# Electronic Supplementary Material (ESI) for Dalton Transactions.
# This journal is © The Royal Society of Chemistry 2015

####################################################################### 
# 
# 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_riv1492_cmpd_1
_database_code_depnum_ccdc_archive 'CCDC 1416191'
_audit_update_record             
;
2015-07-30 deposited with the CCDC.
2015-09-09 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C26 H27 Cl2 Ge O5 P2 Rh W'
_chemical_formula_sum            'C26 H27 Cl2 Ge O5 P2 Rh W'
_chemical_formula_weight         911.66

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'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ge Ge 0.1547 1.8001 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Rh Rh -1.1178 0.9187 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
W W -0.8490 6.8722 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 21/n'
_space_group_name_Hall           '-P 2yn'

_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. 
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'

_cell_length_a                   8.9888(3)
_cell_length_b                   24.3719(7)
_cell_length_c                   14.4140(4)
_cell_angle_alpha                90
_cell_angle_beta                 104.3064(3)
_cell_angle_gamma                90
_cell_volume                     3059.81(16)
_cell_formula_units_Z            4
_cell_measurement_temperature    173(2)
_cell_measurement_reflns_used    9932
_cell_measurement_theta_min      2.22
_cell_measurement_theta_max      28.24

_exptl_crystal_description       prism
_exptl_crystal_colour            yellow
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.979
_exptl_crystal_F_000             1752
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.265
_exptl_crystal_size_mid          0.140
_exptl_crystal_size_min          0.112
_exptl_absorpt_coefficient_mu    5.572
_shelx_estimated_absorpt_T_min   0.320
_shelx_estimated_absorpt_T_max   0.574
_exptl_absorpt_correction_type   integration
_exptl_absorpt_correction_T_min  0.3265
_exptl_absorpt_correction_T_max  0.6400
_exptl_absorpt_process_details   'SADABS (Sheldrick, 2008)'

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      173(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            28051
_diffrn_reflns_av_unetI/netI     0.0147
_diffrn_reflns_av_R_equivalents  0.0162
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_k_min       -32
_diffrn_reflns_limit_k_max       31
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_theta_min         1.671
_diffrn_reflns_theta_max         28.323
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.982
_diffrn_measured_fraction_theta_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 0.982
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 0.982
_diffrn_reflns_point_group_measured_fraction_full 1.000
_reflns_number_total             7477
_reflns_number_gt                7036
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_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. 
;

_computing_data_collection       'Bruker APEX2'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXT-2013 (Sheldrick, 2013)'
_computing_structure_refinement  'SHELXL-2014 (Sheldrick, 2014)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'

_refine_special_details          
; 
 ? 
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0187P)²+1.4453P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   mixed
_refine_ls_hydrogen_treatment    mixed
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         7477
_refine_ls_number_parameters     351
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0179
_refine_ls_R_factor_gt           0.0160
_refine_ls_wR_factor_ref         0.0379
_refine_ls_wR_factor_gt          0.0374
_refine_ls_goodness_of_fit_ref   1.058
_refine_ls_restrained_S_all      1.058
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

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
W W 0.36822(2) 0.12823(2) 0.16437(2) 0.02180(3) Uani 1 1 d . . . . .
Rh Rh 0.13516(2) 0.30255(2) 0.28510(2) 0.01585(3) Uani 1 1 d . . . . .
Ge Ge 0.16657(2) 0.15116(2) 0.25875(2) 0.01930(4) Uani 1 1 d . . . . .
Cl1 Cl 0.13969(6) 0.08672(2) 0.36485(4) 0.02797(10) Uani 1 1 d . . . . .
Cl2 Cl -0.07605(6) 0.14936(2) 0.17153(4) 0.03530(12) Uani 1 1 d . . . . .
P1 P -0.07223(5) 0.34116(2) 0.18357(3) 0.01967(9) Uani 1 1 d . . . . .
P2 P 0.30321(5) 0.37014(2) 0.27502(3) 0.01838(9) Uani 1 1 d . . . . .
O1 O 0.60382(18) 0.09393(7) 0.04512(11) 0.0356(4) Uani 1 1 d . . . . .
O2 O 0.2221(2) 0.22388(7) 0.02137(12) 0.0482(5) Uani 1 1 d . . . . .
O3 O 0.6077(2) 0.20861(7) 0.29664(13) 0.0429(4) Uani 1 1 d . . . . .
O4 O 0.48562(19) 0.03201(7) 0.31452(12) 0.0384(4) Uani 1 1 d . . . . .
O5 O 0.1146(2) 0.04993(7) 0.03731(13) 0.0484(5) Uani 1 1 d . . . . .
C1 C 0.5194(2) 0.10692(9) 0.08948(14) 0.0276(4) Uani 1 1 d . . . . .
C2 C 0.2774(3) 0.18997(9) 0.07337(15) 0.0304(5) Uani 1 1 d . . . . .
C3 C 0.5218(2) 0.17989(9) 0.24832(15) 0.0286(4) Uani 1 1 d . . . . .
C4 C 0.4453(2) 0.06636(9) 0.26090(15) 0.0262(4) Uani 1 1 d . . . . .
C5 C 0.2059(3) 0.07738(9) 0.08339(15) 0.0301(4) Uani 1 1 d . . . . .
C6 C 0.1525(2) 0.21551(8) 0.33896(13) 0.0210(4) Uani 1 1 d . . . . .
C7 C 0.0156(2) 0.23947(8) 0.35389(14) 0.0248(4) Uani 1 1 d . . . . .
H7 H -0.0910 0.2254 0.3271 0.030 Uiso 1 1 calc R U . . .
C8 C 0.0569(3) 0.28408(9) 0.42025(15) 0.0294(4) Uani 1 1 d . . . . .
H8 H -0.0155 0.3067 0.4469 0.035 Uiso 1 1 calc R U . . .
C9 C 0.2177(3) 0.28890(8) 0.44395(14) 0.0298(5) Uani 1 1 d . . . . .
H9 H 0.2797 0.3153 0.4912 0.036 Uiso 1 1 calc R U . . .
C10 C 0.2779(2) 0.24718(8) 0.39301(14) 0.0239(4) Uani 1 1 d . . . . .
H10 H 0.3892 0.2391 0.4000 0.029 Uiso 1 1 calc R U . . .
C11 C -0.1554(2) 0.40198(8) 0.22531(14) 0.0225(4) Uani 1 1 d . . . . .
C12 C -0.1054(2) 0.41895(8) 0.31985(15) 0.0261(4) Uani 1 1 d . . . . .
H12 H -0.0251 0.3995 0.3624 0.031 Uiso 1 1 calc R U . . .
C13 C -0.1716(3) 0.46409(9) 0.35290(17) 0.0337(5) Uani 1 1 d . . . . .
H13 H -0.1367 0.4755 0.4176 0.040 Uiso 1 1 calc R U . . .
C14 C -0.2895(3) 0.49240(9) 0.2905(2) 0.0382(6) Uani 1 1 d . . . . .
H14 H -0.3348 0.5234 0.3126 0.046 Uiso 1 1 calc R U . . .
C15 C -0.3404(2) 0.47562(9) 0.19708(19) 0.0363(5) Uani 1 1 d . . . . .
H15 H -0.4212 0.4950 0.1549 0.044 Uiso 1 1 calc R U . . .
C16 C -0.2747(2) 0.43056(9) 0.16385(17) 0.0305(5) Uani 1 1 d . . . . .
H16 H -0.3109 0.4191 0.0992 0.037 Uiso 1 1 calc R U . . .
C17 C -0.2338(2) 0.29408(9) 0.15645(17) 0.0303(5) Uani 1 1 d . . . . .
H17A H -0.2692 0.2873 0.2145 0.036 Uiso 1 1 calc R U . . .
H17B H -0.2020 0.2594 0.1330 0.036 Uiso 1 1 calc R U . . .
H17C H -0.3176 0.3102 0.1072 0.036 Uiso 1 1 calc R U . . .
C18 C -0.0541(3) 0.35886(11) 0.06464(15) 0.0352(5) Uani 1 1 d . . . . .
H18A H -0.1563 0.3649 0.0224 0.042 Uiso 1 1 calc R U . . .
H18B H -0.0033 0.3288 0.0393 0.042 Uiso 1 1 calc R U . . .
H18C H 0.0072 0.3924 0.0679 0.042 Uiso 1 1 calc R U . . .
C21 C 0.3128(2) 0.38878(8) 0.15479(13) 0.0207(4) Uani 1 1 d . . . . .
C22 C 0.2751(2) 0.44078(9) 0.11657(15) 0.0288(4) Uani 1 1 d . . . . .
H22 H 0.2506 0.4691 0.1555 0.035 Uiso 1 1 calc R U . . .
C23 C 0.2734(3) 0.45141(10) 0.02159(16) 0.0368(5) Uani 1 1 d . . . . .
H23 H 0.2460 0.4869 -0.0045 0.044 Uiso 1 1 calc R U . . .
C24 C 0.3109(3) 0.41093(11) -0.03473(16) 0.0379(5) Uani 1 1 d . . . . .
H24 H 0.3089 0.4184 -0.0997 0.045 Uiso 1 1 calc R U . . .
C25 C 0.3519(3) 0.35907(10) 0.00278(17) 0.0359(5) Uani 1 1 d . . . . .
H25 H 0.3798 0.3313 -0.0360 0.043 Uiso 1 1 calc R U . . .
C26 C 0.3518(2) 0.34805(9) 0.09687(15) 0.0267(4) Uani 1 1 d . . . . .
H26 H 0.3785 0.3124 0.1223 0.032 Uiso 1 1 calc R U . . .
C27 C 0.4994(2) 0.35081(9) 0.33287(16) 0.0300(4) Uani 1 1 d . . . . .
H27A H 0.5693 0.3803 0.3249 0.036 Uiso 1 1 calc R U . . .
H27B H 0.5262 0.3171 0.3036 0.036 Uiso 1 1 calc R U . . .
H27C H 0.5087 0.3446 0.4012 0.036 Uiso 1 1 calc R U . . .
C28 C 0.2842(3) 0.43443(8) 0.33458(15) 0.0283(4) Uani 1 1 d . . . . .
H28A H 0.3683 0.4591 0.3301 0.034 Uiso 1 1 calc R U . . .
H28B H 0.2883 0.4274 0.4021 0.034 Uiso 1 1 calc R U . . .
H28C H 0.1858 0.4516 0.3037 0.034 Uiso 1 1 calc R U . . .
H1 H 0.170(3) 0.2845(12) 0.192(2) 0.052(8) 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
W C1 2.002(2) . ?
W C2 2.030(2) . ?
W C3 2.032(2) . ?
W C5 2.046(2) . ?
W C4 2.053(2) . ?
W Ge 2.5820(2) . ?
Rh C10 2.2136(19) . ?
Rh C7 2.2424(18) . ?
Rh C9 2.2502(19) . ?
Rh C6 2.2509(18) . ?
Rh P2 2.2638(5) . ?
Rh P1 2.2703(5) . ?
Rh C8 2.2734(19) . ?
Rh H1 1.51(3) . ?
Ge C6 1.9709(19) . ?
Ge Cl2 2.2324(5) . ?
Ge Cl1 2.2464(5) . ?
P1 C18 1.814(2) . ?
P1 C17 1.816(2) . ?
P1 C11 1.828(2) . ?
P2 C21 1.8140(19) . ?
P2 C28 1.815(2) . ?
P2 C27 1.817(2) . ?
O1 C1 1.151(3) . ?
O2 C2 1.144(3) . ?
O3 C3 1.142(3) . ?
O4 C4 1.136(3) . ?
O5 C5 1.137(3) . ?
C6 C7 1.426(3) . ?
C6 C10 1.428(3) . ?
C7 C8 1.435(3) . ?
C8 C9 1.405(3) . ?
C9 C10 1.436(3) . ?
C11 C12 1.388(3) . ?
C11 C16 1.397(3) . ?
C12 C13 1.390(3) . ?
C13 C14 1.391(3) . ?
C14 C15 1.373(4) . ?
C15 C16 1.387(3) . ?
C21 C22 1.390(3) . ?
C21 C26 1.396(3) . ?
C22 C23 1.390(3) . ?
C23 C24 1.372(3) . ?
C24 C25 1.388(3) . ?
C25 C26 1.383(3) . ?

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
C1 W C2 93.55(9) . . ?
C1 W C3 91.71(8) . . ?
C2 W C3 91.78(9) . . ?
C1 W C5 91.07(9) . . ?
C2 W C5 87.95(8) . . ?
C3 W C5 177.21(9) . . ?
C1 W C4 90.83(8) . . ?
C2 W C4 175.49(8) . . ?
C3 W C4 89.18(8) . . ?
C5 W C4 90.88(8) . . ?
C1 W Ge 177.19(6) . . ?
C2 W Ge 87.57(6) . . ?
C3 W Ge 90.83(6) . . ?
C5 W Ge 86.39(6) . . ?
C4 W Ge 88.00(6) . . ?
C10 Rh C7 61.93(7) . . ?
C10 Rh C9 37.52(8) . . ?
C7 Rh C9 61.46(8) . . ?
C10 Rh C6 37.30(7) . . ?
C7 Rh C6 37.01(7) . . ?
C9 Rh C6 62.13(7) . . ?
C10 Rh P2 102.04(5) . . ?
C7 Rh P2 158.06(6) . . ?
C9 Rh P2 96.63(6) . . ?
C6 Rh P2 135.84(5) . . ?
C10 Rh P1 161.21(5) . . ?
C7 Rh P1 99.34(6) . . ?
C9 Rh P1 136.79(6) . . ?
C6 Rh P1 126.07(5) . . ?
P2 Rh P1 96.406(18) . . ?
C10 Rh C8 61.68(8) . . ?
C7 Rh C8 37.05(7) . . ?
C9 Rh C8 36.19(8) . . ?
C6 Rh C8 61.82(7) . . ?
P2 Rh C8 123.48(6) . . ?
P1 Rh C8 104.83(6) . . ?
C10 Rh H1 103.5(11) . . ?
C7 Rh H1 114.7(11) . . ?
C9 Rh H1 140.2(11) . . ?
C6 Rh H1 91.1(11) . . ?
P2 Rh H1 82.4(11) . . ?
P1 Rh H1 82.4(11) . . ?
C8 Rh H1 151.1(11) . . ?
C6 Ge Cl2 98.66(6) . . ?
C6 Ge Cl1 97.10(5) . . ?
Cl2 Ge Cl1 96.62(2) . . ?
C6 Ge W 129.52(6) . . ?
Cl2 Ge W 114.480(18) . . ?
Cl1 Ge W 114.520(15) . . ?
C18 P1 C17 101.58(11) . . ?
C18 P1 C11 104.95(10) . . ?
C17 P1 C11 102.27(9) . . ?
C18 P1 Rh 117.17(8) . . ?
C17 P1 Rh 111.26(7) . . ?
C11 P1 Rh 117.49(6) . . ?
C21 P2 C28 105.54(9) . . ?
C21 P2 C27 103.51(10) . . ?
C28 P2 C27 101.59(10) . . ?
C21 P2 Rh 115.69(6) . . ?
C28 P2 Rh 117.10(7) . . ?
C27 P2 Rh 111.67(7) . . ?
O1 C1 W 178.44(19) . . ?
O2 C2 W 177.9(2) . . ?
O3 C3 W 179.0(2) . . ?
O4 C4 W 178.89(18) . . ?
O5 C5 W 178.7(2) . . ?
C7 C6 C10 106.89(17) . . ?
C7 C6 Ge 126.68(15) . . ?
C10 C6 Ge 126.43(15) . . ?
C7 C6 Rh 71.17(11) . . ?
C10 C6 Rh 69.93(10) . . ?
Ge C6 Rh 123.82(9) . . ?
C6 C7 C8 108.65(18) . . ?
C6 C7 Rh 71.82(10) . . ?
C8 C7 Rh 72.65(11) . . ?
C9 C8 C7 107.87(18) . . ?
C9 C8 Rh 71.01(11) . . ?
C7 C8 Rh 70.30(11) . . ?
C8 C9 C10 108.15(18) . . ?
C8 C9 Rh 72.80(11) . . ?
C10 C9 Rh 69.86(11) . . ?
C6 C10 C9 108.37(18) . . ?
C6 C10 Rh 72.77(11) . . ?
C9 C10 Rh 72.62(11) . . ?
C12 C11 C16 119.04(19) . . ?
C12 C11 P1 120.35(15) . . ?
C16 C11 P1 120.54(16) . . ?
C11 C12 C13 120.7(2) . . ?
C12 C13 C14 119.5(2) . . ?
C15 C14 C13 120.1(2) . . ?
C14 C15 C16 120.5(2) . . ?
C15 C16 C11 120.1(2) . . ?
C22 C21 C26 118.92(19) . . ?
C22 C21 P2 122.86(15) . . ?
C26 C21 P2 118.12(15) . . ?
C23 C22 C21 120.2(2) . . ?
C24 C23 C22 120.3(2) . . ?
C23 C24 C25 120.3(2) . . ?
C26 C25 C24 119.6(2) . . ?
C25 C26 C21 120.6(2) . . ?

