15) . ?
C34 H34 0.9400 . ?
C34 C35 1.407(14) . ?
C35 H35 0.9400 . ?
C35 C36 1.358(17) . ?
C36 H36 0.9400 . ?
C36 C37 1.363(18) . ?
C37 H37 0.9400 . ?
C37 C38 1.360(16) . ?
C38 H38 0.9400 . ?
C39 C40 1.362(13) . ?
C39 C44 1.401(12) . ?
C40 H40 0.9400 . ?
C40 C41 1.368(14) . ?
C41 H41 0.9400 . ?
C41 C42 1.365(17) . ?
C42 H42 0.9400 . ?
C42 C43 1.388(17) . ?
C43 H43 0.9400 . ?
C43 C44 1.366(14) . ?
C44 H44 0.9400 . ?
C45 C46 1.380(13) . ?
C45 C50 1.376(12) . ?
C46 H46 0.9400 . ?
C46 C47 1.346(14) . ?
C47 H47 0.9400 . ?
C47 C48 1.365(16) . ?
C48 H48 0.9400 . ?
C48 C49 1.394(16) . ?
C49 H49 0.9400 . ?
C49 C50 1.354(14) . ?
C50 H50 0.9400 . ?
C51 C52 1.413(13) . ?
C51 C56 1.409(12) . ?
C52 H52 0.9400 . ?
C52 C53 1.378(14) . ?
C53 H53 0.9400 . ?
C53 C54 1.368(15) . ?
C54 H54 0.9400 . ?
C54 C55 1.372(15) . ?
C55 H55 0.9400 . ?
C55 C56 1.348(14) . ?
C56 H56 0.9400 . ?
C57 C58 1.371(14) . ?
C57 C62 1.397(14) . ?
C58 H58 0.9400 . ?
C58 C59 1.379(15) . ?
C59 H59 0.9400 . ?
C59 C60 1.377(18) . ?
C60 H60 0.9400 . ?
C60 C61 1.336(18) . ?
C61 H61 0.9400 . ?
C61 C62 1.403(16) . ?
C62 H62 0.9400 . ?
C63 C64 1.342(14) . ?
C63 C68 1.381(14) . ?
C64 H64 0.9400 . ?
C64 C65 1.381(15) . ?
C65 H65 0.9400 . ?
C65 C66 1.365(18) . ?
C66 H66 0.9400 . ?
C66 C67 1.330(17) . ?
C67 H67 0.9400 . ?
C67 C68 1.364(16) . ?
C68 H68 0.9400 . ?

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
_geom_angle_publ_flag
Os2 Os1 H 24(2) . . ?
Sb1 Os1 Os2 78.881(14) . . ?
Sb1 Os1 H 83(2) . . ?
P1 Os1 Os2 87.45(5) . . ?
P1 Os1 Sb1 163.05(5) . . ?
P1 Os1 H 89(2) . . ?
C1 Os1 Os2 156.5(3) . . ?
C1 Os1 Sb1 92.8(2) . . ?
C1 Os1 P1 95.9(2) . . ?
C1 Os1 C2 92.8(5) . . ?
C1 Os1 C8 91.5(4) . . ?
C1 Os1 H 175(2) . . ?
C2 Os1 Os2 110.2(3) . . ?
C2 Os1 Sb1 99.2(3) . . ?
C2 Os1 P1 94.9(3) . . ?
C2 Os1 C8 175.6(4) . . ?
C2 Os1 H 86(2) . . ?
C8 Os1 Os2 65.5(2) . . ?
C8 Os1 Sb1 79.5(2) . . ?
C8 Os1 P1 85.7(2) . . ?
C8 Os1 H 90(2) . . ?
Os1 Os2 H 24(2) . . ?
Os3 Os2 Os1 88.959(11) . . ?
Os3 Os2 H 87(2) . . ?
P2 Os2 Os1 89.72(5) . . ?
P2 Os2 Os3 176.04(6) . . ?
P2 Os2 H 93(2) . . ?
C3 Os2 Os1 157.4(3) . . ?
C3 Os2 Os3 88.3(2) . . ?
C3 Os2 P2 91.5(2) . . ?
