#------------------------------------------------------------------------------
#$Date: 2016-03-23 00:38:15 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179120 $
#$URL: svn://www.crystallography.net/cod/cif/4/30/82/4308224.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_4308224
loop_
_publ_author_name
'Richard D. Adams'
'Burjor Captain'
'Lei Zhu'
_publ_section_title
;
Addition of Pt(PBut3) to Osmium-Tin Cluster Complexes
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              4605
_journal_page_last               4611
_journal_paper_doi               10.1021/ic070261a
_journal_volume                  46
_journal_year                    2007
_chemical_formula_sum            'C53 H78 O11 Os3 P2 Pt Sn'
_chemical_formula_weight         1837.47
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 98.0100(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   17.6264(5)
_cell_length_b                   21.7527(7)
_cell_length_c                   16.0451(5)
_cell_measurement_reflns_used    6038
_cell_measurement_temperature    294(2)
_cell_measurement_theta_max      28.03
_cell_measurement_theta_min      2.27
_cell_volume                     6092.0(3)
_computing_cell_refinement       'SAINT+  V6.45 (Bruker, 2003)'
_computing_data_collection       'SMART V5.632 (Bruker, 2005)'
_computing_data_reduction        'SAINT+  V6.45'
_computing_molecular_graphics    'SHELXTL V6.1 (Sheldrick, 2000)'
_computing_publication_material  'SHELXTL V6.1'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      294(2)
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_device_type  'Bruker SMART APEX CCD diffractometer'
_diffrn_measurement_method       'omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0272
_diffrn_reflns_av_sigmaI/netI    0.0317
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -23
_diffrn_reflns_limit_k_max       28
_diffrn_reflns_limit_k_min       -29
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            46699
_diffrn_reflns_theta_full        28.35
_diffrn_reflns_theta_max         28.35
_diffrn_reflns_theta_min         1.17
_diffrn_standards_decay_%        <1
_exptl_absorpt_coefficient_mu    9.031
_exptl_absorpt_correction_T_max  1.000
_exptl_absorpt_correction_T_min  0.507
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(SADABS, Bruker, 1997)'
_exptl_crystal_colour            orange
_exptl_crystal_density_diffrn    2.003
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             3480
_exptl_crystal_size_max          0.40
_exptl_crystal_size_mid          0.30
_exptl_crystal_size_min          0.20
_refine_diff_density_max         3.443
_refine_diff_density_min         -0.762
_refine_diff_density_rms         0.183
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.044
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     610
_refine_ls_number_reflns         15185
_refine_ls_number_restraints     12
_refine_ls_restrained_S_all      1.045
_refine_ls_R_factor_all          0.0584
_refine_ls_R_factor_gt           0.0382
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0659P)²+0.3054P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0989
_refine_ls_wR_factor_ref         0.1115
_reflns_number_gt                11283
_reflns_number_total             15185
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic070261a-file002_3.cif
_cod_data_source_block           p21c
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from
2010-06-29.

'_exptl_absorpt_correction_type' value 'Multi-scan' changed
to 'multi-scan' according to
'/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_database_code               4308224
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt1 Pt 0.238599(14) 0.564864(11) 0.943846(14) 0.04527(7) Uani 1 1 d . . .
Sn1 Sn 0.26463(2) 0.519274(19) 0.66917(2) 0.04487(10) Uani 1 1 d . . .
Os1 Os 0.168684(14) 0.524147(12) 0.788057(14) 0.04761(7) Uani 1 1 d . . .
Os2 Os 0.328776(14) 0.572065(11) 0.818420(14) 0.04482(7) Uani 1 1 d . . .
Os3 Os 0.329558(14) 0.422547(11) 0.596174(14) 0.04472(7) Uani 1 1 d . . .
P1 P 0.23392(10) 0.55344(9) 1.08848(10) 0.0529(4) Uani 1 1 d . . .