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
C1 W Ge C6 175.9(12) . . . . ?
C2 W Ge C6 -70.47(9) . . . . ?
C3 W Ge C6 21.27(9) . . . . ?
C5 W Ge C6 -158.57(9) . . . . ?
C4 W Ge C6 110.42(9) . . . . ?
C1 W Ge Cl2 -57.9(12) . . . . ?
C2 W Ge Cl2 55.69(6) . . . . ?
C3 W Ge Cl2 147.44(6) . . . . ?
C5 W Ge Cl2 -32.40(6) . . . . ?
C4 W Ge Cl2 -123.41(6) . . . . ?
C1 W Ge Cl1 52.4(12) . . . . ?
C2 W Ge Cl1 165.99(6) . . . . ?
C3 W Ge Cl1 -102.27(6) . . . . ?
C5 W Ge Cl1 77.89(6) . . . . ?
C4 W Ge Cl1 -13.12(6) . . . . ?
C10 Rh P1 C18 -135.65(19) . . . . ?
C7 Rh P1 C18 -139.93(11) . . . . ?
C9 Rh P1 C18 162.22(12) . . . . ?
C6 Rh P1 C18 -111.75(11) . . . . ?
P2 Rh P1 C18 55.41(10) . . . . ?
C8 Rh P1 C18 -177.44(11) . . . . ?
C10 Rh P1 C17 -19.43(19) . . . . ?
C7 Rh P1 C17 -23.71(10) . . . . ?
C9 Rh P1 C17 -81.56(11) . . . . ?
C6 Rh P1 C17 4.47(10) . . . . ?
P2 Rh P1 C17 171.62(8) . . . . ?
C8 Rh P1 C17 -61.22(10) . . . . ?
C10 Rh P1 C11 97.92(18) . . . . ?
C7 Rh P1 C11 93.65(9) . . . . ?
C9 Rh P1 C11 35.79(11) . . . . ?
C6 Rh P1 C11 121.83(9) . . . . ?
P2 Rh P1 C11 -71.02(7) . . . . ?
C8 Rh P1 C11 56.13(9) . . . . ?
C10 Rh P2 C21 130.94(9) . . . . ?
C7 Rh P2 C21 171.61(15) . . . . ?
C9 Rh P2 C21 168.60(9) . . . . ?
C6 Rh P2 C21 112.37(10) . . . . ?
P1 Rh P2 C21 -52.69(7) . . . . ?
C8 Rh P2 C21 -165.20(10) . . . . ?
C10 Rh P2 C28 -103.61(10) . . . . ?
C7 Rh P2 C28 -62.93(17) . . . . ?
C9 Rh P2 C28 -65.95(10) . . . . ?
C6 Rh P2 C28 -122.18(11) . . . . ?
P1 Rh P2 C28 72.77(8) . . . . ?
C8 Rh P2 C28 -39.75(11) . . . . ?
C10 Rh P2 C27 12.89(10) . . . . ?
C7 Rh P2 C27 53.57(17) . . . . ?
C9 Rh P2 C27 50.55(10) . . . . ?
C6 Rh P2 C27 -5.68(11) . . . . ?
P1 Rh P2 C27 -170.73(9) . . . . ?
C8 Rh P2 C27 76.75(11) . . . . ?
C1 W C2 O2 115(6) . . . . ?
C3 W C2 O2 -153(6) . . . . ?
C5 W C2 O2 24(6) . . . . ?
C4 W C2 O2 -51(6) . . . . ?
Ge W C2 O2 -63(6) . . . . ?
Cl2 Ge C6 C7 17.42(16) . . . . ?
Cl1 Ge C6 C7 -80.42(16) . . . . ?
W Ge C6 C7 149.41(13) . . . . ?
Cl2 Ge C6 C10 -162.34(15) . . . . ?
Cl1 Ge C6 C10 99.82(16) . . . . ?
W Ge C6 C10 -30.34(19) . . . . ?
Cl2 Ge C6 Rh -73.42(10) . . . . ?
Cl1 Ge C6 Rh -171.26(9) . . . . ?
W Ge C6 Rh 58.58(12) . . . . ?
C10 Rh C6 C7 116.84(17) . . . . ?
C9 Rh C6 C7 78.69(13) . . . . ?
P2 Rh C6 C7 147.77(10) . . . . ?
P1 Rh C6 C7 -50.72(13) . . . . ?
C8 Rh C6 C7 37.49(12) . . . . ?
C7 Rh C6 C10 -116.84(17) . . . . ?
C9 Rh C6 C10 -38.15(12) . . . . ?
P2 Rh C6 C10 30.93(14) . . . . ?
P1 Rh C6 C10 -167.56(10) . . . . ?
C8 Rh C6 C10 -79.35(13) . . . . ?
C10 Rh C6 Ge -121.08(17) . . . . ?
C7 Rh C6 Ge 122.08(17) . . . . ?
C9 Rh C6 Ge -159.23(14) . . . . ?
P2 Rh C6 Ge -90.15(11) . . . . ?
P1 Rh C6 Ge 71.36(12) . . . . ?
C8 Rh C6 Ge 159.57(14) . . . . ?
C10 C6 C7 C8 -2.6(2) . . . . ?
Ge C6 C7 C8 177.59(13) . . . . ?
Rh C6 C7 C8 -63.76(13) . . . . ?
C10 C6 C7 Rh 61.15(13) . . . . ?
Ge C6 C7 Rh -118.64(14) . . . . ?
C10 Rh C7 C6 -37.79(11) . . . . ?
C9 Rh C7 C6 -80.64(13) . . . . ?
P2 Rh C7 C6 -84.05(17) . . . . ?
P1 Rh C7 C6 140.65(10) . . . . ?
C8 Rh C7 C6 -117.07(18) . . . . ?
C10 Rh C7 C8 79.28(13) . . . . ?
C9 Rh C7 C8 36.44(13) . . . . ?
C6 Rh C7 C8 117.07(18) . . . . ?
P2 Rh C7 C8 33.0(2) . . . . ?
P1 Rh C7 C8 -102.28(12) . . . . ?
C6 C7 C8 C9 1.8(2) . . . . ?
Rh C7 C8 C9 -61.40(14) . . . . ?
C6 C7 C8 Rh 63.23(13) . . . . ?
C10 Rh C8 C9 37.88(12) . . . . ?
C7 Rh C8 C9 117.90(18) . . . . ?
C6 Rh C8 C9 80.45(13) . . . . ?
P2 Rh C8 C9 -47.97(14) . . . . ?
P1 Rh C8 C9 -156.24(11) . . . . ?
C10 Rh C8 C7 -80.02(13) . . . . ?
C9 Rh C8 C7 -117.90(18) . . . . ?
C6 Rh C8 C7 -37.45(12) . . . . ?
P2 Rh C8 C7 -165.87(10) . . . . ?
P1 Rh C8 C7 85.86(12) . . . . ?
C7 C8 C9 C10 -0.3(2) . . . . ?
Rh C8 C9 C10 -61.26(13) . . . . ?
C7 C8 C9 Rh 60.95(14) . . . . ?
C10 Rh C9 C8 -117.44(18) . . . . ?
C7 Rh C9 C8 -37.31(12) . . . . ?
C6 Rh C9 C8 -79.52(13) . . . . ?
P2 Rh C9 C8 141.41(11) . . . . ?
P1 Rh C9 C8 34.68(15) . . . . ?
C7 Rh C9 C10 80.14(13) . . . . ?
C6 Rh C9 C10 37.93(11) . . . . ?
P2 Rh C9 C10 -101.14(11) . . . . ?
P1 Rh C9 C10 152.12(10) . . . . ?
C8 Rh C9 C10 117.44(18) . . . . ?
C7 C6 C10 C9 2.4(2) . . . . ?
Ge C6 C10 C9 -177.79(13) . . . . ?
Rh C6 C10 C9 64.38(13) . . . . ?
C7 C6 C10 Rh -61.96(13) . . . . ?
Ge C6 C10 Rh 117.84(14) . . . . ?
C8 C9 C10 C6 -1.3(2) . . . . ?
Rh C9 C10 C6 -64.47(13) . . . . ?
C8 C9 C10 Rh 63.15(14) . . . . ?
C7 Rh C10 C6 37.50(11) . . . . ?
C9 Rh C10 C6 116.28(17) . . . . ?
P2 Rh C10 C6 -158.52(10) . . . . ?
P1 Rh C10 C6 32.7(2) . . . . ?
C8 Rh C10 C6 79.75(12) . . . . ?
C7 Rh C10 C9 -78.79(13) . . . . ?
C6 Rh C10 C9 -116.28(17) . . . . ?
P2 Rh C10 C9 85.19(12) . . . . ?
P1 Rh C10 C9 -83.6(2) . . . . ?
C8 Rh C10 C9 -36.53(12) . . . . ?
C18 P1 C11 C12 -140.54(17) . . . . ?
C17 P1 C11 C12 113.76(17) . . . . ?
Rh P1 C11 C12 -8.34(18) . . . . ?
C18 P1 C11 C16 42.35(19) . . . . ?
C17 P1 C11 C16 -63.36(18) . . . . ?
Rh P1 C11 C16 174.54(14) . . . . ?
C16 C11 C12 C13 -0.7(3) . . . . ?
P1 C11 C12 C13 -177.87(16) . . . . ?
C11 C12 C13 C14 0.2(3) . . . . ?
C12 C13 C14 C15 0.4(3) . . . . ?
C13 C14 C15 C16 -0.3(3) . . . . ?
C14 C15 C16 C11 -0.3(3) . . . . ?
C12 C11 C16 C15 0.8(3) . . . . ?
P1 C11 C16 C15 177.93(16) . . . . ?
C28 P2 C21 C22 -13.39(19) . . . . ?
C27 P2 C21 C22 -119.72(18) . . . . ?
Rh P2 C21 C22 117.79(16) . . . . ?
C28 P2 C21 C26 170.13(16) . . . . ?
C27 P2 C21 C26 63.79(17) . . . . ?
Rh P2 C21 C26 -58.69(17) . . . . ?
C26 C21 C22 C23 1.4(3) . . . . ?
P2 C21 C22 C23 -175.05(17) . . . . ?
C21 C22 C23 C24 -1.0(3) . . . . ?
C22 C23 C24 C25 -0.4(4) . . . . ?
C23 C24 C25 C26 1.3(4) . . . . ?
C24 C25 C26 C21 -0.8(3) . . . . ?
C22 C21 C26 C25 -0.5(3) . . . . ?
P2 C21 C26 C25 176.12(17) . . . . ?

_refine_diff_density_max         1.032
_refine_diff_density_min         -0.480
_refine_diff_density_rms         0.071

_shelxl_version_number           2014-3

####################################################################### 
# 
# 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_riv14d6_cmpd_2
_database_code_depnum_ccdc_archive 'CCDC 1416192'
_audit_update_record             
;
2015-07-30 deposited with the CCDC.
2015-09-09 downloaded from the CCDC.
;

_vrf_CHEMW03_riv14d6             
;
RESPONSE: Attempts to refine peaks of residual electron density as
disordered or partial-occupancy solvent dichloromethane or carbon
atoms were unsuccessful.  The data were corrected for disordered
electron density through use of the SQUEEZE procedure (Sluis, P. van
der; Spek, A. L. Acta Crystallogr. 1990, A46, 194-201) as implemented
in PLATON (Spek, A. L. Acta Crystallogr. 1990, A46, C34; Spek, A. L.
J. Appl. Cryst. 2003, 36, 7-13.  PLATON - a multipurpose
crystallographic tool.  Utrecht University, Utrecht, The Netherlands).
A total solvent-accessible void volume of 225.6 cubic Angstroms with
a total electron count of 43 (consistent with one molecule of solvent
CH2Cl2, or 0.25 moleculeS per formula unit of the metal complex
molecule) was found in the unit cell.
;

_vrf_PLAT041_riv14d6             
;
RESPONSE: See above response to CHEMW03 alert (use of PLATON/SQUEEZE
for disordered solvent).
;

_vrf_PLAT051_riv14d6             
;
RESPONSE: See above response to CHEMW03 alert (use of PLATON/SQUEEZE
for disordered solvent).
;

_vrf_PLAT068_riv14d6             
;
RESPONSE: See above response to CHEMW03 alert (use of PLATON/SQUEEZE
for disordered solvent).
;

_vrf_FORMU01_riv14d6             
;
RESPONSE: See above response to CHEMW03 alert (use of PLATON/SQUEEZE
for disordered solvent).
;

_vrf_CELLZ01_riv14d6             
;
RESPONSE: See above response to CHEMW03 alert (use of PLATON/SQUEEZE
for disordered solvent).
;

_vrf_PLAT605_riv14d6             
;
RESPONSE: See above response to CHEMW03 alert (use of PLATON/SQUEEZE
for disordered solvent).
;

_audit_creation_method           SHELXL-2014/6
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C26 H27 Cl2 O5 P2 Rh Sn W, 0.25(C H2 Cl2)'
_chemical_formula_sum            'C26.25 H27.5 Cl2.5 O5 P2 Rh Sn W'
_chemical_formula_weight         979.00

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.2955 0.4335 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.3639 0.7018 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Rh Rh 0.0927 3.6045 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Sn Sn 0.0259 5.4591 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
W W -5.4734 5.5774 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 21/n'
_space_group_name_Hall           '-P 2yn'

_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. 
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'

_cell_length_a                   15.3972(2)
_cell_length_b                   9.04530(10)
_cell_length_c                   23.3877(3)
_cell_angle_alpha                90
_cell_angle_beta                 90.5374(12)
_cell_angle_gamma                90
_cell_volume                     3257.12(7)
_cell_formula_units_Z            4
_cell_measurement_temperature    173(2)
_cell_measurement_reflns_used    9963
_cell_measurement_theta_min      3.42
_cell_measurement_theta_max      71.94

_exptl_crystal_description       rod
_exptl_crystal_colour            yellow
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.996
_exptl_crystal_F_000             1866
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.270
_exptl_crystal_size_mid          0.022
_exptl_crystal_size_min          0.018
_exptl_absorpt_coefficient_mu    19.583
_shelx_estimated_absorpt_T_min   0.077
_shelx_estimated_absorpt_T_max   0.719
_exptl_absorpt_correction_type   integration
_exptl_absorpt_correction_T_min  0.1190
_exptl_absorpt_correction_T_max  0.8514
_exptl_absorpt_process_details   'SADABS (Sheldrick, 2008)'
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      173(2)
_diffrn_radiation_wavelength     1.54178
_diffrn_radiation_type           CuK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            21691
_diffrn_reflns_av_unetI/netI     0.0544
_diffrn_reflns_av_R_equivalents  0.0781
_diffrn_reflns_limit_h_min       -19
_diffrn_reflns_limit_h_max       18
_diffrn_reflns_limit_k_min       -11
_diffrn_reflns_limit_k_max       11
_diffrn_reflns_limit_l_min       -28
_diffrn_reflns_limit_l_max       28
_diffrn_reflns_theta_min         3.422
_diffrn_reflns_theta_max         72.584
_diffrn_reflns_theta_full        67.679
_diffrn_measured_fraction_theta_max 0.981
_diffrn_measured_fraction_theta_full 0.990
_diffrn_reflns_Laue_measured_fraction_max 0.981
_diffrn_reflns_Laue_measured_fraction_full 0.990
_diffrn_reflns_point_group_measured_fraction_max 0.981
_diffrn_reflns_point_group_measured_fraction_full 0.990
_reflns_number_total             6344
_reflns_number_gt                5092
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_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. 
;

_computing_data_collection       'Bruker APEX2'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'DIRDIF-2008 (Beurskens et al., 2008)'
_computing_structure_refinement  'SHELXL-2014/6 (Sheldrick, 2014)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0403P)²+0.9612P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         6344
_refine_ls_number_parameters     347
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0483
_refine_ls_R_factor_gt           0.0345
_refine_ls_wR_factor_ref         0.0868
_refine_ls_wR_factor_gt          0.0787
_refine_ls_goodness_of_fit_ref   1.031
_refine_ls_restrained_S_all      1.031
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000