C3 Os2 C9 91.7(4) . . ?
C3 Os2 H 175(2) . . ?
C4 Os2 Os1 106.7(3) . . ?
C4 Os2 Os3 83.7(3) . . ?
C4 Os2 P2 100.2(3) . . ?
C4 Os2 C3 95.2(4) . . ?
C4 Os2 C9 172.3(4) . . ?
C4 Os2 H 82(2) . . ?
C9 Os2 Os1 66.1(2) . . ?
C9 Os2 Os3 93.2(2) . . ?
C9 Os2 P2 82.9(2) . . ?
C9 Os2 H 90(2) . . ?
Sb1 Os3 Os2 81.559(13) . . ?
Sb2 Os3 Os2 176.300(19) . . ?
Sb2 Os3 Sb1 100.789(18) . . ?
C5 Os3 Os2 85.8(3) . . ?
C5 Os3 Sb1 78.1(3) . . ?
C5 Os3 Sb2 97.5(3) . . ?
C5 Os3 C7 167.7(4) . . ?
C6 Os3 Os2 83.3(2) . . ?
C6 Os3 Sb1 162.2(3) . . ?
C6 Os3 Sb2 94.8(2) . . ?
C6 Os3 C5 91.5(4) . . ?
C6 Os3 C7 93.4(4) . . ?
C7 Os3 Os2 83.7(3) . . ?
C7 Os3 Sb1 94.1(3) . . ?
C7 Os3 Sb2 93.3(3) . . ?
Os1 Sb1 Os3 107.319(19) . . ?
C39 Sb1 Os1 115.5(2) . . ?
C39 Sb1 Os3 107.8(2) . . ?
C45 Sb1 Os1 109.9(2) . . ?
C45 Sb1 Os3 120.1(2) . . ?
C45 Sb1 C39 96.4(3) . . ?
C51 Sb2 Os3 120.6(2) . . ?
C51 Sb2 C57 99.9(3) . . ?
C51 Sb2 C63 100.2(3) . . ?
C57 Sb2 Os3 118.9(3) . . ?
C57 Sb2 C63 97.0(3) . . ?
C63 Sb2 Os3 116.1(2) . . ?
C14 P1 Os1 112.7(2) . . ?
C15 P1 Os1 114.5(3) . . ?
C15 P1 C14 104.4(4) . . ?
C15 P1 C21 102.5(4) . . ?
C21 P1 Os1 118.3(3) . . ?
C21 P1 C14 102.7(4) . . ?
C14 P2 Os2 113.5(2) . . ?
C14 P2 C27 101.8(4) . . ?
C14 P2 C33 104.5(4) . . ?
C27 P2 Os2 113.2(3) . . ?
C27 P2 C33 101.6(4) . . ?
C33 P2 Os2 120.0(3) . . ?
O1 C1 Os1 177.9(10) . . ?
O2 C2 Os1 179.2(11) . . ?
O3 C3 Os2 179.0(9) . . ?
O4 C4 Os2 176.7(9) . . ?
O5 C5 Os3 176.3(8) . . ?
O6 C6 Os3 176.8(7) . . ?
O7 C7 Os3 178.1(9) . . ?
C9 C8 Os1 114.6(5) . . ?
C13 C8 Os1 126.0(6) . . ?
C13 C8 C9 119.2(7) . . ?
C8 C9 Os2 113.6(5) . . ?
C10 C9 Os2 130.2(6) . . ?
C10 C9 C8 116.1(7) . . ?
C9 C10 H10 117.8 . . ?
C11 C10 C9 124.5(9) . . ?
C11 C10 H10 117.8 . . ?
C10 C11 H11 120.3 . . ?
C10 C11 C12 119.4(9) . . ?
C12 C11 H11 120.3 . . ?
C11 C12 H12 120.5 . . ?
C11 C12 C13 119.1(9) . . ?
C13 C12 H12 120.5 . . ?
C8 C13 H13 119.2 . . ?
C12 C13 C8 121.5(8) . . ?
C12 C13 H13 119.2 . . ?
P1 C14 H14A 108.8 . . ?
P1 C14 H14B 108.8 . . ?