P2 P 0.39238(11) 0.32941(8) 0.53762(11) 0.0565(4) Uani 1 1 d . . .
O11 O 0.2189(4) 0.4040(3) 0.8790(3) 0.0802(16) Uani 1 1 d . . .
O12 O 0.0228(3) 0.4603(4) 0.7123(4) 0.108(2) Uani 1 1 d . . .
O13 O 0.1103(4) 0.6424(3) 0.6950(4) 0.101(2) Uani 1 1 d . . .
O14 O 0.0695(3) 0.5864(3) 0.9048(4) 0.0858(17) Uani 1 1 d . . .
O21 O 0.3898(3) 0.4441(3) 0.8745(4) 0.0848(17) Uani 1 1 d . . .
O22 O 0.4838(3) 0.6052(3) 0.7711(4) 0.0891(18) Uani 1 1 d . . .
O23 O 0.2689(4) 0.6982(3) 0.7581(4) 0.107(2) Uani 1 1 d . . .
O24 O 0.3748(4) 0.6501(3) 0.9754(4) 0.105(2) Uani 1 1 d . . .
O33 O 0.2771(4) 0.3490(3) 0.7403(4) 0.0942(19) Uani 1 1 d . . .
O34 O 0.4756(3) 0.4703(3) 0.7013(4) 0.094(2) Uani 1 1 d . . .
O35 O 0.3447(3) 0.5168(3) 0.4572(3) 0.0791(16) Uani 1 1 d . . .
C11 C 0.2029(4) 0.4479(3) 0.8443(4) 0.0567(16) Uani 1 1 d . . .
C12 C 0.0782(4) 0.4846(4) 0.7397(4) 0.067(2) Uani 1 1 d . . .
C13 C 0.1334(4) 0.5991(4) 0.7289(4) 0.0631(18) Uani 1 1 d . . .
C14 C 0.1246(4) 0.5625(3) 0.8905(4) 0.0590(17) Uani 1 1 d . . .
C21 C 0.3656(4) 0.4907(3) 0.8551(4) 0.0571(16) Uani 1 1 d . . .
C22 C 0.4258(4) 0.5918(4) 0.7881(5) 0.0635(18) Uani 1 1 d . . .
C23 C 0.2882(5) 0.6509(3) 0.7789(4) 0.0642(18) Uani 1 1 d . . .
C24 C 0.3396(5) 0.6114(4) 0.9371(4) 0.0657(19) Uani 1 1 d . . .
C31 C 0.2994(4) 0.3752(3) 0.6861(4) 0.0616(17) Uani 1 1 d . . .
C32 C 0.4241(4) 0.4493(4) 0.6602(4) 0.0604(17) Uani 1 1 d . . .
C33 C 0.3415(4) 0.4811(3) 0.5076(4) 0.0547(16) Uani 1 1 d . . .
C40 C 0.2366(4) 0.5892(4) 0.5734(4) 0.0615(18) Uani 1 1 d . . .
C41 C 0.2841(5) 0.6381(4) 0.5652(5) 0.075(2) Uani 1 1 d . . .
H41 H 0.3294 0.6420 0.6021 0.090 Uiso 1 1 calc R . .
C42 C 0.2659(7) 0.6816(4) 0.5036(6) 0.094(3) Uani 1 1 d . . .
H42 H 0.2986 0.7147 0.4995 0.113 Uiso 1 1 calc R . .
C43 C 0.2001(8) 0.6764(5) 0.4486(6) 0.113(4) Uani 1 1 d . . .
H43 H 0.1878 0.7065 0.4078 0.135 Uiso 1 1 calc R . .
C44 C 0.1514(7) 0.6272(6) 0.4523(6) 0.106(4) Uani 1 1 d . . .
H44 H 0.1074 0.6229 0.4134 0.127 Uiso 1 1 calc R . .
C45 C 0.1700(5) 0.5840(4) 0.5160(5) 0.082(2) Uani 1 1 d . . .