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
W W 0.30198(2) 0.01645(3) 0.67328(2) 0.02670(8) Uani 1 1 d . . . . .
Sn Sn 0.24195(2) 0.04340(4) 0.56159(2) 0.02458(9) Uani 1 1 d . . . . .
Rh Rh 0.20964(3) 0.26672(5) 0.49363(2) 0.02316(10) Uani 1 1 d . . . . .
Cl1 Cl 0.10392(10) -0.0923(2) 0.55982(7) 0.0420(4) Uani 1 1 d . . . . .
Cl2 Cl 0.31484(10) -0.15359(16) 0.50697(7) 0.0368(3) Uani 1 1 d . . . . .
P1 P 0.19976(10) 0.12992(18) 0.41171(6) 0.0290(3) Uani 1 1 d . . . . .
P2 P 0.35425(9) 0.31846(16) 0.48818(6) 0.0248(3) Uani 1 1 d . . . . .
O1 O 0.3597(4) -0.0722(7) 0.7978(2) 0.0558(14) Uani 1 1 d . . . . .
O2 O 0.4965(3) 0.0105(6) 0.6315(2) 0.0479(12) Uani 1 1 d . . . . .
O3 O 0.2743(4) -0.3266(6) 0.6482(2) 0.0650(17) Uani 1 1 d . . . . .
O4 O 0.1040(3) 0.0603(7) 0.7083(2) 0.0617(16) Uani 1 1 d . . . . .
O5 O 0.3393(4) 0.3582(5) 0.6910(2) 0.0507(13) Uani 1 1 d . . . . .
C1 C 0.3382(5) -0.0361(8) 0.7526(3) 0.0418(16) Uani 1 1 d . . . . .
C2 C 0.4259(4) 0.0078(7) 0.6461(3) 0.0315(13) Uani 1 1 d . . . . .
C3 C 0.2837(5) -0.2028(7) 0.6574(3) 0.0393(15) Uani 1 1 d . . . . .
C4 C 0.1741(5) 0.0436(8) 0.6974(3) 0.0428(16) Uani 1 1 d . . . . .
C5 C 0.3235(4) 0.2354(7) 0.6847(3) 0.0325(13) Uani 1 1 d . . . . .
C6 C 0.1021(5) 0.3060(8) 0.5560(4) 0.055(2) Uani 1 1 d . . . . .
H6 H 0.0817 0.2367 0.5863 0.066 Uiso 1 1 calc R U . . .
C7 C 0.0690(4) 0.3180(10) 0.4986(4) 0.065(3) Uani 1 1 d . . . . .
H7 H 0.0209 0.2574 0.4816 0.078 Uiso 1 1 calc R U . . .
C8 C 0.1067(5) 0.4407(11) 0.4736(3) 0.059(2) Uani 1 1 d . . . . .
H8 H 0.0924 0.4798 0.4346 0.071 Uiso 1 1 calc R U . . .
C9 C 0.1641(5) 0.5033(8) 0.5114(3) 0.0459(17) Uani 1 1 d . . . . .
H9 H 0.1986 0.5954 0.5048 0.055 Uiso 1 1 calc R U . . .
C10 C 0.1634(4) 0.4188(8) 0.5622(3) 0.0380(15) Uani 1 1 d . . . . .
H10 H 0.1958 0.4433 0.5983 0.046 Uiso 1 1 calc R U . . .
C11 C 0.1543(4) 0.2428(8) 0.3539(2) 0.0375(15) Uani 1 1 d . . . . .
C12 C 0.0656(5) 0.2385(10) 0.3404(3) 0.0493(18) Uani 1 1 d . . . . .
H12 H 0.0287 0.1708 0.3595 0.059 Uiso 1 1 calc R U . . .
C13 C 0.0313(6) 0.3325(12) 0.2993(4) 0.075(3) Uani 1 1 d . . . . .
H13 H -0.0287 0.3269 0.2898 0.090 Uiso 1 1 calc R U . . .
C14 C 0.0827(8) 0.4332(13) 0.2724(4) 0.093(4) Uani 1 1 d . . . . .
H14 H 0.0578 0.5000 0.2456 0.111 Uiso 1 1 calc R U . . .
C15 C 0.1716(8) 0.4385(15) 0.2841(4) 0.101(4) Uani 1 1 d . . . . .
H15 H 0.2079 0.5064 0.2646 0.121 Uiso 1 1 calc R U . . .
C16 C 0.2062(6) 0.3426(11) 0.3249(3) 0.064(3) Uani 1 1 d . . . . .
H16 H 0.2667 0.3455 0.3330 0.077 Uiso 1 1 calc R U . . .
C17 C 0.1286(4) -0.0299(8) 0.4144(3) 0.0421(16) Uani 1 1 d . . . . .
H17A H 0.1199 -0.0690 0.3757 0.051 Uiso 1 1 calc R U . . .
H17B H 0.0725 -0.0007 0.4303 0.051 Uiso 1 1 calc R U . . .
H17C H 0.1551 -0.1062 0.4387 0.051 Uiso 1 1 calc R U . . .
C18 C 0.2957(4) 0.0534(8) 0.3789(3) 0.0400(15) Uani 1 1 d . . . . .
H18A H 0.3215 -0.0210 0.4043 0.048 Uiso 1 1 calc R U . . .
H18B H 0.3379 0.1325 0.3722 0.048 Uiso 1 1 calc R U . . .
H18C H 0.2797 0.0073 0.3424 0.048 Uiso 1 1 calc R U . . .
C21 C 0.3892(4) 0.4104(7) 0.4226(2) 0.0292(12) Uani 1 1 d . . . . .
C22 C 0.4510(4) 0.3491(8) 0.3865(2) 0.0355(14) Uani 1 1 d . . . . .
H22 H 0.4767 0.2566 0.3958 0.043 Uiso 1 1 calc R U . . .
C23 C 0.4748(5) 0.4225(9) 0.3375(3) 0.0486(18) Uani 1 1 d . . . . .
H23 H 0.5159 0.3786 0.3127 0.058 Uiso 1 1 calc R U . . .
C24 C 0.4400(6) 0.5581(10) 0.3239(4) 0.064(2) Uani 1 1 d . . . . .
H24 H 0.4572 0.6076 0.2900 0.076 Uiso 1 1 calc R U . . .
C25 C 0.3801(6) 0.6222(9) 0.3597(3) 0.060(2) Uani 1 1 d . . . . .
H25 H 0.3572 0.7171 0.3509 0.073 Uiso 1 1 calc R U . . .
C26 C 0.3527(5) 0.5476(8) 0.4092(3) 0.0460(17) Uani 1 1 d . . . . .
H26 H 0.3099 0.5901 0.4332 0.055 Uiso 1 1 calc R U . . .
C27 C 0.3866(4) 0.4489(7) 0.5438(3) 0.0367(14) Uani 1 1 d . . . . .
H27A H 0.3694 0.4105 0.5812 0.044 Uiso 1 1 calc R U . . .
H27B H 0.3581 0.5442 0.5370 0.044 Uiso 1 1 calc R U . . .
H27C H 0.4498 0.4621 0.5432 0.044 Uiso 1 1 calc R U . . .
C28 C 0.4349(4) 0.1730(7) 0.4981(3) 0.0366(14) Uani 1 1 d . . . . .
H28A H 0.4244 0.0939 0.4703 0.044 Uiso 1 1 calc R U . . .
H28B H 0.4307 0.1329 0.5369 0.044 Uiso 1 1 calc R U . . .
H28C H 0.4932 0.2139 0.4925 0.044 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
W C1 1.989(6) . ?
W C2 2.019(6) . ?
W C5 2.025(6) . ?
W C3 2.036(7) . ?
W C4 2.068(7) . ?
W Sn 2.7736(4) . ?
Sn Cl1 2.4544(14) . ?
Sn Cl2 2.4685(15) . ?
Sn Rh 2.6152(5) . ?
Rh C7 2.218(6) . ?
Rh C10 2.235(6) . ?
Rh C6 2.245(7) . ?
Rh C8 2.279(7) . ?
Rh P2 2.2800(14) . ?
Rh P1 2.2846(14) . ?
Rh C9 2.291(7) . ?
P1 C18 1.808(6) . ?
P1 C17 1.815(7) . ?
P1 C11 1.829(6) . ?
P2 C27 1.823(6) . ?
P2 C28 1.823(6) . ?
P2 C21 1.830(6) . ?
O1 C1 1.152(8) . ?
O2 C2 1.142(8) . ?
O3 C3 1.150(8) . ?
O4 C4 1.122(8) . ?
O5 C5 1.146(8) . ?
C6 C10 1.397(10) . ?
C6 C7 1.435(12) . ?
C7 C8 1.384(13) . ?
C8 C9 1.367(11) . ?
C9 C10 1.414(10) . ?
C11 C16 1.387(10) . ?
C11 C12 1.399(9) . ?
C12 C13 1.384(11) . ?
C13 C14 1.364(14) . ?
C14 C15 1.394(15) . ?
C15 C16 1.392(12) . ?
C21 C22 1.392(8) . ?
C21 C26 1.396(9) . ?
C22 C23 1.378(9) . ?
C23 C24 1.375(12) . ?
C24 C25 1.379(12) . ?
C25 C26 1.408(9) . ?

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
C1 W C2 91.5(3) . . ?
C1 W C5 93.8(3) . . ?
C2 W C5 85.7(2) . . ?
C1 W C3 88.5(3) . . ?
C2 W C3 91.9(3) . . ?
C5 W C3 176.7(3) . . ?
C1 W C4 91.9(3) . . ?
C2 W C4 174.8(3) . . ?
C5 W C4 90.2(3) . . ?
C3 W C4 92.0(3) . . ?
C1 W Sn 170.8(2) . . ?
C2 W Sn 90.82(16) . . ?
C5 W Sn 95.24(17) . . ?
C3 W Sn 82.48(17) . . ?
C4 W Sn 86.38(18) . . ?
Cl1 Sn Cl2 91.60(6) . . ?
Cl1 Sn Rh 102.50(4) . . ?
Cl2 Sn Rh 109.14(4) . . ?
Cl1 Sn W 104.64(4) . . ?
Cl2 Sn W 105.95(4) . . ?
Rh Sn W 134.438(17) . . ?
C7 Rh C10 61.1(3) . . ?
C7 Rh C6 37.5(3) . . ?
C10 Rh C6 36.3(3) . . ?
C7 Rh C8 35.8(3) . . ?
C10 Rh C8 59.8(3) . . ?
C6 Rh C8 60.5(3) . . ?
C7 Rh P2 156.1(3) . . ?
C10 Rh P2 103.38(19) . . ?
C6 Rh P2 136.9(2) . . ?
C8 Rh P2 121.6(3) . . ?
C7 Rh P1 95.7(2) . . ?
C10 Rh P1 156.39(18) . . ?
C6 Rh P1 125.9(2) . . ?
C8 Rh P1 99.3(2) . . ?
P2 Rh P1 96.99(5) . . ?
C7 Rh C9 59.7(3) . . ?
C10 Rh C9 36.4(2) . . ?
C6 Rh C9 60.4(3) . . ?
C8 Rh C9 34.8(3) . . ?
P2 Rh C9 96.8(2) . . ?
P1 Rh C9 129.8(2) . . ?
C7 Rh Sn 108.1(3) . . ?
C10 Rh Sn 95.69(18) . . ?
C6 Rh Sn 82.2(2) . . ?
C8 Rh Sn 141.8(2) . . ?
P2 Rh Sn 90.70(4) . . ?
P1 Rh Sn 95.86(4) . . ?
C9 Rh Sn 131.94(19) . . ?
C18 P1 C17 101.9(3) . . ?
C18 P1 C11 102.0(3) . . ?
C17 P1 C11 104.1(3) . . ?
C18 P1 Rh 121.0(2) . . ?
C17 P1 Rh 116.0(2) . . ?
C11 P1 Rh 109.9(2) . . ?
C27 P2 C28 101.2(3) . . ?
C27 P2 C21 102.9(3) . . ?
C28 P2 C21 103.3(3) . . ?
C27 P2 Rh 110.7(2) . . ?
C28 P2 Rh 120.6(2) . . ?
C21 P2 Rh 115.77(19) . . ?
O1 C1 W 177.3(7) . . ?
O2 C2 W 176.4(6) . . ?
O3 C3 W 179.3(8) . . ?
O4 C4 W 177.2(6) . . ?
O5 C5 W 177.2(6) . . ?
C10 C6 C7 106.0(7) . . ?
C10 C6 Rh 71.4(4) . . ?
C7 C6 Rh 70.2(4) . . ?
C8 C7 C6 108.0(6) . . ?
C8 C7 Rh 74.5(4) . . ?
C6 C7 Rh 72.3(4) . . ?
C9 C8 C7 109.3(7) . . ?
C9 C8 Rh 73.1(4) . . ?
C7 C8 Rh 69.7(4) . . ?
C8 C9 C10 108.0(7) . . ?
C8 C9 Rh 72.1(4) . . ?
C10 C9 Rh 69.7(4) . . ?
C6 C10 C9 108.5(7) . . ?
C6 C10 Rh 72.2(4) . . ?
C9 C10 Rh 74.0(4) . . ?
C16 C11 C12 118.3(7) . . ?
C16 C11 P1 120.4(5) . . ?
C12 C11 P1 121.2(6) . . ?
C13 C12 C11 120.3(8) . . ?
C14 C13 C12 120.8(9) . . ?
C13 C14 C15 120.3(9) . . ?
C16 C15 C14 118.8(10) . . ?
C11 C16 C15 121.5(8) . . ?
C22 C21 C26 119.6(6) . . ?
C22 C21 P2 122.3(5) . . ?
C26 C21 P2 118.1(5) . . ?
C23 C22 C21 120.1(7) . . ?
C24 C23 C22 121.0(7) . . ?
C23 C24 C25 119.8(7) . . ?
C24 C25 C26 120.3(8) . . ?
C21 C26 C25 119.2(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
C1 W Sn Cl1 40.2(13) . . . . ?
C2 W Sn Cl1 145.00(18) . . . . ?
C5 W Sn Cl1 -129.20(18) . . . . ?
C3 W Sn Cl1 53.2(2) . . . . ?
C4 W Sn Cl1 -39.4(2) . . . . ?
C1 W Sn Cl2 -55.8(13) . . . . ?
C2 W Sn Cl2 48.99(17) . . . . ?
C5 W Sn Cl2 134.79(18) . . . . ?
C3 W Sn Cl2 -42.8(2) . . . . ?
C4 W Sn Cl2 -135.4(2) . . . . ?
C1 W Sn Rh 164.9(13) . . . . ?
C2 W Sn Rh -90.28(17) . . . . ?
C5 W Sn Rh -4.48(18) . . . . ?
C3 W Sn Rh 177.9(2) . . . . ?
C4 W Sn Rh 85.4(2) . . . . ?
Cl1 Sn Rh C7 29.6(2) . . . . ?
Cl2 Sn Rh C7 125.8(2) . . . . ?
W Sn Rh C7 -95.8(2) . . . . ?
Cl1 Sn Rh C10 91.01(19) . . . . ?
Cl2 Sn Rh C10 -172.83(19) . . . . ?
W Sn Rh C10 -34.44(18) . . . . ?
Cl1 Sn Rh C6 57.2(2) . . . . ?
Cl2 Sn Rh C6 153.3(2) . . . . ?
W Sn Rh C6 -68.3(2) . . . . ?
Cl1 Sn Rh C8 44.7(4) . . . . ?
Cl2 Sn Rh C8 140.9(4) . . . . ?
W Sn Rh C8 -80.7(4) . . . . ?
Cl1 Sn Rh P2 -165.47(6) . . . . ?
Cl2 Sn Rh P2 -69.31(5) . . . . ?
W Sn Rh P2 69.08(4) . . . . ?
Cl1 Sn Rh P1 -68.37(6) . . . . ?
Cl2 Sn Rh P1 27.79(6) . . . . ?
W Sn Rh P1 166.18(4) . . . . ?
Cl1 Sn Rh C9 94.7(3) . . . . ?
Cl2 Sn Rh C9 -169.1(3) . . . . ?
W Sn Rh C9 -30.7(3) . . . . ?
C7 Rh P1 C18 177.6(4) . . . . ?
C10 Rh P1 C18 167.5(5) . . . . ?
C6 Rh P1 C18 -158.2(4) . . . . ?
C8 Rh P1 C18 141.6(4) . . . . ?
P2 Rh P1 C18 17.9(3) . . . . ?
C9 Rh P1 C18 122.8(4) . . . . ?
Sn Rh P1 C18 -73.5(3) . . . . ?
C7 Rh P1 C17 -58.4(4) . . . . ?
C10 Rh P1 C17 -68.5(6) . . . . ?
C6 Rh P1 C17 -34.2(4) . . . . ?
C8 Rh P1 C17 -94.4(4) . . . . ?
P2 Rh P1 C17 141.9(3) . . . . ?
C9 Rh P1 C17 -113.2(4) . . . . ?
Sn Rh P1 C17 50.4(3) . . . . ?
C7 Rh P1 C11 59.2(4) . . . . ?
C10 Rh P1 C11 49.1(5) . . . . ?
C6 Rh P1 C11 83.4(4) . . . . ?
C8 Rh P1 C11 23.2(4) . . . . ?
P2 Rh P1 C11 -100.5(2) . . . . ?
C9 Rh P1 C11 4.4(4) . . . . ?
Sn Rh P1 C11 168.1(2) . . . . ?
C7 Rh P2 C27 51.6(7) . . . . ?
C10 Rh P2 C27 5.3(3) . . . . ?
C6 Rh P2 C27 -11.4(4) . . . . ?
C8 Rh P2 C27 67.8(3) . . . . ?
P1 Rh P2 C27 173.2(2) . . . . ?
C9 Rh P2 C27 41.7(3) . . . . ?
Sn Rh P2 C27 -90.8(2) . . . . ?
C7 Rh P2 C28 169.4(7) . . . . ?
C10 Rh P2 C28 123.0(3) . . . . ?
C6 Rh P2 C28 106.3(4) . . . . ?
C8 Rh P2 C28 -174.4(3) . . . . ?
P1 Rh P2 C28 -69.0(3) . . . . ?
C9 Rh P2 C28 159.4(3) . . . . ?
Sn Rh P2 C28 27.0(3) . . . . ?
C7 Rh P2 C21 -65.0(7) . . . . ?
C10 Rh P2 C21 -111.4(3) . . . . ?
C6 Rh P2 C21 -128.0(4) . . . . ?
C8 Rh P2 C21 -48.8(3) . . . . ?
P1 Rh P2 C21 56.6(2) . . . . ?
C9 Rh P2 C21 -75.0(3) . . . . ?
Sn Rh P2 C21 152.6(2) . . . . ?
C1 W C2 O2 -88(9) . . . . ?
C5 W C2 O2 6(9) . . . . ?
C3 W C2 O2 -177(100) . . . . ?
C4 W C2 O2 44(10) . . . . ?
Sn W C2 O2 101(9) . . . . ?
C7 Rh C6 C10 -115.5(7) . . . . ?
C8 Rh C6 C10 -78.0(5) . . . . ?
P2 Rh C6 C10 28.1(6) . . . . ?
P1 Rh C6 C10 -157.6(4) . . . . ?
C9 Rh C6 C10 -37.8(4) . . . . ?
Sn Rh C6 C10 110.7(5) . . . . ?
C10 Rh C6 C7 115.5(7) . . . . ?
C8 Rh C6 C7 37.5(5) . . . . ?
P2 Rh C6 C7 143.6(5) . . . . ?
P1 Rh C6 C7 -42.1(6) . . . . ?
C9 Rh C6 C7 77.7(5) . . . . ?
Sn Rh C6 C7 -133.8(5) . . . . ?
C10 C6 C7 C8 -3.6(8) . . . . ?
Rh C6 C7 C8 -66.5(5) . . . . ?
C10 C6 C7 Rh 62.9(5) . . . . ?
C10 Rh C7 C8 77.5(5) . . . . ?
C6 Rh C7 C8 115.2(6) . . . . ?
P2 Rh C7 C8 23.9(9) . . . . ?
P1 Rh C7 C8 -97.9(5) . . . . ?
C9 Rh C7 C8 35.4(4) . . . . ?
Sn Rh C7 C8 164.0(4) . . . . ?
C10 Rh C7 C6 -37.7(4) . . . . ?
C8 Rh C7 C6 -115.2(6) . . . . ?
P2 Rh C7 C6 -91.3(9) . . . . ?
P1 Rh C7 C6 146.9(5) . . . . ?
C9 Rh C7 C6 -79.7(5) . . . . ?
Sn Rh C7 C6 48.8(5) . . . . ?
C6 C7 C8 C9 2.3(8) . . . . ?
Rh C7 C8 C9 -62.7(5) . . . . ?
C6 C7 C8 Rh 65.0(5) . . . . ?
C7 Rh C8 C9 118.8(7) . . . . ?
C10 Rh C8 C9 37.4(5) . . . . ?
C6 Rh C8 C9 79.5(5) . . . . ?
P2 Rh C8 C9 -50.1(5) . . . . ?
P1 Rh C8 C9 -154.3(5) . . . . ?
Sn Rh C8 C9 93.7(6) . . . . ?
C10 Rh C8 C7 -81.4(5) . . . . ?
C6 Rh C8 C7 -39.3(5) . . . . ?
P2 Rh C8 C7 -168.9(4) . . . . ?
P1 Rh C8 C7 86.9(5) . . . . ?
C9 Rh C8 C7 -118.8(7) . . . . ?
Sn Rh C8 C7 -25.1(7) . . . . ?
C7 C8 C9 C10 -0.1(8) . . . . ?
Rh C8 C9 C10 -60.7(5) . . . . ?
C7 C8 C9 Rh 60.6(5) . . . . ?
C7 Rh C9 C8 -36.5(5) . . . . ?
C10 Rh C9 C8 -117.8(7) . . . . ?
C6 Rh C9 C8 -80.0(6) . . . . ?
P2 Rh C9 C8 138.9(5) . . . . ?
P1 Rh C9 C8 33.9(6) . . . . ?
Sn Rh C9 C8 -124.0(5) . . . . ?
C7 Rh C9 C10 81.3(5) . . . . ?
C6 Rh C9 C10 37.8(4) . . . . ?
C8 Rh C9 C10 117.8(7) . . . . ?
P2 Rh C9 C10 -103.3(4) . . . . ?
P1 Rh C9 C10 151.7(3) . . . . ?
Sn Rh C9 C10 -6.2(6) . . . . ?
C7 C6 C10 C9 3.5(7) . . . . ?
Rh C6 C10 C9 65.6(5) . . . . ?
C7 C6 C10 Rh -62.1(4) . . . . ?
C8 C9 C10 C6 -2.2(8) . . . . ?
Rh C9 C10 C6 -64.5(5) . . . . ?
C8 C9 C10 Rh 62.3(5) . . . . ?
C7 Rh C10 C6 38.9(5) . . . . ?
C8 Rh C10 C6 80.3(5) . . . . ?
P2 Rh C10 C6 -160.7(5) . . . . ?
P1 Rh C10 C6 50.3(8) . . . . ?
C9 Rh C10 C6 116.0(7) . . . . ?
Sn Rh C10 C6 -68.6(5) . . . . ?
C7 Rh C10 C9 -77.1(5) . . . . ?
C6 Rh C10 C9 -116.0(7) . . . . ?
C8 Rh C10 C9 -35.7(5) . . . . ?
P2 Rh C10 C9 83.3(4) . . . . ?
P1 Rh C10 C9 -65.7(7) . . . . ?
Sn Rh C10 C9 175.4(4) . . . . ?
C18 P1 C11 C16 -50.1(7) . . . . ?
C17 P1 C11 C16 -155.8(6) . . . . ?
Rh P1 C11 C16 79.4(6) . . . . ?
C18 P1 C11 C12 134.4(6) . . . . ?
C17 P1 C11 C12 28.7(6) . . . . ?
Rh P1 C11 C12 -96.1(6) . . . . ?
C16 C11 C12 C13 -0.3(12) . . . . ?
P1 C11 C12 C13 175.3(7) . . . . ?
C11 C12 C13 C14 -1.7(15) . . . . ?
C12 C13 C14 C15 2.8(18) . . . . ?
C13 C14 C15 C16 -2(2) . . . . ?
C12 C11 C16 C15 1.2(13) . . . . ?
P1 C11 C16 C15 -174.4(8) . . . . ?
C14 C15 C16 C11 -0.1(18) . . . . ?
C27 P2 C21 C22 118.0(5) . . . . ?
C28 P2 C21 C22 12.9(6) . . . . ?
Rh P2 C21 C22 -121.1(5) . . . . ?
C27 P2 C21 C26 -61.2(6) . . . . ?
C28 P2 C21 C26 -166.3(5) . . . . ?
Rh P2 C21 C26 59.7(6) . . . . ?
C26 C21 C22 C23 -1.1(10) . . . . ?
P2 C21 C22 C23 179.7(5) . . . . ?
C21 C22 C23 C24 1.6(11) . . . . ?
C22 C23 C24 C25 -0.2(13) . . . . ?
C23 C24 C25 C26 -1.7(14) . . . . ?
C22 C21 C26 C25 -0.8(11) . . . . ?
P2 C21 C26 C25 178.5(6) . . . . ?
C24 C25 C26 C21 2.2(13) . . . . ?