P2 C14 P1 113.9(4) . . ?
P2 C14 H14A 108.8 . . ?
P2 C14 H14B 108.8 . . ?
H14A C14 H14B 107.7 . . ?
C16 C15 P1 116.8(7) . . ?
C20 C15 P1 123.4(7) . . ?
C20 C15 C16 119.7(8) . . ?
C15 C16 H16 120.3 . . ?
C15 C16 C17 119.3(10) . . ?
C17 C16 H16 120.3 . . ?
C16 C17 H17 119.6 . . ?
C18 C17 C16 120.9(11) . . ?
C18 C17 H17 119.6 . . ?
C17 C18 H18 119.5 . . ?
C17 C18 C19 120.9(9) . . ?
C19 C18 H18 119.5 . . ?
C18 C19 H19 120.2 . . ?
C18 C19 C20 119.7(11) . . ?
C20 C19 H19 120.2 . . ?
C15 C20 C19 119.5(10) . . ?
C15 C20 H20 120.3 . . ?
C19 C20 H20 120.3 . . ?
C22 C21 P1 120.3(7) . . ?
C26 C21 P1 121.1(8) . . ?
C26 C21 C22 118.5(9) . . ?
C21 C22 H22 119.5 . . ?
C23 C22 C21 121.0(10) . . ?
C23 C22 H22 119.5 . . ?
C22 C23 H23 120.0 . . ?
C24 C23 C22 120.1(11) . . ?
C24 C23 H23 120.0 . . ?
C23 C24 H24 120.0 . . ?
C23 C24 C25 120.0(10) . . ?
C25 C24 H24 120.0 . . ?
C24 C25 H25 119.9 . . ?
C24 C25 C26 120.2(11) . . ?
C26 C25 H25 119.9 . . ?
C21 C26 C25 120.2(11) . . ?
C21 C26 H26 119.9 . . ?
C25 C26 H26 119.9 . . ?
C28 C27 P2 123.7(7) . . ?
C28 C27 C32 117.3(9) . . ?
C32 C27 P2 118.8(8) . . ?
C27 C28 H28 119.5 . . ?
C29 C28 C27 121.0(11) . . ?
C29 C28 H28 119.5 . . ?
C28 C29 H29 119.0 . . ?
C30 C29 C28 122.0(13) . . ?
C30 C29 H29 119.0 . . ?
C29 C30 H30 121.1 . . ?
C29 C30 C31 117.8(11) . . ?
C31 C30 H30 121.1 . . ?
C30 C31 H31 119.5 . . ?
C32 C31 C30 120.9(12) . . ?
C32 C31 H31 119.5 . . ?
C27 C32 H32 119.5 . . ?
C31 C32 C27 120.9(12) . . ?
C31 C32 H32 119.5 . . ?
C34 C33 P2 120.5(8) . . ?
C34 C33 C38 118.5(9) . . ?
C38 C33 P2 121.0(8) . . ?
C33 C34 H34 120.8 . . ?
C33 C34 C35 118.3(10) . . ?
C35 C34 H34 120.8 . . ?
C34 C35 H35 119.2 . . ?
C36 C35 C34 121.7(11) . . ?
C36 C35 H35 119.2 . . ?
C35 C36 H36 120.4 . . ?
C35 C36 C37 119.3(11) . . ?
C37 C36 H36 120.4 . . ?
C36 C37 H37 119.9 . . ?
C38 C37 C36 120.2(12) . . ?
C38 C37 H37 119.9 . . ?
C33 C38 H38 119.1 . . ?
C37 C38 C33 121.9(11) . . ?
C37 C38 H38 119.1 . . ?
C40 C39 Sb1 121.9(7) . . ?
C40 C39 C44 119.1(9) . . ?
C44 C39 Sb1 119.0(7) . . ?
C39 C40 H40 119.9 . . ?
C39 C40 C41 120.1(10) . . ?
C41 C40 H40 119.9 . . ?
C40 C41 H41 119.2 . . ?
C42 C41 C40 121.6(11) . . ?
C42 C41 H41 119.2 . . ?
C41 C42 H42 120.6 . . ?