H45 H 0.1373 0.5509 0.5202 0.098 Uiso 1 1 calc R . .
C46 C 0.2106(4) 0.4174(3) 0.5349(4) 0.0615(18) Uani 1 1 d . . .
C47 C 0.1885(5) 0.4308(4) 0.4493(5) 0.082(3) Uani 1 1 d . . .
H47 H 0.2264 0.4397 0.4161 0.099 Uiso 1 1 calc R . .
C48 C 0.1123(7) 0.4312(7) 0.4121(7) 0.131(5) Uani 1 1 d . . .
H48 H 0.1001 0.4436 0.3564 0.158 Uiso 1 1 calc R . .
C49 C 0.0567(6) 0.4139(7) 0.4555(7) 0.134(5) Uani 1 1 d . . .
H49 H 0.0062 0.4126 0.4296 0.161 Uiso 1 1 calc R . .
C50 C 0.0747(5) 0.3981(6) 0.5389(7) 0.116(4) Uani 1 1 d . . .
H50 H 0.0362 0.3869 0.5700 0.139 Uiso 1 1 calc R . .
C51 C 0.1497(5) 0.3989(4) 0.5759(5) 0.079(2) Uani 1 1 d . . .
H51 H 0.1606 0.3865 0.6318 0.094 Uiso 1 1 calc R . .
C52 C 0.3266(8) 0.2617(6) 0.5143(13) 0.182(8) Uani 1 1 d . . .
C53 C 0.3200(8) 0.2304(5) 0.6108(8) 0.164(7) Uani 1 1 d . . .
H53A H 0.2886 0.2562 0.6405 0.247 Uiso 1 1 calc R . .
H53B H 0.3702 0.2272 0.6424 0.247 Uiso 1 1 calc R . .
H53C H 0.2974 0.1903 0.6036 0.247 Uiso 1 1 calc R . .
C54 C 0.3590(8) 0.2081(6) 0.4597(10) 0.174(7) Uani 1 1 d . . .
H54A H 0.3269 0.1724 0.4597 0.261 Uiso 1 1 calc R . .
H54B H 0.4103 0.1978 0.4840 0.261 Uiso 1 1 calc R . .
H54C H 0.3589 0.2221 0.4030 0.261 Uiso 1 1 calc R . .
C55 C 0.2501(6) 0.2798(6) 0.4691(9) 0.147(6) Uani 1 1 d . . .
H55A H 0.2559 0.2952 0.4143 0.221 Uiso 1 1 calc R . .
H55B H 0.2282 0.3111 0.5005 0.221 Uiso 1 1 calc R . .
H55C H 0.2170 0.2445 0.4633 0.221 Uiso 1 1 calc R . .
C56 C 0.4388(7) 0.3473(5) 0.4425(7) 0.113(4) Uani 1 1 d . . .
C57 C 0.4812(6) 0.4096(4) 0.4492(6) 0.095(3) Uani 1 1 d . . .
H57A H 0.5290 0.4053 0.4856 0.142 Uiso 1 1 calc R . .
H57B H 0.4502 0.4399 0.4719 0.142 Uiso 1 1 calc R . .
H57C H 0.4908 0.4223 0.3943 0.142 Uiso 1 1 calc R . .
C58 C 0.3540(9) 0.3509(7) 0.3658(6) 0.169(7) Uani 1 1 d . . .
H58A H 0.3678 0.3456 0.3104 0.253 Uiso 1 1 calc R . .
H58B H 0.3297 0.3902 0.3692 0.253 Uiso 1 1 calc R . .
H58C H 0.3192 0.3189 0.3768 0.253 Uiso 1 1 calc R . .
C59 C 0.4959(6) 0.3006(4) 0.4148(6) 0.105(3) Uani 1 1 d . . .
H59A H 0.5155 0.3158 0.3658 0.157 Uiso 1 1 calc R . .