_refine_diff_density_max         1.130
_refine_diff_density_min         -1.373
_refine_diff_density_rms         0.145

_shelxl_version_number           2014/6


####################################################################### 
# 
# 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_riv14g2_cmpd_3
_database_code_depnum_ccdc_archive 'CCDC 1416193'
_audit_update_record             
;
2015-07-30 deposited with the CCDC.
2015-09-09 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014/6
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C21 H27 Cl2 P2 Pb Rh'
_chemical_formula_sum            'C21 H27 Cl2 P2 Pb Rh'
_chemical_formula_weight         722.36

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'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Rh Rh -1.1178 0.9187 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Pb Pb -3.3944 10.1111 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 21/n'
_space_group_name_Hall           '-P 2yn'

_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. 
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'

_cell_length_a                   17.346(5)
_cell_length_b                   15.351(4)
_cell_length_c                   18.164(5)
_cell_angle_alpha                90
_cell_angle_beta                 95.470(3)
_cell_angle_gamma                90
_cell_volume                     4814(2)
_cell_formula_units_Z            8
_cell_measurement_temperature    173(2)
_cell_measurement_reflns_used    9990
_cell_measurement_theta_min      2.25
_cell_measurement_theta_max      26.65

_exptl_crystal_description       prism
_exptl_crystal_colour            orange
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.993
_exptl_crystal_F_000             2752
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.095
_exptl_crystal_size_mid          0.079
_exptl_crystal_size_min          0.073
_exptl_absorpt_coefficient_mu    8.030
_shelx_estimated_absorpt_T_min   0.516
_shelx_estimated_absorpt_T_max   0.592
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_correction_T_min  0.5292
_exptl_absorpt_correction_T_max  0.7619
_exptl_absorpt_process_details   'SADABS-2014/4 (Sheldrick, 2014)'
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      173(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            41795
_diffrn_reflns_av_unetI/netI     0.0485
_diffrn_reflns_av_R_equivalents  0.0573
_diffrn_reflns_limit_h_min       -22
_diffrn_reflns_limit_h_max       22
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_l_min       -23
_diffrn_reflns_limit_l_max       23
_diffrn_reflns_theta_min         1.551
_diffrn_reflns_theta_max         27.758
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.975
_diffrn_measured_fraction_theta_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.975
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.975
_diffrn_reflns_point_group_measured_fraction_full 0.999
_reflns_number_total             11064
_reflns_number_gt                8280
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_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. 
;

_computing_data_collection       'Bruker APEX2'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXT-2014 (Sheldrick 2014)'
_computing_structure_refinement  'SHELXL-2014/6 (Sheldrick, 2014)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0316P)²] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         11064
_refine_ls_number_parameters     495
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0609
_refine_ls_R_factor_gt           0.0364
_refine_ls_wR_factor_ref         0.0816
_refine_ls_wR_factor_gt          0.0737
_refine_ls_goodness_of_fit_ref   1.120
_refine_ls_restrained_S_all      1.120
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000

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
Pb1A Pb 0.32727(2) 0.63892(2) 0.77288(2) 0.02563(6) Uani 1 1 d . . . . .
Rh1A Rh 0.21779(2) 0.65854(3) 0.87209(2) 0.01933(9) Uani 1 1 d . . . . .
Cl1A Cl 0.42278(9) 0.76547(10) 0.81769(9) 0.0392(4) Uani 1 1 d . . . . .
Cl2A Cl 0.26088(10) 0.72343(11) 0.65627(8) 0.0453(4) Uani 1 1 d . . . . .
P1A P 0.29500(8) 0.57296(9) 0.94942(8) 0.0243(3) Uani 1 1 d . . . . .
P2A P 0.14952(8) 0.55307(9) 0.80686(8) 0.0243(3) Uani 1 1 d . . . . .
C1A C 0.2167(4) 0.8002(4) 0.8427(4) 0.0395(16) Uani 1 1 d . . . . .
H1A H 0.2422 0.8272 0.8013 0.047 Uiso 1 1 calc R U . . .
C2A C 0.1406(4) 0.7722(4) 0.8396(3) 0.0378(16) Uani 1 1 d . . . . .
H2A H 0.1024 0.7747 0.7948 0.045 Uiso 1 1 calc R U . . .
C3A C 0.1233(3) 0.7501(4) 0.9103(4) 0.0362(15) Uani 1 1 d . . . . .
H3A H 0.0714 0.7316 0.9244 0.043 Uiso 1 1 calc R U . . .
C4A C 0.1894(4) 0.7598(4) 0.9582(3) 0.0389(16) Uani 1 1 d . . . . .
H4A H 0.1936 0.7512 1.0130 0.047 Uiso 1 1 calc R U . . .
C5A C 0.2499(3) 0.7895(4) 0.9157(4) 0.0426(17) Uani 1 1 d . . . . .
H5A H 0.3028 0.8088 0.9358 0.051 Uiso 1 1 calc R U . . .
C11A C 0.3665(3) 0.5006(4) 0.9133(3) 0.0263(12) Uani 1 1 d . . . . .
C12A C 0.3507(3) 0.4134(4) 0.8994(3) 0.0319(14) Uani 1 1 d . . . . .
H12A H 0.3031 0.3893 0.9115 0.038 Uiso 1 1 calc R U . . .
C13A C 0.4038(4) 0.3607(4) 0.8677(4) 0.0449(17) Uani 1 1 d . . . . .
H13A H 0.3925 0.3008 0.8591 0.054 Uiso 1 1 calc R U . . .
C14A C 0.4728(4) 0.3949(5) 0.8488(3) 0.0457(18) Uani 1 1 d . . . . .
H14A H 0.5086 0.3592 0.8263 0.055 Uiso 1 1 calc R U . . .
C15A C 0.4890(4) 0.4814(5) 0.8630(3) 0.0438(17) Uani 1 1 d . . . . .
H15A H 0.5368 0.5050 0.8507 0.053 Uiso 1 1 calc R U . . .
C16A C 0.4367(3) 0.5345(4) 0.8948(3) 0.0336(14) Uani 1 1 d . . . . .
H16A H 0.4488 0.5941 0.9041 0.040 Uiso 1 1 calc R U . . .
C17A C 0.3571(4) 0.6370(4) 1.0157(3) 0.0388(15) Uani 1 1 d . . . . .
H17A H 0.3858 0.6800 0.9892 0.047 Uiso 1 1 calc R U . . .
H17B H 0.3938 0.5983 1.0441 0.047 Uiso 1 1 calc R U . . .
H17C H 0.3252 0.6671 1.0495 0.047 Uiso 1 1 calc R U . . .
C18A C 0.2448(4) 0.5031(4) 1.0104(3) 0.0412(16) Uani 1 1 d . . . . .
H18A H 0.2108 0.4629 0.9807 0.049 Uiso 1 1 calc R U . . .
H18B H 0.2138 0.5390 1.0411 0.049 Uiso 1 1 calc R U . . .
H18C H 0.2828 0.4697 1.0424 0.049 Uiso 1 1 calc R U . . .
C21A C 0.0788(3) 0.4927(3) 0.8562(3) 0.0248(12) Uani 1 1 d . . . . .
C22A C 0.0830(4) 0.4040(4) 0.8678(4) 0.0402(16) Uani 1 1 d . . . . .
H22A H 0.1259 0.3721 0.8532 0.048 Uiso 1 1 calc R U . . .
C23A C 0.0247(4) 0.3608(4) 0.9011(4) 0.053(2) Uani 1 1 d . . . . .
H23A H 0.0280 0.2997 0.9088 0.064 Uiso 1 1 calc R U . . .
C24A C -0.0381(4) 0.4067(5) 0.9229(3) 0.0490(19) Uani 1 1 d . . . . .
H24A H -0.0778 0.3774 0.9457 0.059 Uiso 1 1 calc R U . . .
C25A C -0.0422(4) 0.4950(5) 0.9111(3) 0.0442(17) Uani 1 1 d . . . . .
H25A H -0.0853 0.5269 0.9254 0.053 Uiso 1 1 calc R U . . .
C26A C 0.0157(3) 0.5376(4) 0.8788(3) 0.0342(14) Uani 1 1 d . . . . .
H26A H 0.0124 0.5989 0.8718 0.041 Uiso 1 1 calc R U . . .
C27A C 0.0886(3) 0.5981(4) 0.7285(3) 0.0335(14) Uani 1 1 d . . . . .
H27A H 0.0493 0.6363 0.7467 0.040 Uiso 1 1 calc R U . . .
H27B H 0.0631 0.5506 0.6996 0.040 Uiso 1 1 calc R U . . .
H27C H 0.1207 0.6317 0.6972 0.040 Uiso 1 1 calc R U . . .
C28A C 0.1979(4) 0.4668(4) 0.7599(4) 0.0429(17) Uani 1 1 d . . . . .
H28A H 0.2340 0.4360 0.7957 0.052 Uiso 1 1 calc R U . . .
H28B H 0.2264 0.4922 0.7211 0.052 Uiso 1 1 calc R U . . .
H28C H 0.1592 0.4256 0.7377 0.052 Uiso 1 1 calc R U . . .
Pb1B Pb 0.32948(2) 0.63106(2) 0.26274(2) 0.02521(6) Uani 1 1 d . . . . .
Rh1B Rh 0.24435(2) 0.65442(3) 0.38162(2) 0.02032(9) Uani 1 1 d . . . . .
Cl1B Cl 0.42831(8) 0.76132(10) 0.29184(9) 0.0398(4) Uani 1 1 d . . . . .
Cl2B Cl 0.23347(10) 0.70793(13) 0.16065(8) 0.0503(5) Uani 1 1 d . . . . .
P1B P 0.33853(8) 0.57839(9) 0.44954(8) 0.0239(3) Uani 1 1 d . . . . .
P2B P 0.16859(8) 0.54234(9) 0.33658(8) 0.0235(3) Uani 1 1 d . . . . .
C1B C 0.2362(5) 0.7942(4) 0.3449(4) 0.0491(19) Uani 1 1 d . . . . .
H1B H 0.2559 0.8181 0.2990 0.059 Uiso 1 1 calc R U . . .
C2B C 0.1628(4) 0.7647(4) 0.3505(4) 0.0495(19) Uani 1 1 d . . . . .
H2B H 0.1199 0.7638 0.3097 0.059 Uiso 1 1 calc R U . . .
C3B C 0.1553(5) 0.7454(4) 0.4257(5) 0.063(3) Uani 1 1 d . . . . .
H3B H 0.1067 0.7275 0.4471 0.076 Uiso 1 1 calc R U . . .
C4B C 0.2264(5) 0.7611(4) 0.4648(4) 0.059(2) Uani 1 1 d . . . . .
H4B H 0.2385 0.7572 0.5197 0.070 Uiso 1 1 calc R U . . .
C5B C 0.2781(4) 0.7883(4) 0.4131(4) 0.0482(18) Uani 1 1 d . . . . .
H5B H 0.3322 0.8096 0.4254 0.058 Uiso 1 1 calc R U . . .
C11B C 0.3978(3) 0.5020(4) 0.4019(3) 0.0247(12) Uani 1 1 d . . . . .
C12B C 0.3759(3) 0.4157(4) 0.3912(3) 0.0300(13) Uani 1 1 d . . . . .
H12B H 0.3314 0.3946 0.4122 0.036 Uiso 1 1 calc R U . . .
C13B C 0.4177(4) 0.3597(4) 0.3506(4) 0.0399(16) Uani 1 1 d . . . . .
H13B H 0.4019 0.3007 0.3440 0.048 Uiso 1 1 calc R U . . .
C14B C 0.4822(3) 0.3894(4) 0.3196(3) 0.0395(16) Uani 1 1 d . . . . .
H14B H 0.5105 0.3515 0.2909 0.047 Uiso 1 1 calc R U . . .
C15B C 0.5056(3) 0.4755(4) 0.3308(3) 0.0372(15) Uani 1 1 d . . . . .
H15B H 0.5509 0.4960 0.3108 0.045 Uiso 1 1 calc R U . . .
C16B C 0.4635(3) 0.5309(4) 0.3705(3) 0.0309(13) Uani 1 1 d . . . . .
H16B H 0.4793 0.5899 0.3767 0.037 Uiso 1 1 calc R U . . .
C17B C 0.4105(3) 0.6513(4) 0.4968(3) 0.0385(15) Uani 1 1 d . . . . .
H17D H 0.4300 0.6913 0.4608 0.046 Uiso 1 1 calc R U . . .
H17E H 0.4536 0.6169 0.5204 0.046 Uiso 1 1 calc R U . . .
H17F H 0.3865 0.6848 0.5345 0.046 Uiso 1 1 calc R U . . .
C18B C 0.3113(3) 0.5142(4) 0.5274(3) 0.0358(15) Uani 1 1 d . . . . .
H18D H 0.2742 0.4690 0.5094 0.043 Uiso 1 1 calc R U . . .
H18E H 0.2874 0.5523 0.5621 0.043 Uiso 1 1 calc R U . . .
H18F H 0.3575 0.4867 0.5526 0.043 Uiso 1 1 calc R U . . .
C21B C 0.1271(3) 0.4731(4) 0.4050(3) 0.0284(13) Uani 1 1 d . . . . .
C22B C 0.0951(4) 0.3926(4) 0.3868(4) 0.0417(16) Uani 1 1 d . . . . .
H22B H 0.0980 0.3697 0.3385 0.050 Uiso 1 1 calc R U . . .
C23B C 0.0586(4) 0.3447(4) 0.4384(4) 0.0520(19) Uani 1 1 d . . . . .
H23B H 0.0364 0.2897 0.4251 0.062 Uiso 1 1 calc R U . . .
C24B C 0.0543(4) 0.3762(5) 0.5079(4) 0.0497(19) Uani 1 1 d . . . . .
H24B H 0.0293 0.3432 0.5429 0.060 Uiso 1 1 calc R U . . .
C25B C 0.0862(4) 0.4552(5) 0.5272(4) 0.0440(17) Uani 1 1 d . . . . .
H25B H 0.0843 0.4764 0.5762 0.053 Uiso 1 1 calc R U . . .
C26B C 0.1214(3) 0.5050(4) 0.4758(3) 0.0347(14) Uani 1 1 d . . . . .
H26B H 0.1415 0.5610 0.4891 0.042 Uiso 1 1 calc R U . . .
C27B C 0.0824(3) 0.5814(4) 0.2819(3) 0.0373(15) Uani 1 1 d . . . . .
H27D H 0.0975 0.6170 0.2409 0.045 Uiso 1 1 calc R U . . .
H27E H 0.0515 0.6167 0.3131 0.045 Uiso 1 1 calc R U . . .
H27F H 0.0516 0.5317 0.2622 0.045 Uiso 1 1 calc R U . . .
C28B C 0.2043(4) 0.4647(4) 0.2711(3) 0.0406(16) Uani 1 1 d . . . . .
H28D H 0.2514 0.4366 0.2938 0.049 Uiso 1 1 calc R U . . .
H28E H 0.2160 0.4957 0.2263 0.049 Uiso 1 1 calc R U . . .
H28F H 0.1646 0.4205 0.2581 0.049 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
Pb1A Cl1A 2.6314(16) . ?
Pb1A Cl2A 2.6515(16) . ?
Pb1A Rh1A 2.7561(7) . ?
Rh1A C5A 2.213(6) . ?
Rh1A C1A 2.238(6) . ?
Rh1A C2A 2.244(6) . ?
Rh1A P1A 2.2659(15) . ?
Rh1A P2A 2.2717(15) . ?
Rh1A C4A 2.292(5) . ?
Rh1A C3A 2.316(5) . ?
P1A C18A 1.823(6) . ?
P1A C17A 1.825(6) . ?
P1A C11A 1.832(6) . ?
P2A C28A 1.823(6) . ?
P2A C27A 1.826(6) . ?
P2A C21A 1.837(5) . ?
C1A C2A 1.383(9) . ?
C1A C5A 1.403(9) . ?
C2A C3A 1.388(8) . ?
C3A C4A 1.379(8) . ?
C4A C5A 1.435(9) . ?
C11A C12A 1.384(8) . ?
C11A C16A 1.395(7) . ?
C12A C13A 1.390(8) . ?
C13A C14A 1.381(9) . ?
C14A C15A 1.376(9) . ?
C15A C16A 1.386(8) . ?
C21A C22A 1.379(8) . ?
C21A C26A 1.388(8) . ?
C22A C23A 1.395(9) . ?
C23A C24A 1.384(10) . ?
C24A C25A 1.374(9) . ?
C25A C26A 1.376(8) . ?
Pb1B Cl2B 2.6489(16) . ?
Pb1B Cl1B 2.6540(16) . ?
Pb1B Rh1B 2.7530(7) . ?
Rh1B C5B 2.197(6) . ?
Rh1B C2B 2.243(6) . ?
Rh1B C1B 2.248(6) . ?
Rh1B C4B 2.270(6) . ?
Rh1B P2B 2.2697(15) . ?
Rh1B P1B 2.2734(15) . ?
Rh1B C3B 2.284(6) . ?
P1B C18B 1.823(6) . ?
P1B C17B 1.829(6) . ?
P1B C11B 1.831(5) . ?
P2B C27B 1.817(6) . ?
P2B C28B 1.833(6) . ?
P2B C21B 1.834(6) . ?
C1B C2B 1.363(10) . ?
C1B C5B 1.377(9) . ?
C2B C3B 1.415(10) . ?
C3B C4B 1.385(11) . ?
C4B C5B 1.421(10) . ?
C11B C12B 1.388(7) . ?
C11B C16B 1.393(7) . ?
C12B C13B 1.382(8) . ?
C13B C14B 1.377(8) . ?
C14B C15B 1.392(9) . ?
C15B C16B 1.370(8) . ?
C21B C22B 1.382(8) . ?
C21B C26B 1.389(8) . ?
C22B C23B 1.390(9) . ?
C23B C24B 1.359(10) . ?
C24B C25B 1.365(9) . ?
C25B C26B 1.393(8) . ?