C41 C42 C43 118.8(9) . . ?
C43 C42 H42 120.6 . . ?
C42 C43 H43 119.9 . . ?
C44 C43 C42 120.1(10) . . ?
C44 C43 H43 119.9 . . ?
C39 C44 H44 119.9 . . ?
C43 C44 C39 120.2(10) . . ?
C43 C44 H44 119.9 . . ?
C46 C45 Sb1 118.7(7) . . ?
C50 C45 Sb1 123.2(7) . . ?
C50 C45 C46 118.0(9) . . ?
C45 C46 H46 119.1 . . ?
C47 C46 C45 121.8(10) . . ?
C47 C46 H46 119.1 . . ?
C46 C47 H47 119.9 . . ?
C46 C47 C48 120.1(10) . . ?
C48 C47 H47 119.9 . . ?
C47 C48 H48 120.4 . . ?
C47 C48 C49 119.2(9) . . ?
C49 C48 H48 120.4 . . ?
C48 C49 H49 120.0 . . ?
C50 C49 C48 119.9(9) . . ?
C50 C49 H49 120.0 . . ?
C45 C50 H50 119.5 . . ?
C49 C50 C45 121.0(10) . . ?
C49 C50 H50 119.5 . . ?
C52 C51 Sb2 119.5(6) . . ?
C56 C51 Sb2 123.2(7) . . ?
C56 C51 C52 117.2(9) . . ?
C51 C52 H52 119.9 . . ?
C53 C52 C51 120.2(9) . . ?
C53 C52 H52 119.9 . . ?
C52 C53 H53 120.0 . . ?
C54 C53 C52 119.9(10) . . ?
C54 C53 H53 120.0 . . ?
C53 C54 H54 119.4 . . ?
C53 C54 C55 121.1(10) . . ?
C55 C54 H54 119.4 . . ?
C54 C55 H55 120.0 . . ?
C56 C55 C54 119.9(9) . . ?
C56 C55 H55 120.0 . . ?
C51 C56 H56 119.2 . . ?
C55 C56 C51 121.6(9) . . ?
C55 C56 H56 119.2 . . ?
C58 C57 Sb2 118.5(7) . . ?
C58 C57 C62 119.6(10) . . ?
C62 C57 Sb2 121.8(8) . . ?
C57 C58 H58 119.3 . . ?
C57 C58 C59 121.3(11) . . ?
C59 C58 H58 119.3 . . ?
C58 C59 H59 120.7 . . ?
C60 C59 C58 118.7(12) . . ?
C60 C59 H59 120.7 . . ?
C59 C60 H60 119.4 . . ?
C61 C60 C59 121.1(11) . . ?
C61 C60 H60 119.4 . . ?
C60 C61 H61 119.3 . . ?
C60 C61 C62 121.4(11) . . ?
C62 C61 H61 119.3 . . ?
C57 C62 C61 117.9(11) . . ?
C57 C62 H62 121.1 . . ?
C61 C62 H62 121.1 . . ?
C64 C63 Sb2 121.1(7) . . ?
C64 C63 C68 117.7(9) . . ?
C68 C63 Sb2 121.2(7) . . ?
C63 C64 H64 119.4 . . ?
C63 C64 C65 121.2(11) . . ?
C65 C64 H64 119.4 . . ?
C64 C65 H65 120.1 . . ?
C66 C65 C64 119.7(11) . . ?
C66 C65 H65 120.1 . . ?
C65 C66 H66 120.2 . . ?
C67 C66 C65 119.7(11) . . ?
C67 C66 H66 120.2 . . ?
C66 C67 H67 119.7 . . ?
C66 C67 C68 120.6(12) . . ?
C68 C67 H67 119.7 . . ?
C63 C68 H68 119.4 . . ?
C67 C68 C63 121.1(11) . . ?
C67 C68 H68 119.4 . . ?

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_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
Os1 P1 C14 P2 55.5(5) . . . . ?
Os1 P1 C15 C16 -65.1(7) . . . . ?
Os1 P1 C15 C20 111.4(8) . . . . ?
Os1 P1 C21 C22 -31.0(8) . . . . ?