H59B H 0.4704 0.2621 0.4018 0.157 Uiso 1 1 calc R . .
H59C H 0.5375 0.2948 0.4595 0.157 Uiso 1 1 calc R . .
C60 C 0.4783(9) 0.3017(6) 0.6195(6) 0.146(6) Uani 1 1 d . . .
C61 C 0.4591(7) 0.3031(5) 0.7072(5) 0.115(4) Uani 1 1 d . . .
H61A H 0.4153 0.2776 0.7107 0.173 Uiso 1 1 calc R . .
H61B H 0.4479 0.3446 0.7219 0.173 Uiso 1 1 calc R . .
H61C H 0.5019 0.2881 0.7454 0.173 Uiso 1 1 calc R . .
C62 C 0.5508(6) 0.3503(6) 0.6045(10) 0.142(5) Uani 1 1 d . . .
H62A H 0.5401 0.3905 0.6244 0.214 Uiso 1 1 calc R . .
H62B H 0.5553 0.3523 0.5457 0.214 Uiso 1 1 calc R . .
H62C H 0.5980 0.3355 0.6351 0.214 Uiso 1 1 calc R . .
C63 C 0.5042(9) 0.2356(6) 0.6022(7) 0.165(7) Uani 1 1 d . . .
H63A H 0.5436 0.2230 0.6464 0.247 Uiso 1 1 calc R . .
H63B H 0.5237 0.2345 0.5493 0.247 Uiso 1 1 calc R . .
H63C H 0.4613 0.2082 0.6003 0.247 Uiso 1 1 calc R . .
C64 C 0.1456(5) 0.5065(4) 1.1112(4) 0.072(2) Uani 1 1 d . . .
C65 C 0.1283(5) 0.4564(4) 1.0463(5) 0.080(2) Uani 1 1 d . . .
H65A H 0.1682 0.4260 1.0541 0.121 Uiso 1 1 calc R . .
H65B H 0.1255 0.4737 0.9910 0.121 Uiso 1 1 calc R . .
H65C H 0.0802 0.4375 1.0526 0.121 Uiso 1 1 calc R . .
C66 C 0.0734(5) 0.5494(5) 1.0995(6) 0.093(3) Uani 1 1 d . . .
H66A H 0.0719 0.5720 1.0480 0.140 Uiso 1 1 calc R . .
H66B H 0.0763 0.5775 1.1460 0.140 Uiso 1 1 calc R . .
H66C H 0.0280 0.5248 1.0976 0.140 Uiso 1 1 calc R . .
C67 C 0.1499(5) 0.4788(5) 1.1993(5) 0.087(3) Uani 1 1 d . . .
H67A H 0.0999 0.4652 1.2084 0.131 Uiso 1 1 calc R . .
H67B H 0.1681 0.5093 1.2405 0.131 Uiso 1 1 calc R . .
H67C H 0.1844 0.4444 1.2043 0.131 Uiso 1 1 calc R . .
C68 C 0.3226(5) 0.5074(4) 1.1389(4) 0.074(2) Uani 1 1 d . . .
C69 C 0.3372(6) 0.5096(5) 1.2358(5) 0.100(3) Uani 1 1 d . . .
H69A H 0.3794 0.4832 1.2559 0.150 Uiso 1 1 calc R . .
H69B H 0.2922 0.4962 1.2579 0.150 Uiso 1 1 calc R . .
H69C H 0.3492 0.5510 1.2538 0.150 Uiso 1 1 calc R . .
C70 C 0.3947(4) 0.5299(5) 1.1043(5) 0.084(3) Uani 1 1 d . . .
H70A H 0.3998 0.5735 1.1124 0.126 Uiso 1 1 calc R . .
H70B H 0.3904 0.5206 1.0453 0.126 Uiso 1 1 calc R . .
H70C H 0.4389 0.5096 1.1336 0.126 Uiso 1 1 calc R . .