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
Cl1A Pb1A Cl2A 95.65(6) . . ?
Cl1A Pb1A Rh1A 99.78(4) . . ?
Cl2A Pb1A Rh1A 101.25(4) . . ?
C5A Rh1A C1A 36.8(2) . . ?
C5A Rh1A C2A 60.7(2) . . ?
C1A Rh1A C2A 36.0(2) . . ?
C5A Rh1A P1A 101.03(18) . . ?
C1A Rh1A P1A 134.61(19) . . ?
C2A Rh1A P1A 156.41(16) . . ?
C5A Rh1A P2A 159.27(17) . . ?
C1A Rh1A P2A 125.15(19) . . ?
C2A Rh1A P2A 98.55(17) . . ?
P1A Rh1A P2A 99.09(6) . . ?
C5A Rh1A C4A 37.1(2) . . ?
C1A Rh1A C4A 60.4(2) . . ?
C2A Rh1A C4A 59.3(2) . . ?
P1A Rh1A C4A 97.08(16) . . ?
P2A Rh1A C4A 134.76(18) . . ?
C5A Rh1A C3A 60.2(2) . . ?
C1A Rh1A C3A 59.4(2) . . ?
C2A Rh1A C3A 35.4(2) . . ?
P1A Rh1A C3A 124.03(17) . . ?
P2A Rh1A C3A 103.90(16) . . ?
C4A Rh1A C3A 34.8(2) . . ?
C5A Rh1A Pb1A 99.65(18) . . ?
C1A Rh1A Pb1A 86.64(16) . . ?
C2A Rh1A Pb1A 110.14(17) . . ?
P1A Rh1A Pb1A 86.48(4) . . ?
P2A Rh1A Pb1A 86.47(4) . . ?
C4A Rh1A Pb1A 136.60(18) . . ?
C3A Rh1A Pb1A 144.49(16) . . ?
C18A P1A C17A 101.7(3) . . ?
C18A P1A C11A 103.9(3) . . ?
C17A P1A C11A 100.7(3) . . ?
C18A P1A Rh1A 115.5(2) . . ?
C17A P1A Rh1A 111.9(2) . . ?
C11A P1A Rh1A 120.63(18) . . ?
C28A P2A C27A 99.7(3) . . ?
C28A P2A C21A 102.7(3) . . ?
C27A P2A C21A 101.9(3) . . ?
C28A P2A Rh1A 121.5(2) . . ?
C27A P2A Rh1A 111.8(2) . . ?
C21A P2A Rh1A 116.39(18) . . ?
C2A C1A C5A 107.9(6) . . ?
C2A C1A Rh1A 72.2(3) . . ?
C5A C1A Rh1A 70.6(3) . . ?
C1A C2A C3A 109.1(6) . . ?
C1A C2A Rh1A 71.8(3) . . ?
C3A C2A Rh1A 75.1(3) . . ?
C4A C3A C2A 108.4(6) . . ?
C4A C3A Rh1A 71.6(3) . . ?
C2A C3A Rh1A 69.5(3) . . ?
C3A C4A C5A 107.6(6) . . ?
C3A C4A Rh1A 73.5(3) . . ?
C5A C4A Rh1A 68.5(3) . . ?
C1A C5A C4A 106.8(5) . . ?
C1A C5A Rh1A 72.6(3) . . ?
C4A C5A Rh1A 74.4(3) . . ?
C12A C11A C16A 118.6(5) . . ?
C12A C11A P1A 121.5(4) . . ?
C16A C11A P1A 119.8(5) . . ?
C11A C12A C13A 120.7(6) . . ?
C14A C13A C12A 120.4(6) . . ?
C15A C14A C13A 119.1(6) . . ?
C14A C15A C16A 121.0(6) . . ?
C15A C16A C11A 120.2(6) . . ?
C22A C21A C26A 118.5(5) . . ?
C22A C21A P2A 123.0(5) . . ?
C26A C21A P2A 118.4(4) . . ?
C21A C22A C23A 120.4(6) . . ?
C24A C23A C22A 120.3(6) . . ?
C25A C24A C23A 119.2(6) . . ?
C24A C25A C26A 120.4(7) . . ?
C25A C26A C21A 121.2(6) . . ?
Cl2B Pb1B Cl1B 98.91(6) . . ?
Cl2B Pb1B Rh1B 98.20(4) . . ?
Cl1B Pb1B Rh1B 97.48(4) . . ?
C5B Rh1B C2B 60.3(3) . . ?
C5B Rh1B C1B 36.1(2) . . ?
C2B Rh1B C1B 35.3(2) . . ?
C5B Rh1B C4B 37.1(3) . . ?
C2B Rh1B C4B 60.0(2) . . ?
C1B Rh1B C4B 60.0(2) . . ?
C5B Rh1B P2B 158.95(19) . . ?
C2B Rh1B P2B 98.74(19) . . ?
C1B Rh1B P2B 126.8(2) . . ?
C4B Rh1B P2B 132.5(3) . . ?
C5B Rh1B P1B 100.34(19) . . ?
C2B Rh1B P1B 157.98(18) . . ?
C1B Rh1B P1B 132.3(2) . . ?
C4B Rh1B P1B 98.39(19) . . ?
P2B Rh1B P1B 99.67(6) . . ?
C5B Rh1B C3B 60.6(3) . . ?
C2B Rh1B C3B 36.4(3) . . ?
C1B Rh1B C3B 59.6(2) . . ?
C4B Rh1B C3B 35.4(3) . . ?
P2B Rh1B C3B 101.7(2) . . ?
P1B Rh1B C3B 126.8(2) . . ?
C5B Rh1B Pb1B 100.2(2) . . ?
C2B Rh1B Pb1B 105.9(2) . . ?
C1B Rh1B Pb1B 85.14(17) . . ?
C4B Rh1B Pb1B 137.2(2) . . ?
P2B Rh1B Pb1B 87.36(4) . . ?
P1B Rh1B Pb1B 86.99(4) . . ?
C3B Rh1B Pb1B 141.8(2) . . ?
C18B P1B C17B 100.5(3) . . ?
C18B P1B C11B 102.7(3) . . ?
C17B P1B C11B 103.0(3) . . ?
C18B P1B Rh1B 118.20(19) . . ?
C17B P1B Rh1B 111.3(2) . . ?
C11B P1B Rh1B 118.61(17) . . ?
C27B P2B C28B 99.9(3) . . ?
C27B P2B C21B 101.9(3) . . ?
C28B P2B C21B 104.0(3) . . ?
C27B P2B Rh1B 111.4(2) . . ?
C28B P2B Rh1B 120.4(2) . . ?
C21B P2B Rh1B 116.51(19) . . ?
C2B C1B C5B 109.1(6) . . ?
C2B C1B Rh1B 72.1(4) . . ?
C5B C1B Rh1B 70.0(4) . . ?
C1B C2B C3B 108.3(7) . . ?
C1B C2B Rh1B 72.5(4) . . ?
C3B C2B Rh1B 73.4(4) . . ?
C4B C3B C2B 107.4(7) . . ?
C4B C3B Rh1B 71.7(4) . . ?
C2B C3B Rh1B 70.2(4) . . ?
C3B C4B C5B 107.3(6) . . ?
C3B C4B Rh1B 72.8(4) . . ?
C5B C4B Rh1B 68.7(3) . . ?
C1B C5B C4B 107.6(6) . . ?
C1B C5B Rh1B 74.0(4) . . ?
C4B C5B Rh1B 74.2(4) . . ?
C12B C11B C16B 118.0(5) . . ?
C12B C11B P1B 121.3(4) . . ?
C16B C11B P1B 120.5(4) . . ?
C13B C12B C11B 121.2(6) . . ?
C14B C13B C12B 119.9(6) . . ?
C13B C14B C15B 119.5(6) . . ?
C16B C15B C14B 120.2(6) . . ?
C15B C16B C11B 121.0(6) . . ?
C22B C21B C26B 118.4(5) . . ?
C22B C21B P2B 122.1(5) . . ?
C26B C21B P2B 119.3(4) . . ?
C21B C22B C23B 120.6(7) . . ?
C24B C23B C22B 120.4(7) . . ?
C23B C24B C25B 119.9(6) . . ?
C24B C25B C26B 120.5(7) . . ?
C21B C26B C25B 120.1(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
Cl1A Pb1A Rh1A C5A 14.73(18) . . . . ?
Cl2A Pb1A Rh1A C5A -83.10(18) . . . . ?
Cl1A Pb1A Rh1A C1A 49.23(19) . . . . ?
Cl2A Pb1A Rh1A C1A -48.60(19) . . . . ?
Cl1A Pb1A Rh1A C2A 76.95(18) . . . . ?
Cl2A Pb1A Rh1A C2A -20.87(18) . . . . ?
Cl1A Pb1A Rh1A P1A -85.88(6) . . . . ?
Cl2A Pb1A Rh1A P1A 176.30(6) . . . . ?
Cl1A Pb1A Rh1A P2A 174.78(5) . . . . ?
Cl2A Pb1A Rh1A P2A 76.95(6) . . . . ?
Cl1A Pb1A Rh1A C4A 10.7(2) . . . . ?
Cl2A Pb1A Rh1A C4A -87.1(2) . . . . ?
Cl1A Pb1A Rh1A C3A 65.6(3) . . . . ?
Cl2A Pb1A Rh1A C3A -32.2(3) . . . . ?
C5A Rh1A P1A C18A 113.5(3) . . . . ?
C1A Rh1A P1A C18A 130.9(3) . . . . ?
C2A Rh1A P1A C18A 76.5(5) . . . . ?
P2A Rh1A P1A C18A -61.5(2) . . . . ?
C4A Rh1A P1A C18A 76.1(3) . . . . ?
C3A Rh1A P1A C18A 52.2(3) . . . . ?
Pb1A Rh1A P1A C18A -147.3(2) . . . . ?
C5A Rh1A P1A C17A -2.2(3) . . . . ?
C1A Rh1A P1A C17A 15.2(3) . . . . ?
C2A Rh1A P1A C17A -39.2(5) . . . . ?
P2A Rh1A P1A C17A -177.1(2) . . . . ?
C4A Rh1A P1A C17A -39.6(3) . . . . ?
C3A Rh1A P1A C17A -63.5(3) . . . . ?
Pb1A Rh1A P1A C17A 97.0(2) . . . . ?
C5A Rh1A P1A C11A -120.3(3) . . . . ?
C1A Rh1A P1A C11A -102.9(3) . . . . ?
C2A Rh1A P1A C11A -157.3(5) . . . . ?
P2A Rh1A P1A C11A 64.7(2) . . . . ?
C4A Rh1A P1A C11A -157.7(3) . . . . ?
C3A Rh1A P1A C11A 178.4(3) . . . . ?
Pb1A Rh1A P1A C11A -21.1(2) . . . . ?
C5A Rh1A P2A C28A 139.2(6) . . . . ?
C1A Rh1A P2A C28A 114.4(3) . . . . ?
C2A Rh1A P2A C28A 140.9(3) . . . . ?
P1A Rh1A P2A C28A -54.9(3) . . . . ?
C4A Rh1A P2A C28A -164.4(3) . . . . ?
C3A Rh1A P2A C28A 176.6(3) . . . . ?
Pb1A Rh1A P2A C28A 31.0(3) . . . . ?
C5A Rh1A P2A C27A 22.0(6) . . . . ?
C1A Rh1A P2A C27A -2.8(3) . . . . ?
C2A Rh1A P2A C27A 23.7(3) . . . . ?
P1A Rh1A P2A C27A -172.1(2) . . . . ?
C4A Rh1A P2A C27A 78.4(3) . . . . ?
C3A Rh1A P2A C27A 59.4(3) . . . . ?
Pb1A Rh1A P2A C27A -86.2(2) . . . . ?
C5A Rh1A P2A C21A -94.6(6) . . . . ?
C1A Rh1A P2A C21A -119.3(3) . . . . ?
C2A Rh1A P2A C21A -92.9(3) . . . . ?
P1A Rh1A P2A C21A 71.4(2) . . . . ?
C4A Rh1A P2A C21A -38.1(3) . . . . ?
C3A Rh1A P2A C21A -57.1(3) . . . . ?
Pb1A Rh1A P2A C21A 157.3(2) . . . . ?
C5A Rh1A C1A C2A -117.0(5) . . . . ?
P1A Rh1A C1A C2A -146.4(3) . . . . ?
P2A Rh1A C1A C2A 48.6(4) . . . . ?
C4A Rh1A C1A C2A -77.5(4) . . . . ?
C3A Rh1A C1A C2A -37.1(3) . . . . ?
Pb1A Rh1A C1A C2A 131.9(4) . . . . ?
C2A Rh1A C1A C5A 117.0(5) . . . . ?
P1A Rh1A C1A C5A -29.4(5) . . . . ?
P2A Rh1A C1A C5A 165.6(3) . . . . ?
C4A Rh1A C1A C5A 39.5(4) . . . . ?
C3A Rh1A C1A C5A 79.9(4) . . . . ?
Pb1A Rh1A C1A C5A -111.1(4) . . . . ?
C5A C1A C2A C3A 4.4(7) . . . . ?
Rh1A C1A C2A C3A 66.4(4) . . . . ?
C5A C1A C2A Rh1A -62.0(4) . . . . ?
C5A Rh1A C2A C1A 37.7(4) . . . . ?
P1A Rh1A C2A C1A 80.3(6) . . . . ?
P2A Rh1A C2A C1A -141.6(3) . . . . ?
C4A Rh1A C2A C1A 80.7(4) . . . . ?
C3A Rh1A C2A C1A 116.4(5) . . . . ?
Pb1A Rh1A C2A C1A -52.3(4) . . . . ?
C5A Rh1A C2A C3A -78.7(4) . . . . ?
C1A Rh1A C2A C3A -116.4(5) . . . . ?
P1A Rh1A C2A C3A -36.1(7) . . . . ?
P2A Rh1A C2A C3A 102.0(4) . . . . ?
C4A Rh1A C2A C3A -35.6(4) . . . . ?
Pb1A Rh1A C2A C3A -168.7(3) . . . . ?
C1A C2A C3A C4A -2.9(7) . . . . ?
Rh1A C2A C3A C4A 61.3(4) . . . . ?
C1A C2A C3A Rh1A -64.3(4) . . . . ?
C5A Rh1A C3A C4A -38.3(4) . . . . ?
C1A Rh1A C3A C4A -81.0(4) . . . . ?
C2A Rh1A C3A C4A -118.7(6) . . . . ?
P1A Rh1A C3A C4A 44.8(4) . . . . ?
P2A Rh1A C3A C4A 156.1(3) . . . . ?
Pb1A Rh1A C3A C4A -100.2(4) . . . . ?
C5A Rh1A C3A C2A 80.4(4) . . . . ?
C1A Rh1A C3A C2A 37.7(4) . . . . ?
P1A Rh1A C3A C2A 163.5(3) . . . . ?
P2A Rh1A C3A C2A -85.2(4) . . . . ?
C4A Rh1A C3A C2A 118.7(6) . . . . ?
Pb1A Rh1A C3A C2A 18.5(5) . . . . ?
C2A C3A C4A C5A 0.3(6) . . . . ?
Rh1A C3A C4A C5A 60.3(4) . . . . ?