Os1 P1 C21 C26 153.5(7) . . . . ?
Os1 C8 C9 Os2 5.0(7) . . . . ?
Os1 C8 C9 C10 -178.8(6) . . . . ?
Os1 C8 C13 C12 -178.9(7) . . . . ?
Os2 P2 C14 P1 -48.0(5) . . . . ?
Os2 P2 C27 C28 -89.4(8) . . . . ?
Os2 P2 C27 C32 86.4(7) . . . . ?
Os2 P2 C33 C34 156.5(6) . . . . ?
Os2 P2 C33 C38 -24.5(9) . . . . ?
Os2 C9 C10 C11 171.9(8) . . . . ?
Sb1 C39 C40 C41 178.4(7) . . . . ?
Sb1 C39 C44 C43 -177.3(7) . . . . ?
Sb1 C45 C46 C47 -177.6(8) . . . . ?
Sb1 C45 C50 C49 178.0(8) . . . . ?
Sb2 C51 C52 C53 -176.4(8) . . . . ?
Sb2 C51 C56 C55 175.3(8) . . . . ?
Sb2 C57 C58 C59 178.3(8) . . . . ?
Sb2 C57 C62 C61 -178.7(8) . . . . ?
Sb2 C63 C64 C65 -179.6(10) . . . . ?
Sb2 C63 C68 C67 -178.8(11) . . . . ?
P1 C15 C16 C17 178.7(8) . . . . ?
P1 C15 C20 C19 -177.6(8) . . . . ?
P1 C21 C22 C23 -174.3(8) . . . . ?
P1 C21 C26 C25 175.2(9) . . . . ?
P2 C27 C28 C29 176.5(9) . . . . ?
P2 C27 C32 C31 -178.4(9) . . . . ?
P2 C33 C34 C35 -178.6(8) . . . . ?
P2 C33 C38 C37 177.7(9) . . . . ?
C8 C9 C10 C11 -3.5(14) . . . . ?
C9 C8 C13 C12 -3.6(13) . . . . ?
C9 C10 C11 C12 -0.5(16) . . . . ?
C10 C11 C12 C13 2.6(15) . . . . ?
C11 C12 C13 C8 -0.6(14) . . . . ?
C13 C8 C9 Os2 -170.8(6) . . . . ?
C13 C8 C9 C10 5.4(12) . . . . ?
C14 P1 C15 C16 171.1(7) . . . . ?
C14 P1 C15 C20 -12.3(9) . . . . ?
C14 P1 C21 C22 93.8(8) . . . . ?
C14 P1 C21 C26 -81.7(8) . . . . ?
C14 P2 C27 C28 32.9(9) . . . . ?
C14 P2 C27 C32 -151.3(7) . . . . ?
C14 P2 C33 C34 27.8(8) . . . . ?
C14 P2 C33 C38 -153.2(8) . . . . ?
C15 P1 C14 P2 -179.6(4) . . . . ?
C15 P1 C21 C22 -158.0(7) . . . . ?
C15 P1 C21 C26 26.4(9) . . . . ?
C15 C16 C17 C18 -1.5(16) . . . . ?
C16 C15 C20 C19 -1.1(15) . . . . ?
C16 C17 C18 C19 0.2(18) . . . . ?
C17 C18 C19 C20 0.7(18) . . . . ?
C18 C19 C20 C15 -0.2(17) . . . . ?
C20 C15 C16 C17 2.0(14) . . . . ?
C21 P1 C14 P2 -72.9(5) . . . . ?
C21 P1 C15 C16 64.3(8) . . . . ?
C21 P1 C15 C20 -119.1(8) . . . . ?
C21 C22 C23 C24 -2.4(17) . . . . ?
C22 C21 C26 C25 -0.4(16) . . . . ?
C22 C23 C24 C25 2(2) . . . . ?
C23 C24 C25 C26 -1(2) . . . . ?
C24 C25 C26 C21 0.4(19) . . . . ?
C26 C21 C22 C23 1.3(15) . . . . ?
C27 P2 C14 P1 -170.1(5) . . . . ?
C27 P2 C33 C34 -77.8(8) . . . . ?