C71 C 0.3136(6) 0.4397(4) 1.1078(7) 0.098(3) Uani 1 1 d . . .
H71A H 0.3047 0.4391 1.0474 0.146 Uiso 1 1 calc R . .
H71B H 0.2710 0.4211 1.1295 0.146 Uiso 1 1 calc R . .
H71C H 0.3595 0.4173 1.1273 0.146 Uiso 1 1 calc R . .
C72 C 0.2320(6) 0.6315(4) 1.1449(5) 0.085(3) Uani 1 1 d . . .
C73 C 0.1801(6) 0.6733(4) 1.0865(6) 0.103(3) Uani 1 1 d . . .
H73A H 0.1291 0.6568 1.0782 0.154 Uiso 1 1 calc R . .
H73B H 0.1990 0.6760 1.0333 0.154 Uiso 1 1 calc R . .
H73C H 0.1795 0.7135 1.1110 0.154 Uiso 1 1 calc R . .
C74 C 0.2083(6) 0.6285(5) 1.2314(5) 0.102(3) Uani 1 1 d . . .
H74A H 0.2118 0.6688 1.2561 0.153 Uiso 1 1 calc R . .
H74B H 0.2416 0.6009 1.2659 0.153 Uiso 1 1 calc R . .
H74C H 0.1565 0.6141 1.2272 0.153 Uiso 1 1 calc R . .
C75 C 0.3139(6) 0.6585(4) 1.1554(6) 0.102(3) Uani 1 1 d . . .
H75A H 0.3342 0.6553 1.1032 0.154 Uiso 1 1 calc R . .
H75B H 0.3460 0.6361 1.1983 0.154 Uiso 1 1 calc R . .
H75C H 0.3122 0.7010 1.1714 0.154 Uiso 1 1 calc R . .
C1S C 0.9434(18) 0.7045(15) 0.0717(19) 0.50(3) Uiso 1 1 d D . .
H1S1 H 0.9112 0.6690 0.0596 0.744 Uiso 1 1 calc R . .
H1S2 H 0.9836 0.7038 0.0370 0.744 Uiso 1 1 calc R . .
H1S3 H 0.9133 0.7411 0.0602 0.744 Uiso 1 1 calc R . .
C2S C 0.9781(17) 0.7037(15) 0.164(2) 0.51(3) Uiso 1 1 d D . .
H2S1 H 0.9758 0.6624 0.1860 0.607 Uiso 1 1 calc R . .
H2S2 H 1.0314 0.7160 0.1691 0.607 Uiso 1 1 calc R . .
C3S C 0.9344(12) 0.7472(12) 0.2128(17) 0.361(17) Uiso 1 1 d D . .
H3S1 H 0.9335 0.7879 0.1881 0.434 Uiso 1 1 calc R . .
H3S2 H 0.8820 0.7331 0.2112 0.434 Uiso 1 1 calc R . .
C4S C 0.9733(14) 0.7493(15) 0.3023(17) 0.41(2) Uiso 1 1 d D . .
H4S1 H 1.0246 0.7660 0.3045 0.498 Uiso 1 1 calc R . .
H4S2 H 0.9771 0.7082 0.3261 0.498 Uiso 1 1 calc R . .
C5S C 0.9253(16) 0.7902(15) 0.3520(18) 0.43(2) Uiso 1 1 d D . .
H5S1 H 0.8733 0.7747 0.3481 0.518 Uiso 1 1 calc R . .
H5S2 H 0.9236 0.8320 0.3305 0.518 Uiso 1 1 calc R . .
C6S C 0.965(2) 0.7883(19) 0.4439(19) 0.64(4) Uiso 1 1 d D . .
H6S1 H 1.0173 0.8011 0.4461 0.959 Uiso 1 1 calc R . .
H6S2 H 0.9632 0.7472 0.4652 0.959 Uiso 1 1 calc R . .