C2A C3A C4A Rh1A -60.0(4) . . . . ?
C5A Rh1A C4A C3A 117.1(5) . . . . ?
C1A Rh1A C4A C3A 78.0(4) . . . . ?
C2A Rh1A C4A C3A 36.2(4) . . . . ?
P1A Rh1A C4A C3A -144.0(4) . . . . ?
P2A Rh1A C4A C3A -33.6(5) . . . . ?
Pb1A Rh1A C4A C3A 123.7(4) . . . . ?
C1A Rh1A C4A C5A -39.1(4) . . . . ?
C2A Rh1A C4A C5A -80.9(4) . . . . ?
P1A Rh1A C4A C5A 98.9(4) . . . . ?
P2A Rh1A C4A C5A -150.7(3) . . . . ?
C3A Rh1A C4A C5A -117.1(5) . . . . ?
Pb1A Rh1A C4A C5A 6.6(5) . . . . ?
C2A C1A C5A C4A -4.1(6) . . . . ?
Rh1A C1A C5A C4A -67.2(4) . . . . ?
C2A C1A C5A Rh1A 63.1(4) . . . . ?
C3A C4A C5A C1A 2.3(6) . . . . ?
Rh1A C4A C5A C1A 65.9(4) . . . . ?
C3A C4A C5A Rh1A -63.6(4) . . . . ?
C2A Rh1A C5A C1A -36.9(4) . . . . ?
P1A Rh1A C5A C1A 159.2(3) . . . . ?
P2A Rh1A C5A C1A -34.9(8) . . . . ?
C4A Rh1A C5A C1A -113.7(5) . . . . ?
C3A Rh1A C5A C1A -77.8(4) . . . . ?
Pb1A Rh1A C5A C1A 70.9(4) . . . . ?
C1A Rh1A C5A C4A 113.7(5) . . . . ?
C2A Rh1A C5A C4A 76.8(4) . . . . ?
P1A Rh1A C5A C4A -87.2(4) . . . . ?
P2A Rh1A C5A C4A 78.7(7) . . . . ?
C3A Rh1A C5A C4A 35.9(3) . . . . ?
Pb1A Rh1A C5A C4A -175.4(3) . . . . ?
C18A P1A C11A C12A 34.6(5) . . . . ?
C17A P1A C11A C12A 139.6(5) . . . . ?
Rh1A P1A C11A C12A -96.8(5) . . . . ?
C18A P1A C11A C16A -149.4(5) . . . . ?
C17A P1A C11A C16A -44.4(5) . . . . ?
Rh1A P1A C11A C16A 79.2(5) . . . . ?
C16A C11A C12A C13A 0.1(9) . . . . ?
P1A C11A C12A C13A 176.1(5) . . . . ?
C11A C12A C13A C14A -0.9(10) . . . . ?
C12A C13A C14A C15A 1.3(10) . . . . ?
C13A C14A C15A C16A -1.0(10) . . . . ?
C14A C15A C16A C11A 0.2(9) . . . . ?
C12A C11A C16A C15A 0.3(8) . . . . ?
P1A C11A C16A C15A -175.8(4) . . . . ?
C28A P2A C21A C22A 16.2(5) . . . . ?
C27A P2A C21A C22A 119.2(5) . . . . ?
Rh1A P2A C21A C22A -119.0(5) . . . . ?
C28A P2A C21A C26A -159.9(5) . . . . ?
C27A P2A C21A C26A -56.9(5) . . . . ?
Rh1A P2A C21A C26A 65.0(5) . . . . ?
C26A C21A C22A C23A 0.5(9) . . . . ?
P2A C21A C22A C23A -175.5(5) . . . . ?
C21A C22A C23A C24A -0.2(10) . . . . ?
C22A C23A C24A C25A 0.2(10) . . . . ?
C23A C24A C25A C26A -0.7(10) . . . . ?
C24A C25A C26A C21A 1.1(9) . . . . ?
C22A C21A C26A C25A -1.0(9) . . . . ?
P2A C21A C26A C25A 175.2(5) . . . . ?
Cl2B Pb1B Rh1B C5B -82.6(2) . . . . ?
Cl1B Pb1B Rh1B C5B 17.61(19) . . . . ?
Cl2B Pb1B Rh1B C2B -20.7(2) . . . . ?
Cl1B Pb1B Rh1B C2B 79.5(2) . . . . ?
Cl2B Pb1B Rh1B C1B -49.6(2) . . . . ?
Cl1B Pb1B Rh1B C1B 50.5(2) . . . . ?
Cl2B Pb1B Rh1B C4B -83.4(3) . . . . ?
Cl1B Pb1B Rh1B C4B 16.7(3) . . . . ?
Cl2B Pb1B Rh1B P2B 77.63(6) . . . . ?
Cl1B Pb1B Rh1B P2B 177.80(5) . . . . ?
Cl2B Pb1B Rh1B P1B 177.46(6) . . . . ?
Cl1B Pb1B Rh1B P1B -82.37(5) . . . . ?
Cl2B Pb1B Rh1B C3B -28.0(4) . . . . ?
Cl1B Pb1B Rh1B C3B 72.2(4) . . . . ?
C5B Rh1B P1B C18B 110.4(3) . . . . ?
C2B Rh1B P1B C18B 83.3(6) . . . . ?
C1B Rh1B P1B C18B 129.5(3) . . . . ?
C4B Rh1B P1B C18B 72.8(3) . . . . ?
P2B Rh1B P1B C18B -63.1(2) . . . . ?
C3B Rh1B P1B C18B 49.5(3) . . . . ?
Pb1B Rh1B P1B C18B -149.9(2) . . . . ?
C5B Rh1B P1B C17B -5.2(3) . . . . ?
C2B Rh1B P1B C17B -32.3(6) . . . . ?
C1B Rh1B P1B C17B 13.9(3) . . . . ?
C4B Rh1B P1B C17B -42.8(3) . . . . ?
P2B Rh1B P1B C17B -178.6(2) . . . . ?
C3B Rh1B P1B C17B -66.1(3) . . . . ?
Pb1B Rh1B P1B C17B 94.5(2) . . . . ?
C5B Rh1B P1B C11B -124.4(3) . . . . ?
C2B Rh1B P1B C11B -151.5(6) . . . . ?
C1B Rh1B P1B C11B -105.3(3) . . . . ?
C4B Rh1B P1B C11B -162.0(3) . . . . ?
P2B Rh1B P1B C11B 62.2(2) . . . . ?
C3B Rh1B P1B C11B 174.7(3) . . . . ?
Pb1B Rh1B P1B C11B -24.6(2) . . . . ?
C5B Rh1B P2B C27B 15.3(6) . . . . ?
C2B Rh1B P2B C27B 9.1(3) . . . . ?
C1B Rh1B P2B C27B -14.6(3) . . . . ?
C4B Rh1B P2B C27B 66.1(3) . . . . ?
P1B Rh1B P2B C27B 177.0(2) . . . . ?
C3B Rh1B P2B C27B 46.0(3) . . . . ?
Pb1B Rh1B P2B C27B -96.6(2) . . . . ?
C5B Rh1B P2B C28B 131.6(6) . . . . ?
C2B Rh1B P2B C28B 125.4(3) . . . . ?
C1B Rh1B P2B C28B 101.7(3) . . . . ?
C4B Rh1B P2B C28B -177.6(3) . . . . ?
P1B Rh1B P2B C28B -66.7(3) . . . . ?
C3B Rh1B P2B C28B 162.3(3) . . . . ?
Pb1B Rh1B P2B C28B 19.8(3) . . . . ?
C5B Rh1B P2B C21B -101.0(6) . . . . ?
C2B Rh1B P2B C21B -107.2(3) . . . . ?
C1B Rh1B P2B C21B -130.9(3) . . . . ?
C4B Rh1B P2B C21B -50.3(3) . . . . ?
P1B Rh1B P2B C21B 60.6(2) . . . . ?
C3B Rh1B P2B C21B -70.3(3) . . . . ?
Pb1B Rh1B P2B C21B 147.1(2) . . . . ?
C5B Rh1B C1B C2B -118.9(6) . . . . ?
C4B Rh1B C1B C2B -79.4(5) . . . . ?
P2B Rh1B C1B C2B 43.4(5) . . . . ?
P1B Rh1B C1B C2B -152.1(4) . . . . ?
C3B Rh1B C1B C2B -38.2(4) . . . . ?
Pb1B Rh1B C1B C2B 126.4(4) . . . . ?
C2B Rh1B C1B C5B 118.9(6) . . . . ?
C4B Rh1B C1B C5B 39.5(4) . . . . ?
P2B Rh1B C1B C5B 162.3(4) . . . . ?
P1B Rh1B C1B C5B -33.2(5) . . . . ?
C3B Rh1B C1B C5B 80.7(5) . . . . ?
Pb1B Rh1B C1B C5B -114.7(4) . . . . ?
C5B C1B C2B C3B 4.6(7) . . . . ?
Rh1B C1B C2B C3B 65.1(4) . . . . ?
C5B C1B C2B Rh1B -60.5(5) . . . . ?
C5B Rh1B C2B C1B 36.4(4) . . . . ?
C4B Rh1B C2B C1B 79.4(5) . . . . ?
P2B Rh1B C2B C1B -146.2(4) . . . . ?
P1B Rh1B C2B C1B 67.4(8) . . . . ?
C3B Rh1B C2B C1B 116.0(6) . . . . ?
Pb1B Rh1B C2B C1B -56.4(4) . . . . ?
C5B Rh1B C2B C3B -79.6(5) . . . . ?
C1B Rh1B C2B C3B -116.0(6) . . . . ?
C4B Rh1B C2B C3B -36.6(4) . . . . ?
P2B Rh1B C2B C3B 97.8(5) . . . . ?
P1B Rh1B C2B C3B -48.6(9) . . . . ?
Pb1B Rh1B C2B C3B -172.4(4) . . . . ?
C1B C2B C3B C4B -2.1(7) . . . . ?
Rh1B C2B C3B C4B 62.5(5) . . . . ?
C1B C2B C3B Rh1B -64.6(5) . . . . ?
C5B Rh1B C3B C4B -38.0(4) . . . . ?
C2B Rh1B C3B C4B -116.9(6) . . . . ?
C1B Rh1B C3B C4B -79.9(5) . . . . ?
P2B Rh1B C3B C4B 154.1(4) . . . . ?
P1B Rh1B C3B C4B 42.5(5) . . . . ?
Pb1B Rh1B C3B C4B -105.1(6) . . . . ?
C5B Rh1B C3B C2B 78.9(5) . . . . ?
C1B Rh1B C3B C2B 37.1(4) . . . . ?
C4B Rh1B C3B C2B 116.9(6) . . . . ?
P2B Rh1B C3B C2B -88.9(4) . . . . ?
P1B Rh1B C3B C2B 159.4(4) . . . . ?
Pb1B Rh1B C3B C2B 11.8(7) . . . . ?
C2B C3B C4B C5B -1.2(7) . . . . ?
Rh1B C3B C4B C5B 60.4(4) . . . . ?
C2B C3B C4B Rh1B -61.5(4) . . . . ?
C5B Rh1B C4B C3B 117.1(6) . . . . ?
C2B Rh1B C4B C3B 37.7(4) . . . . ?
C1B Rh1B C4B C3B 78.7(5) . . . . ?
P2B Rh1B C4B C3B -35.4(5) . . . . ?
P1B Rh1B C4B C3B -146.9(4) . . . . ?
Pb1B Rh1B C4B C3B 118.5(5) . . . . ?
C2B Rh1B C4B C5B -79.4(5) . . . . ?
C1B Rh1B C4B C5B -38.4(4) . . . . ?
P2B Rh1B C4B C5B -152.5(4) . . . . ?
P1B Rh1B C4B C5B 96.1(4) . . . . ?
C3B Rh1B C4B C5B -117.1(6) . . . . ?
Pb1B Rh1B C4B C5B 1.4(6) . . . . ?
C2B C1B C5B C4B -5.3(7) . . . . ?
Rh1B C1B C5B C4B -67.2(4) . . . . ?
C2B C1B C5B Rh1B 61.8(5) . . . . ?
C3B C4B C5B C1B 4.0(7) . . . . ?
Rh1B C4B C5B C1B 67.0(4) . . . . ?
C3B C4B C5B Rh1B -63.0(5) . . . . ?
C2B Rh1B C5B C1B -35.7(4) . . . . ?
C4B Rh1B C5B C1B -114.1(6) . . . . ?
P2B Rh1B C5B C1B -42.7(9) . . . . ?
P1B Rh1B C5B C1B 155.7(4) . . . . ?
C3B Rh1B C5B C1B -77.7(5) . . . . ?
Pb1B Rh1B C5B C1B 66.9(4) . . . . ?
C2B Rh1B C5B C4B 78.4(5) . . . . ?
C1B Rh1B C5B C4B 114.1(6) . . . . ?
P2B Rh1B C5B C4B 71.4(8) . . . . ?
P1B Rh1B C5B C4B -90.3(4) . . . . ?
C3B Rh1B C5B C4B 36.3(4) . . . . ?
Pb1B Rh1B C5B C4B -179.0(4) . . . . ?
C18B P1B C11B C12B 43.0(5) . . . . ?
C17B P1B C11B C12B 147.1(5) . . . . ?
Rh1B P1B C11B C12B -89.5(5) . . . . ?
C18B P1B C11B C16B -141.8(5) . . . . ?
C17B P1B C11B C16B -37.6(5) . . . . ?
Rh1B P1B C11B C16B 85.8(5) . . . . ?
C16B C11B C12B C13B -0.1(8) . . . . ?
P1B C11B C12B C13B 175.3(5) . . . . ?
C11B C12B C13B C14B -0.2(9) . . . . ?
C12B C13B C14B C15B 1.2(9) . . . . ?
C13B C14B C15B C16B -1.9(9) . . . . ?
C14B C15B C16B C11B 1.5(9) . . . . ?
C12B C11B C16B C15B -0.5(8) . . . . ?
P1B C11B C16B C15B -176.0(4) . . . . ?
C27B P2B C21B C22B 73.4(5) . . . . ?
C28B P2B C21B C22B -30.1(6) . . . . ?
Rh1B P2B C21B C22B -165.1(4) . . . . ?
C27B P2B C21B C26B -100.8(5) . . . . ?
C28B P2B C21B C26B 155.7(5) . . . . ?
Rh1B P2B C21B C26B 20.6(5) . . . . ?
C26B C21B C22B C23B -0.5(9) . . . . ?
P2B C21B C22B C23B -174.8(5) . . . . ?
C21B C22B C23B C24B -0.5(10) . . . . ?
C22B C23B C24B C25B -0.1(10) . . . . ?
C23B C24B C25B C26B 1.6(10) . . . . ?
C22B C21B C26B C25B 2.0(9) . . . . ?
P2B C21B C26B C25B 176.5(4) . . . . ?
C24B C25B C26B C21B -2.6(9) . . . . ?