C27 P2 C33 C38 101.3(8) . . . . ?
C27 C28 C29 C30 0.4(18) . . . . ?
C28 C27 C32 C31 -2.3(15) . . . . ?
C28 C29 C30 C31 0(2) . . . . ?
C29 C30 C31 C32 -2(2) . . . . ?
C30 C31 C32 C27 3.1(18) . . . . ?
C32 C27 C28 C29 0.6(15) . . . . ?
C33 P2 C14 P1 84.5(5) . . . . ?
C33 P2 C27 C28 140.5(8) . . . . ?
C33 P2 C27 C32 -43.7(8) . . . . ?
C33 C34 C35 C36 0.4(16) . . . . ?
C34 C33 C38 C37 -3.2(16) . . . . ?
C34 C35 C36 C37 -2.4(18) . . . . ?
C35 C36 C37 C38 1.5(19) . . . . ?
C36 C37 C38 C33 1.3(19) . . . . ?
C38 C33 C34 C35 2.3(14) . . . . ?
C39 C40 C41 C42 -2.0(16) . . . . ?
C40 C39 C44 C43 -0.1(13) . . . . ?
C40 C41 C42 C43 1.5(16) . . . . ?
C41 C42 C43 C44 -0.2(16) . . . . ?
C42 C43 C44 C39 -0.4(14) . . . . ?
C44 C39 C40 C41 1.3(14) . . . . ?
C45 C46 C47 C48 -0.6(17) . . . . ?
C46 C45 C50 C49 0.2(15) . . . . ?
C46 C47 C48 C49 0.3(18) . . . . ?
C47 C48 C49 C50 0.1(18) . . . . ?
C48 C49 C50 C45 -0.4(17) . . . . ?
C50 C45 C46 C47 0.3(15) . . . . ?
C51 C52 C53 C54 -0.2(17) . . . . ?
C52 C51 C56 C55 -2.9(14) . . . . ?
C52 C53 C54 C55 -0.6(18) . . . . ?
C53 C54 C55 C56 -0.3(17) . . . . ?
C54 C55 C56 C51 2.2(16) . . . . ?
C56 C51 C52 C53 1.9(14) . . . . ?
C57 C58 C59 C60 -0.1(17) . . . . ?
C58 C57 C62 C61 -1.8(15) . . . . ?
C58 C59 C60 C61 -0.7(19) . . . . ?
C59 C60 C61 C62 0.2(19) . . . . ?
C60 C61 C62 C57 1.1(17) . . . . ?
C62 C57 C58 C59 1.3(15) . . . . ?
C63 C64 C65 C66 -2(2) . . . . ?
C64 C63 C68 C67 0(2) . . . . ?
C64 C65 C66 C67 1(2) . . . . ?
C65 C66 C67 C68 0(2) . . . . ?
C66 C67 C68 C63 -1(2) . . . . ?
C68 C63 C64 C65 1.5(19) . . . . ?

_smtbx_masks_special_details     ?
loop_
_smtbx_masks_void_nr
_smtbx_masks_void_average_x
_smtbx_masks_void_average_y
_smtbx_masks_void_average_z
_smtbx_masks_void_volume
_smtbx_masks_void_count_electrons
_smtbx_masks_void_content
1 -0.070 -0.006 -0.002 273.3 68.3 ?
2 0.012 0.065 0.300 7.1 0.0 ?
3 0.070 0.494 0.502 273.3 68.5 ?
4 -0.012 0.565 0.200 7.1 0.0 ?
5 0.430 0.506 0.002 273.3 70.0 ?
6 0.570 0.006 0.498 273.3 69.9 ?
7 0.250 0.472 0.225 7.1 0.0 ?
8 0.250 0.528 0.725 7.1 0.7 ?
9 0.487 0.935 0.800 7.1 0.0 ?
10 0.512 0.435 0.700 7.1 0.0 ?
11 0.750 0.028 0.775 7.1 0.0 ?
12 0.750 0.972 0.275 7.1 0.0 ?

_smtbx_masks_void_probe_radius   1.2
_smtbx_masks_void_truncation_radius 1.2
_olex2_submission_special_instructions 'No special instructions were received'