H6S3 H 0.9389 0.8156 0.4775 0.959 Uiso 1 1 calc R . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Sn Sn -0.6537 1.4246 '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'
Pt Pt -1.7033 8.3905 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
C24 Pt1 C14 141.7(3) . . ?
C24 Pt1 P1 104.7(2) . . ?
C14 Pt1 P1 103.88(19) . . ?
C24 Pt1 Os2 48.67(19) . . ?
C14 Pt1 Os2 109.09(19) . . ?
P1 Pt1 Os2 146.84(5) . . ?
C24 Pt1 Os1 112.78(19) . . ?
C14 Pt1 Os1 48.42(19) . . ?
P1 Pt1 Os1 141.72(5) . . ?
Os2 Pt1 Os1 65.561(9) . . ?
C40 Sn1 Os1 111.53(18) . . ?
C40 Sn1 Os3 107.66(18) . . ?
Os1 Sn1 Os3 131.906(17) . . ?
C40 Sn1 Os2 110.4(2) . . ?
Os1 Sn1 Os2 66.052(11) . . ?
Os3 Sn1 Os2 123.213(17) . . ?
C12 Os1 C11 89.5(3) . . ?
C12 Os1 C13 89.3(4) . . ?
C11 Os1 C13 178.4(3) . . ?
C12 Os1 C14 96.9(3) . . ?
C11 Os1 C14 95.7(3) . . ?
C13 Os1 C14 85.5(3) . . ?
C12 Os1 Sn1 105.5(2) . . ?
C11 Os1 Sn1 96.3(2) . . ?
C13 Os1 Sn1 83.0(2) . . ?
C14 Os1 Sn1 154.6(2) . . ?
C12 Os1 Pt1 139.6(2) . . ?
C11 Os1 Pt1 77.5(2) . . ?
C13 Os1 Pt1 104.1(2) . . ?
C14 Os1 Pt1 47.9(2) . . ?
Sn1 Os1 Pt1 113.740(13) . . ?
C12 Os1 Os2 162.7(2) . . ?
C11 Os1 Os2 89.8(2) . . ?
C13 Os1 Os2 91.0(2) . . ?
C14 Os1 Os2 100.3(2) . . ?
Sn1 Os1 Os2 57.469(11) . . ?
Pt1 Os1 Os2 56.632(8) . . ?
C22 Os2 C23 91.2(3) . . ?
C22 Os2 C21 90.5(3) . . ?
C23 Os2 C21 177.3(3) . . ?
C22 Os2 C24 99.9(3) . . ?
C23 Os2 C24 85.3(3) . . ?
C21 Os2 C24 96.5(3) . . ?
C22 Os2 Pt1 147.2(2) . . ?
C23 Os2 Pt1 93.8(2) . . ?
C21 Os2 Pt1 85.9(2) . . ?
C24 Os2 Pt1 48.4(2) . . ?
C22 Os2 Sn1 98.5(2) . . ?
C23 Os2 Sn1 89.8(2) . . ?
C21 Os2 Sn1 87.9(2) . . ?
C24 Os2 Sn1 161.0(2) . . ?
Pt1 Os2 Sn1 113.924(13) . . ?
C22 Os2 Os1 154.9(2) . . ?
C23 Os2 Os1 87.6(2) . . ?
C21 Os2 Os1 90.0(2) . . ?
C24 Os2 Os1 105.0(2) . . ?
Pt1 Os2 Os1 57.806(8) . . ?
Sn1 Os2 Os1 56.479(11) . . ?
C31 Os3 C32 94.1(3) . . ?
C31 Os3 C33 167.9(3) . . ?
C32 Os3 C33 91.0(3) . . ?
C31 Os3 C46 87.8(3) . . ?
C32 Os3 C46 163.6(3) . . ?
C33 Os3 C46 84.2(3) . . ?
C31 Os3 P2 91.8(2) . . ?
C32 Os3 P2 92.8(2) . . ?
C33 Os3 P2 98.90(19) . . ?