_refine_diff_density_max         1.992
_refine_diff_density_min         -1.824
_refine_diff_density_rms         0.180

_shelxl_version_number           2014/6

####################################################################### 
# 
# 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_riv15c5_cmpd_4
_database_code_depnum_ccdc_archive 'CCDC 1416194'
_audit_update_record             
;
2015-07-30 deposited with the CCDC.
2015-09-09 downloaded from the CCDC.
;
# start Validation Reply Form
_vrf_CHEMW03_riv15c5             
;
PROBLEM: The ratio of given/expected molecular weight as
RESPONSE: The reported weight includes contributions from the poorly-behaved 
solvent hexane molecule that was removed by use of the SQUEEZE routine of the
program PLATON.  See _platon_squeeze_details section in this CIF for more
information.
;
_vrf_PLAT041_riv15c5             
;
PROBLEM: Calc. and Reported SumFormula    Strings  Differ     Please Check
RESPONSE: The reported formula includes contributions from the poorly-behaved 
solvent hexane molecule that was removed by use of the SQUEEZE routine of the
program PLATON.  See _platon_squeeze_details section in this CIF for more
information.
;
_vrf_PLAT068_riv15c5             
;
PROBLEM: Reported F000 Differs from Calcd (or Missing)...     Please Check
RESPONSE: The reported formula includes contributions from the poorly-behaved 
solvent hexane molecule that was removed by use of the SQUEEZE routine of the
program PLATON.  See _platon_squeeze_details section in this CIF for more
information.
;
_vrf_FORMU01_riv15c5             
;
PROBLEM: There is a discrepancy between the atom counts in the... Please Check
RESPONSE: The reported formula includes contributions from the poorly-behaved 
solvent hexane molecule that was removed by use of the SQUEEZE routine of the
program PLATON.  See _platon_squeeze_details section in this CIF for more
information.
;
_vrf_CELLZ01_riv15c5             
;
PROBLEM: Difference between formula and atom_site contents detected.
RESPONSE: The reported formula includes contributions from the poorly-behaved 
solvent hexane molecule that was removed by use of the SQUEEZE routine of the
program PLATON.  See _platon_squeeze_details section in this CIF for more
information.
;
_vrf_PLAT605_riv15c5             
;
PROBLEM: Structure Contains Solvent Accessible VOIDS of .        219 A**3
RESPONSE: The voids are filled by a poorly-behaved solvent hexane molecule 
that was removed by use of the SQUEEZE routine of the program PLATON.  
See _platon_squeeze_details section in this CIF for more information.
;


# end Validation Reply Form  

_audit_creation_method           SHELXL-2014/7
_shelx_SHELXL_version_number     2014/7
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C45 H36 B F18 P2 Rh, 0.5(C6 H14)'
_chemical_formula_sum            'C48 H43 B F18 P2 Rh'
_chemical_formula_weight         1137.48

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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'
B B 0.0090 0.0039 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0727 0.0534 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.2955 0.4335 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Rh Rh 0.0927 3.6045 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'

_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. 
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   12.2135(3)
_cell_length_b                   12.5991(3)
_cell_length_c                   17.0103(4)
_cell_angle_alpha                80.6961(10)
_cell_angle_beta                 81.3382(8)
_cell_angle_gamma                75.2500(8)
_cell_volume                     2481.49(10)
_cell_formula_units_Z            2
_cell_measurement_temperature    173(2)
_cell_measurement_reflns_used    9844
_cell_measurement_theta_min      4.23
_cell_measurement_theta_max      72.12

_exptl_crystal_description       fragment
_exptl_crystal_colour            yellow
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.522
_exptl_crystal_F_000             1146
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.265
_exptl_crystal_size_mid          0.202
_exptl_crystal_size_min          0.156
_exptl_absorpt_coefficient_mu    4.305
_shelx_estimated_absorpt_T_min   0.395
_shelx_estimated_absorpt_T_max   0.553
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_correction_T_min  0.4912
_exptl_absorpt_correction_T_max  0.6786
_exptl_absorpt_process_details   'SADABS 2014/5'
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      173(2)
_diffrn_radiation_wavelength     1.54178
_diffrn_radiation_type           CuK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            17405
_diffrn_reflns_av_unetI/netI     0.0169
_diffrn_reflns_av_R_equivalents  0.0129
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_limit_l_max       20
_diffrn_reflns_theta_min         2.650
_diffrn_reflns_theta_max         72.230
_diffrn_reflns_theta_full        67.679
_diffrn_measured_fraction_theta_max 0.963
_diffrn_measured_fraction_theta_full 0.967
_diffrn_reflns_Laue_measured_fraction_max 0.963
_diffrn_reflns_Laue_measured_fraction_full 0.967
_diffrn_reflns_point_group_measured_fraction_max 0.963
_diffrn_reflns_point_group_measured_fraction_full 0.967
_reflns_number_total             9416
_reflns_number_gt                9241
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_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. 
;

_computing_data_collection       'Bruker APEX2'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXT-2014 (Sheldrick 2014)'
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0493P)²+2.1386P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   mixed
_refine_ls_hydrogen_treatment    mixed
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         9416
_refine_ls_number_parameters     716
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0323
_refine_ls_R_factor_gt           0.0319
_refine_ls_wR_factor_ref         0.0860
_refine_ls_wR_factor_gt          0.0855
_refine_ls_goodness_of_fit_ref   1.026
_refine_ls_restrained_S_all      1.026
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000

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
Rh Rh 0.69914(2) 0.36082(2) 0.78968(2) 0.02642(6) Uani 1 1 d . . . . .
H1 H 0.766(2) 0.448(2) 0.7754(16) 0.036(7) Uiso 1 1 d . . . . .
P1 P 0.82455(5) 0.30162(5) 0.68435(4) 0.03545(13) Uani 1 1 d . . . . .
P2 P 0.81388(5) 0.27933(5) 0.88631(3) 0.03358(13) Uani 1 1 d . . . . .
F31 F 0.4834(2) 1.05400(14) 0.88267(15) 0.0788(6) Uani 1 1 d . . . . .
F32 F 0.35593(19) 0.99369(16) 0.95991(14) 0.0802(6) Uani 1 1 d . . . . .
F33 F 0.3481(3) 1.01954(18) 0.83340(18) 0.1188(12) Uani 1 1 d . . . . .
F34 F 0.82264(15) 0.6590(3) 0.94828(13) 0.1125(11) Uani 1 1 d . . . . .
F35 F 0.71156(18) 0.71766(19) 1.04705(12) 0.0812(7) Uani 1 1 d . . . . .
F36 F 0.7155(2) 0.56298(17) 1.01705(15) 0.0886(8) Uani 1 1 d . . . . .
F41 F 0.05083(16) 0.9218(2) 0.63323(17) 0.0982(9) Uani 1 1 d . . . . .
F42 F 0.2099(2) 0.9597(2) 0.6133(2) 0.1188(12) Uani 1 1 d . . . . .
F43 F 0.1783(4) 0.8479(3) 0.54859(15) 0.1592(18) Uani 1 1 d . . . . .
F44 F 0.13593(13) 0.47291(13) 0.85522(10) 0.0508(4) Uani 1 1 d . . . . .
F45 F 0.07186(14) 0.61700(16) 0.91472(10) 0.0575(4) Uani 1 1 d . . . . .
F46 F -0.00785(12) 0.59786(16) 0.81512(11) 0.0596(5) Uani 1 1 d . . . . .
F51 F 0.8564(2) 0.7973(3) 0.64893(16) 0.1285(13) Uani 1 1 d . . . . .
F52 F 0.8778(2) 0.8088(3) 0.52473(15) 0.1212(12) Uani 1 1 d . . . . .
F53 F 0.9417(2) 0.6626(3) 0.5949(3) 0.1523(17) Uani 1 1 d . . . . .
F54 F 0.57736(17) 0.72894(17) 0.39085(9) 0.0614(4) Uani 1 1 d . . . . .
F55 F 0.63253(19) 0.55446(17) 0.42040(11) 0.0681(5) Uani 1 1 d . . . . .
F56 F 0.46261(16) 0.6384(2) 0.45999(10) 0.0835(8) Uani 1 1 d . . . . .
C1 C 0.53178(16) 0.49156(17) 0.78214(12) 0.0264(4) Uani 1 1 d . . . . .
C2 C 0.53340(17) 0.42786(18) 0.85979(13) 0.0304(4) Uani 1 1 d . . . . .
H2 H 0.5245 0.4587 0.9116 0.036 Uiso 1 1 calc R U . . .
C3 C 0.53890(19) 0.31405(19) 0.85236(15) 0.0365(5) Uani 1 1 d . . . . .
H3 H 0.5348 0.2534 0.8977 0.044 Uiso 1 1 calc R U . . .
C4 C 0.54485(19) 0.30466(19) 0.77083(16) 0.0377(5) Uani 1 1 d . . . . .
H4 H 0.5452 0.2366 0.7475 0.045 Uiso 1 1 calc R U . . .
C5 C 0.54366(18) 0.41282(18) 0.72727(14) 0.0313(4) Uani 1 1 d . . . . .
H5 H 0.5431 0.4318 0.6679 0.038 Uiso 1 1 calc R U . . .
C11A C 0.9762(19) 0.3076(16) 0.6901(14) 0.033(3) Uani 0.5 1 d . . P A 1
C12A C 0.9983(10) 0.4112(9) 0.6792(8) 0.041(2) Uani 0.5 1 d . . P A 1
H12A H 0.9396 0.4752 0.6673 0.050 Uiso 0.5 1 calc R U P A 1
C13A C 1.1065(12) 0.4215(10) 0.6859(8) 0.071(4) Uani 0.5 1 d . . P A 1
H13A H 1.1230 0.4926 0.6767 0.085 Uiso 0.5 1 calc R U P A 1
C14A C 1.1906(16) 0.3286(16) 0.7059(9) 0.082(5) Uani 0.5 1 d . . P A 1
H14A H 1.2632 0.3361 0.7144 0.099 Uiso 0.5 1 calc R U P A 1
C15A C 1.1689(12) 0.2224(18) 0.7138(12) 0.068(5) Uani 0.5 1 d . . P A 1
H15A H 1.2271 0.1578 0.7255 0.081 Uiso 0.5 1 calc R U P A 1
C16A C 1.0582(12) 0.2144(9) 0.7039(8) 0.052(3) Uani 0.5 1 d . . P A 1
H16A H 1.0419 0.1439 0.7070 0.063 Uiso 0.5 1 calc R U P A 1
C11B C 0.968(2) 0.2785(18) 0.6914(15) 0.041(4) Uani 0.5 1 d . . P A 2
C12B C 1.0195(13) 0.3667(11) 0.6865(9) 0.057(3) Uani 0.5 1 d . . P A 2
H12B H 0.9739 0.4394 0.6749 0.069 Uiso 0.5 1 calc R U P A 2
C13B C 1.1320(12) 0.3565(14) 0.6973(8) 0.081(5) Uani 0.5 1 d . . P A 2
H13B H 1.1621 0.4200 0.6926 0.097 Uiso 0.5 1 calc R U P A 2
C14B C 1.196(2) 0.257(2) 0.7143(13) 0.095(10) Uani 0.5 1 d . . P A 2
H14B H 1.2735 0.2482 0.7220 0.113 Uiso 0.5 1 calc R U P A 2
C15B C 1.1528(11) 0.1619(13) 0.7212(8) 0.090(5) Uani 0.5 1 d . . P A 2
H15B H 1.2008 0.0906 0.7334 0.108 Uiso 0.5 1 calc R U P A 2
C16B C 1.0410(13) 0.1721(10) 0.7103(9) 0.060(3) Uani 0.5 1 d . . P A 2
H16B H 1.0123 0.1077 0.7154 0.072 Uiso 0.5 1 calc R U P A 2
C17 C 0.7987(2) 0.3901(3) 0.59079(16) 0.0548(7) Uani 1 1 d . . . . .
H17A H 0.7176 0.4057 0.5840 0.066 Uiso 1 1 calc R U . . .
H17B H 0.8202 0.4597 0.5915 0.066 Uiso 1 1 calc R U . . .
H17C H 0.8441 0.3528 0.5462 0.066 Uiso 1 1 calc R U . . .
C18 C 0.8217(4) 0.1686(3) 0.6583(2) 0.0753(11) Uani 1 1 d . . . . .
H18A H 0.7434 0.1682 0.6520 0.090 Uiso 1 1 calc R U . . .
H18B H 0.8706 0.1555 0.6079 0.090 Uiso 1 1 calc R U . . .
H18C H 0.8496 0.1101 0.7010 0.090 Uiso 1 1 calc R U . . .
C21A C 0.8859(16) 0.1420(15) 0.8859(12) 0.033(2) Uani 0.5 1 d . . P B 1
C22A C 0.8208(14) 0.068(2) 0.8787(15) 0.058(5) Uani 0.5 1 d . . P B 1
H22A H 0.7423 0.0971 0.8728 0.069 Uiso 0.5 1 calc R U P B 1
C23A C 0.8636(19) -0.0446(19) 0.8795(14) 0.076(5) Uani 0.5 1 d . . P B 1
H23A H 0.8160 -0.0913 0.8739 0.091 Uiso 0.5 1 calc R U P B 1
C24A C 0.975(2) -0.086(2) 0.8885(15) 0.073(7) Uani 0.5 1 d . . P B 1
H24A H 1.0042 -0.1643 0.8915 0.088 Uiso 0.5 1 calc R U P B 1
C25A C 1.0458(11) -0.0206(16) 0.8933(11) 0.063(3) Uani 0.5 1 d . . P B 1
H25A H 1.1251 -0.0514 0.8954 0.075 Uiso 0.5 1 calc R U P B 1
C26A C 1.0005(15) 0.0933(16) 0.8953(12) 0.050(3) Uani 0.5 1 d . . P B 1
H26A H 1.0487 0.1383 0.9032 0.059 Uiso 0.5 1 calc R U P B 1
C21B C 0.8629(15) 0.1222(13) 0.8846(12) 0.034(3) Uani 0.5 1 d . . P B 2
C22B C 0.7887(13) 0.066(2) 0.8696(13) 0.054(4) Uani 0.5 1 d . . P B 2
H22B H 0.7128 0.1035 0.8609 0.065 Uiso 0.5 1 calc R U P B 2
C23B C 0.8259(18) -0.0494(17) 0.8670(12) 0.079(5) Uani 0.5 1 d . . P B 2
H23B H 0.7743 -0.0904 0.8587 0.095 Uiso 0.5 1 calc R U P B 2
C24B C 0.939(2) -0.102(2) 0.8766(14) 0.089(7) Uani 0.5 1 d . . P B 2
H24B H 0.9656 -0.1792 0.8728 0.107 Uiso 0.5 1 calc R U P B 2
C25B C 1.0084(14) -0.0445(16) 0.8912(12) 0.085(8) Uani 0.5 1 d . . P B 2
H25B H 1.0840 -0.0822 0.9010 0.102 Uiso 0.5 1 calc R U P B 2
C26B C 0.9747(18) 0.0708(18) 0.8927(14) 0.069(4) Uani 0.5 1 d . . P B 2
H26B H 1.0276 0.1116 0.8991 0.082 Uiso 0.5 1 calc R U P B 2
C27 C 0.7371(2) 0.2848(2) 0.98702(14) 0.0413(5) Uani 1 1 d . . . . .
H27A H 0.6936 0.3607 0.9923 0.050 Uiso 1 1 calc R U . . .
H27B H 0.6849 0.2354 0.9960 0.050 Uiso 1 1 calc R U . . .
H27C H 0.7918 0.2612 1.0268 0.050 Uiso 1 1 calc R U . . .
C28 C 0.9319(2) 0.3381(3) 0.89402(17) 0.0519(7) Uani 1 1 d . . . . .
H28A H 0.9044 0.4181 0.8950 0.062 Uiso 1 1 calc R U . . .
H28B H 0.9657 0.3040 0.9435 0.062 Uiso 1 1 calc R U . . .
H28C H 0.9895 0.3240 0.8478 0.062 Uiso 1 1 calc R U . . .
C31 C 0.52663(17) 0.69452(17) 0.82380(12) 0.0259(4) Uani 1 1 d . . . . .
C32 C 0.46434(19) 0.80313(18) 0.83002(13) 0.0309(4) Uani 1 1 d . . . . .
H32 H 0.4054 0.8348 0.7967 0.037 Uiso 1 1 calc R U . . .
C33 C 0.4856(2) 0.86637(19) 0.88331(14) 0.0354(5) Uani 1 1 d . . . . .
C34 C 0.5691(2) 0.82271(19) 0.93455(13) 0.0342(5) Uani 1 1 d . . . . .
H34 H 0.5831 0.8655 0.9714 0.041 Uiso 1 1 calc R U . . .
C35 C 0.63115(18) 0.71516(19) 0.93026(13) 0.0303(4) Uani 1 1 d . . . . .
C36 C 0.61144(17) 0.65296(17) 0.87509(12) 0.0281(4) Uani 1 1 d . . . . .
H36 H 0.6572 0.5800 0.8724 0.034 Uiso 1 1 calc R U . . .
C37 C 0.4173(3) 0.9826(2) 0.88853(18) 0.0516(7) Uani 1 1 d . . . . .
C38 C 0.7221(2) 0.6648(2) 0.98447(14) 0.0371(5) Uani 1 1 d . . . . .
C41 C 0.36647(17) 0.66350(17) 0.74523(12) 0.0257(4) Uani 1 1 d . . . . .
C42 C 0.32005(18) 0.75285(18) 0.69049(14) 0.0318(4) Uani 1 1 d . . . . .
H42 H 0.3694 0.7935 0.6575 0.038 Uiso 1 1 calc R U . . .
C43 C 0.2038(2) 0.7846(2) 0.68245(15) 0.0363(5) Uani 1 1 d . . . . .
C44 C 0.12860(18) 0.7286(2) 0.73052(14) 0.0360(5) Uani 1 1 d . . . . .
H44 H 0.0493 0.7500 0.7254 0.043 Uiso 1 1 calc R U . . .
C45 C 0.17219(18) 0.64117(19) 0.78602(13) 0.0316(4) Uani 1 1 d . . . . .
C46 C 0.28870(17) 0.60880(18) 0.79313(13) 0.0285(4) Uani 1 1 d . . . . .
H46 H 0.3161 0.5479 0.8316 0.034 Uiso 1 1 calc R U . . .
C47 C 0.1607(2) 0.8768(3) 0.6198(2) 0.0576(8) Uani 1 1 d . . . . .
C48 C 0.0934(2) 0.5823(2) 0.84183(16) 0.0413(5) Uani 1 1 d . . . . .
C51 C 0.57998(17) 0.65345(17) 0.67107(12) 0.0269(4) Uani 1 1 d . . . . .
C52 C 0.54740(18) 0.64074(18) 0.59847(13) 0.0297(4) Uani 1 1 d . . . . .
H52 H 0.4798 0.6162 0.5993 0.036 Uiso 1 1 calc R U . . .
C53 C 0.6103(2) 0.6627(2) 0.52517(13) 0.0346(5) Uani 1 1 d . . . . .
C54 C 0.7102(2) 0.6979(2) 0.52102(14) 0.0392(5) Uani 1 1 d . . . . .
H54 H 0.7533 0.7132 0.4710 0.047 Uiso 1 1 calc R U . . .
C55 C 0.74500(19) 0.7098(2) 0.59187(15) 0.0372(5) Uani 1 1 d . . . . .
C56 C 0.68166(18) 0.68795(19) 0.66553(13) 0.0315(4) Uani 1 1 d . . . . .
H56 H 0.7082 0.6967 0.7133 0.038 Uiso 1 1 calc R U . . .
C57 C 0.5709(2) 0.6461(3) 0.44986(14) 0.0449(6) Uani 1 1 d . . . . .
C58 C 0.8539(2) 0.7452(3) 0.58923(17) 0.0522(7) Uani 1 1 d . . . . .
B B 0.50377(19) 0.62566(19) 0.75630(13) 0.0247(4) Uani 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
Rh C5 2.216(2) . ?
Rh C2 2.227(2) . ?
Rh C3 2.252(2) . ?
Rh C4 2.256(2) . ?
Rh P2 2.2661(6) . ?
Rh P1 2.2663(6) . ?
Rh C1 2.281(2) . ?
Rh H1 1.50(3) . ?
P1 C11B 1.72(3) . ?
P1 C17 1.810(3) . ?
P1 C18 1.811(3) . ?
P1 C11A 1.89(2) . ?
P2 C21A 1.73(2) . ?
P2 C28 1.810(3) . ?
P2 C27 1.828(2) . ?
P2 C21B 1.921(16) . ?
F31 C37 1.337(4) . ?
F32 C37 1.335(4) . ?
F33 C37 1.307(3) . ?
F34 C38 1.278(3) . ?
F35 C38 1.318(3) . ?
F36 C38 1.330(3) . ?
F41 C47 1.318(4) . ?
F42 C47 1.314(4) . ?
F43 C47 1.292(4) . ?
F44 C48 1.338(3) . ?
F45 C48 1.348(3) . ?
F46 C48 1.339(3) . ?
F51 C58 1.303(4) . ?
F52 C58 1.292(4) . ?
F53 C58 1.293(4) . ?
F54 C57 1.335(3) . ?
F55 C57 1.335(3) . ?
F56 C57 1.334(3) . ?
C1 C2 1.430(3) . ?
C1 C5 1.436(3) . ?
C1 B 1.636(3) . ?
C2 C3 1.443(3) . ?
C3 C4 1.400(4) . ?
C4 C5 1.440(3) . ?
C11A C16A 1.35(3) . ?
C11A C12A 1.378(15) . ?
C12A C13A 1.38(2) . ?
C13A C14A 1.38(3) . ?
C14A C15A 1.41(3) . ?
C15A C16A 1.418(19) . ?
C11B C12B 1.397(18) . ?
C11B C16B 1.43(3) . ?
C12B C13B 1.38(2) . ?
C13B C14B 1.32(3) . ?
C14B C15B 1.41(2) . ?
C15B C16B 1.38(2) . ?
C21A C26A 1.40(3) . ?
C21A C22A 1.40(2) . ?
C22A C23A 1.38(4) . ?
C23A C24A 1.35(4) . ?
C24A C25A 1.37(2) . ?
C25A C26A 1.40(3) . ?
C21B C22B 1.358(18) . ?
C21B C26B 1.37(3) . ?
C22B C23B 1.41(3) . ?
C23B C24B 1.39(4) . ?
C24B C25B 1.32(3) . ?
C25B C26B 1.41(3) . ?
C31 C32 1.398(3) . ?
C31 C36 1.399(3) . ?
C31 B 1.640(3) . ?
C32 C33 1.391(3) . ?
C33 C34 1.389(3) . ?
C33 C37 1.498(3) . ?
C34 C35 1.381(3) . ?
C35 C36 1.398(3) . ?
C35 C38 1.499(3) . ?
C41 C42 1.397(3) . ?
C41 C46 1.400(3) . ?
C41 B 1.653(3) . ?
C42 C43 1.395(3) . ?
C43 C44 1.388(3) . ?
C43 C47 1.490(4) . ?
C44 C45 1.380(3) . ?
C45 C46 1.395(3) . ?
C45 C48 1.496(3) . ?
C51 C52 1.398(3) . ?
C51 C56 1.402(3) . ?
C51 B 1.639(3) . ?
C52 C53 1.389(3) . ?
C53 C54 1.390(3) . ?
C53 C57 1.497(3) . ?
C54 C55 1.379(3) . ?
C55 C56 1.396(3) . ?
C55 C58 1.499(3) . ?