C46 Os3 P2 103.4(2) . . ?
C31 Os3 Sn1 85.1(2) . . ?
C32 Os3 Sn1 85.5(2) . . ?
C33 Os3 Sn1 84.45(19) . . ?
C46 Os3 Sn1 78.5(2) . . ?
P2 Os3 Sn1 176.29(4) . . ?
C72 P1 C68 109.0(4) . . ?
C72 P1 C64 108.0(4) . . ?
C68 P1 C64 105.8(4) . . ?
C72 P1 Pt1 112.1(3) . . ?
C68 P1 Pt1 109.3(2) . . ?
C64 P1 Pt1 112.4(2) . . ?
C56 P2 C52 109.2(7) . . ?
C56 P2 C60 103.1(6) . . ?
C52 P2 C60 106.9(8) . . ?
C56 P2 Os3 113.4(3) . . ?
C52 P2 Os3 114.1(4) . . ?
C60 P2 Os3 109.4(3) . . ?
O11 C11 Os1 176.0(6) . . ?
O12 C12 Os1 178.3(7) . . ?
O13 C13 Os1 177.5(7) . . ?
O14 C14 Pt1 134.5(6) . . ?
O14 C14 Os1 138.9(6) . . ?
Pt1 C14 Os1 83.6(3) . . ?
O21 C21 Os2 176.7(7) . . ?
O22 C22 Os2 178.1(7) . . ?
O23 C23 Os2 175.6(8) . . ?
O24 C24 Pt1 136.4(6) . . ?
O24 C24 Os2 139.0(6) . . ?
Pt1 C24 Os2 82.9(3) . . ?
O33 C31 Os3 175.6(7) . . ?
O34 C32 Os3 172.5(6) . . ?
O35 C33 Os3 176.1(6) . . ?
C41 C40 C45 118.0(7) . . ?
C41 C40 Sn1 122.0(6) . . ?
C45 C40 Sn1 119.9(6) . . ?
C40 C41 C42 121.3(9) . . ?
C43 C42 C41 120.1(10) . . ?
C42 C43 C44 121.1(9) . . ?
C43 C44 C45 118.1(10) . . ?
C40 C45 C44 121.4(10) . . ?
C51 C46 C47 113.2(7) . . ?
C51 C46 Os3 123.7(5) . . ?
C47 C46 Os3 123.0(5) . . ?
C48 C47 C46 122.7(8) . . ?
C49 C48 C47 120.7(10) . . ?
C48 C49 C50 119.5(10) . . ?
C51 C50 C49 119.7(9) . . ?
C50 C51 C46 123.9(8) . . ?
C55 C52 C54 106.9(13) . . ?
C55 C52 C53 112.0(12) . . ?
C54 C52 C53 106.2(13) . . ?
C55 C52 P2 112.4(11) . . ?
C54 C52 P2 114.9(9) . . ?
C53 C52 P2 104.5(10) . . ?
C59 C56 C57 105.6(9) . . ?
C59 C56 C58 110.2(9) . . ?
C57 C56 C58 111.0(10) . . ?
C59 C56 P2 118.5(8) . . ?
C57 C56 P2 112.8(7) . . ?
C58 C56 P2 98.7(7) . . ?
C61 C60 C63 107.4(10) . . ?
C61 C60 C62 113.2(12) . . ?
C63 C60 C62 107.9(11) . . ?
C61 C60 P2 111.7(9) . . ?
C63 C60 P2 112.7(9) . . ?
C62 C60 P2 103.9(8) . . ?
C65 C64 C67 109.4(7) . . ?
C65 C64 C66 105.4(7) . . ?
C67 C64 C66 106.2(7) . . ?
C65 C64 P1 110.0(5) . . ?
C67 C64 P1 116.3(6) . . ?
C66 C64 P1 108.9(6) . . ?
C70 C68 C69 108.9(7) . . ?
C70 C68 C71 103.8(8) . . ?
C69 C68 C71 110.4(8) . . ?
C70 C68 P1 110.2(5) . . ?
C69 C68 P1 114.6(7) . . ?
C71 C68 P1 108.4(5) . . ?
C74 C72 C73 112.0(8) . . ?
C74 C72 C75 106.8(8) . . ?
C73 C72 C75 108.2(8) . . ?
C74 C72 P1 114.9(7) . . ?
C73 C72 P1 106.7(6) . . ?
C75 C72 P1 108.1(6) . . ?
C3S C2S C1S 109.6(10) . . ?
C4S C3S C2S 108.7(9) . . ?
C3S C4S C5S 107.7(9) . . ?
C4S C5S C6S 105.9(9) . . ?
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
Pt1 C24 2.063(7) . ?
Pt1 C14 2.072(8) . ?
Pt1 P1 2.3468(16) . ?
Pt1 Os2 2.7372(3) . ?
Pt1 Os1 2.7736(3) . ?
Sn1 C40 2.170(7) . ?
Sn1 Os1 2.7219(4) . ?
Sn1 Os3 2.7354(5) . ?
Sn1 Os2 2.7526(5) . ?
Os1 C12 1.882(8) . ?
Os1 C11 1.944(7) . ?
Os1 C13 1.943(8) . ?
Os1 C14 2.088(7) . ?
Os1 Os2 2.9839(4) . ?
Os2 C22 1.892(8) . ?
Os2 C23 1.931(7) . ?
Os2 C21 1.948(7) . ?
Os2 C24 2.071(7) . ?
Os3 C31 1.908(7) . ?
Os3 C32 1.923(7) . ?
Os3 C33 1.942(7) . ?
Os3 C46 2.191(7) . ?
Os3 P2 2.5501(17) . ?
P1 C72 1.926(8) . ?
P1 C68 1.936(8) . ?
P1 C64 1.938(8) . ?
P2 C56 1.871(10) . ?
P2 C52 1.879(12) . ?
P2 C60 1.957(12) . ?
O11 C11 1.122(8) . ?
O12 C12 1.144(9) . ?
O13 C13 1.135(9) . ?
O14 C14 1.153(8) . ?
O21 C21 1.126(8) . ?
O22 C22 1.132(8) . ?
O23 C23 1.120(9) . ?
O24 C24 1.170(8) . ?
O33 C31 1.153(8) . ?
O34 C32 1.139(8) . ?
O35 C33 1.129(7) . ?
C40 C41 1.371(11) . ?
C40 C45 1.392(11) . ?
C41 C42 1.373(11) . ?
C42 C43 1.361(15) . ?
C43 C44 1.378(16) . ?
C44 C45 1.394(12) . ?
C46 C51 1.394(10) . ?
C46 C47 1.405(10) . ?
C47 C48 1.392(13) . ?
C48 C49 1.333(16) . ?
C49 C50 1.375(15) . ?
C50 C51 1.372(12) . ?
C52 C55 1.492(19) . ?
C52 C54 1.609(15) . ?
C52 C53 1.71(2) . ?
C56 C59 1.539(13) . ?
C56 C57 1.544(13) . ?
C56 C58 1.801(17) . ?
C60 C61 1.493(13) . ?
C60 C63 1.545(15) . ?
C60 C62 1.700(19) . ?
C64 C65 1.509(11) . ?
C64 C67 1.529(10) . ?
C64 C66 1.567(12) . ?
C68 C70 1.535(11) . ?
C68 C69 1.541(10) . ?
C68 C71 1.555(13) . ?
C72 C74 1.505(11) . ?
C72 C73 1.517(13) . ?
C72 C75 1.546(13) . ?
C1S C2S 1.517(10) . ?
C2S C3S 1.510(10) . ?
C3S C4S 1.503(10) . ?
C4S C5S 1.527(10) . ?
C5S C6S 1.542(10) . ?