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
C5 Rh C2 61.58(8) . . ?
C5 Rh C3 61.52(9) . . ?
C2 Rh C3 37.59(8) . . ?
C5 Rh C4 37.55(8) . . ?
C2 Rh C4 61.81(8) . . ?
C3 Rh C4 36.20(9) . . ?
C5 Rh P2 159.13(6) . . ?
C2 Rh P2 103.01(6) . . ?
C3 Rh P2 97.62(7) . . ?
C4 Rh P2 124.15(7) . . ?
C5 Rh P1 97.71(6) . . ?
C2 Rh P1 159.25(6) . . ?
C3 Rh P1 133.47(6) . . ?
C4 Rh P1 101.56(7) . . ?
P2 Rh P1 96.70(2) . . ?
C5 Rh C1 37.20(7) . . ?
C2 Rh C1 36.97(8) . . ?
C3 Rh C1 62.34(8) . . ?
C4 Rh C1 62.58(8) . . ?
P2 Rh C1 136.00(5) . . ?
P1 Rh C1 126.00(5) . . ?
C5 Rh H1 112.1(10) . . ?
C2 Rh H1 107.6(10) . . ?
C3 Rh H1 144.9(10) . . ?
C4 Rh H1 149.6(10) . . ?
P2 Rh H1 85.2(10) . . ?
P1 Rh H1 80.2(10) . . ?
C1 Rh H1 91.5(10) . . ?
C11B P1 C17 106.4(8) . . ?
C11B P1 C18 99.2(7) . . ?
C17 P1 C18 101.38(18) . . ?
C17 P1 C11A 99.9(7) . . ?
C18 P1 C11A 110.2(6) . . ?
C11B P1 Rh 118.6(8) . . ?
C17 P1 Rh 113.23(9) . . ?
C18 P1 Rh 115.85(12) . . ?
C11A P1 Rh 114.4(7) . . ?
C21A P2 C28 99.3(5) . . ?
C21A P2 C27 104.3(7) . . ?
C28 P2 C27 101.64(13) . . ?
C28 P2 C21B 111.3(5) . . ?
C27 P2 C21B 100.8(6) . . ?
C21A P2 Rh 119.1(7) . . ?
C28 P2 Rh 117.96(10) . . ?
C27 P2 Rh 112.20(9) . . ?
C21B P2 Rh 111.3(6) . . ?
C2 C1 C5 105.04(18) . . ?
C2 C1 B 130.40(18) . . ?
C5 C1 B 123.98(18) . . ?
C2 C1 Rh 69.47(11) . . ?
C5 C1 Rh 68.94(11) . . ?
B C1 Rh 132.18(13) . . ?
C1 C2 C3 109.5(2) . . ?
C1 C2 Rh 73.56(11) . . ?
C3 C2 Rh 72.12(12) . . ?
C4 C3 C2 108.2(2) . . ?
C4 C3 Rh 72.06(13) . . ?
C2 C3 Rh 70.29(12) . . ?
C3 C4 C5 107.15(19) . . ?
C3 C4 Rh 71.74(13) . . ?
C5 C4 Rh 69.73(12) . . ?
C1 C5 C4 110.1(2) . . ?
C1 C5 Rh 73.86(12) . . ?
C4 C5 Rh 72.72(13) . . ?
C16A C11A C12A 122.1(16) . . ?
C16A C11A P1 121.2(10) . . ?
C12A C11A P1 116.7(16) . . ?
C11A C12A C13A 119.6(14) . . ?
C14A C13A C12A 119.9(11) . . ?
C13A C14A C15A 120.2(14) . . ?
C14A C15A C16A 118.4(13) . . ?
C11A C16A C15A 119.5(13) . . ?
C12B C11B C16B 114(2) . . ?
C12B C11B P1 121(2) . . ?
C16B C11B P1 124.5(12) . . ?
C13B C12B C11B 125.1(17) . . ?
C14B C13B C12B 118.3(16) . . ?
C13B C14B C15B 121(2) . . ?
C16B C15B C14B 120.3(17) . . ?
C15B C16B C11B 120.6(14) . . ?
C26A C21A C22A 114.9(18) . . ?
C26A C21A P2 128.7(10) . . ?
C22A C21A P2 116.4(17) . . ?
C23A C22A C21A 124.1(17) . . ?
C24A C23A C22A 118.2(15) . . ?
C23A C24A C25A 122(2) . . ?
C24A C25A C26A 119.1(18) . . ?
C21A C26A C25A 121.4(13) . . ?
C22B C21B C26B 121.4(16) . . ?
C22B C21B P2 119.5(16) . . ?
C26B C21B P2 118.9(10) . . ?
C21B C22B C23B 119.2(16) . . ?
C24B C23B C22B 119.5(17) . . ?
C25B C24B C23B 119(2) . . ?
C24B C25B C26B 122.4(19) . . ?
C21B C26B C25B 117.8(12) . . ?
C32 C31 C36 115.74(18) . . ?
C32 C31 B 120.59(18) . . ?
C36 C31 B 123.58(18) . . ?
C33 C32 C31 122.3(2) . . ?
C34 C33 C32 120.9(2) . . ?
C34 C33 C37 118.1(2) . . ?
C32 C33 C37 121.0(2) . . ?
C35 C34 C33 117.99(19) . . ?
C34 C35 C36 120.9(2) . . ?
C34 C35 C38 119.72(19) . . ?
C36 C35 C38 119.4(2) . . ?
C35 C36 C31 122.2(2) . . ?
F33 C37 F32 107.9(3) . . ?
F33 C37 F31 107.1(3) . . ?
F32 C37 F31 103.3(2) . . ?
F33 C37 C33 113.5(2) . . ?
F32 C37 C33 112.2(2) . . ?
F31 C37 C33 112.2(3) . . ?
F34 C38 F35 108.0(2) . . ?
F34 C38 F36 107.6(3) . . ?
F35 C38 F36 103.5(2) . . ?
F34 C38 C35 112.8(2) . . ?
F35 C38 C35 113.1(2) . . ?
F36 C38 C35 111.1(2) . . ?
C42 C41 C46 115.87(19) . . ?
C42 C41 B 123.02(18) . . ?
C46 C41 B 121.08(19) . . ?
C43 C42 C41 122.4(2) . . ?
C44 C43 C42 120.6(2) . . ?
C44 C43 C47 119.8(2) . . ?
C42 C43 C47 119.6(2) . . ?
C45 C44 C43 118.1(2) . . ?
C44 C45 C46 121.1(2) . . ?
C44 C45 C48 119.9(2) . . ?
C46 C45 C48 119.0(2) . . ?
C45 C46 C41 121.9(2) . . ?
F43 C47 F42 104.6(4) . . ?
F43 C47 F41 106.7(3) . . ?
F42 C47 F41 104.6(3) . . ?
F43 C47 C43 113.4(3) . . ?
F42 C47 C43 113.0(3) . . ?
F41 C47 C43 113.7(3) . . ?
F44 C48 F46 107.1(2) . . ?
F44 C48 F45 105.4(2) . . ?
F46 C48 F45 106.3(2) . . ?
F44 C48 C45 113.0(2) . . ?
F46 C48 C45 112.7(2) . . ?
F45 C48 C45 111.8(2) . . ?
C52 C51 C56 115.76(19) . . ?
C52 C51 B 120.77(17) . . ?
C56 C51 B 123.45(18) . . ?
C53 C52 C51 122.37(19) . . ?
C52 C53 C54 120.9(2) . . ?
C52 C53 C57 119.4(2) . . ?
C54 C53 C57 119.7(2) . . ?
C55 C54 C53 117.9(2) . . ?
C54 C55 C56 121.2(2) . . ?
C54 C55 C58 119.0(2) . . ?
C56 C55 C58 119.8(2) . . ?
C55 C56 C51 121.9(2) . . ?
F56 C57 F55 106.5(2) . . ?
F56 C57 F54 105.8(2) . . ?
F55 C57 F54 105.7(2) . . ?
F56 C57 C53 112.8(2) . . ?
F55 C57 C53 112.7(2) . . ?
F54 C57 C53 112.7(2) . . ?
F52 C58 F53 106.1(3) . . ?
F52 C58 F51 106.2(3) . . ?
F53 C58 F51 103.0(3) . . ?
F52 C58 C55 114.1(2) . . ?
F53 C58 C55 112.9(3) . . ?
F51 C58 C55 113.7(2) . . ?
C1 B C51 108.99(16) . . ?
C1 B C31 113.84(17) . . ?
C51 B C31 109.76(16) . . ?
C1 B C41 105.76(15) . . ?
C51 B C41 110.30(17) . . ?
C31 B C41 108.11(16) . . ?

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
C5 C1 C2 C3 -3.5(2) . . . . ?
B C1 C2 C3 167.82(19) . . . . ?
Rh C1 C2 C3 -63.66(14) . . . . ?
C5 C1 C2 Rh 60.13(13) . . . . ?
B C1 C2 Rh -128.5(2) . . . . ?
C1 C2 C3 C4 2.1(2) . . . . ?
Rh C2 C3 C4 -62.50(16) . . . . ?
C1 C2 C3 Rh 64.58(14) . . . . ?
C2 C3 C4 C5 0.3(2) . . . . ?
Rh C3 C4 C5 -61.08(15) . . . . ?
C2 C3 C4 Rh 61.37(15) . . . . ?
C2 C1 C5 C4 3.7(2) . . . . ?
B C1 C5 C4 -168.32(18) . . . . ?
Rh C1 C5 C4 64.22(15) . . . . ?
C2 C1 C5 Rh -60.48(13) . . . . ?
B C1 C5 Rh 127.46(18) . . . . ?
C3 C4 C5 C1 -2.6(2) . . . . ?
Rh C4 C5 C1 -64.94(15) . . . . ?
C3 C4 C5 Rh 62.38(16) . . . . ?
C17 P1 C11A C16A -129.6(17) . . . . ?
C18 P1 C11A C16A -23(2) . . . . ?
Rh P1 C11A C16A 109.1(16) . . . . ?
C17 P1 C11A C12A 50.2(17) . . . . ?
C18 P1 C11A C12A 156.3(14) . . . . ?
Rh P1 C11A C12A -71.0(18) . . . . ?
C16A C11A C12A C13A -3(3) . . . . ?
P1 C11A C12A C13A 177.4(12) . . . . ?
C11A C12A C13A C14A -2(2) . . . . ?
C12A C13A C14A C15A 5(2) . . . . ?
C13A C14A C15A C16A -2(3) . . . . ?
C12A C11A C16A C15A 5(3) . . . . ?
P1 C11A C16A C15A -175.3(14) . . . . ?
C14A C15A C16A C11A -2(3) . . . . ?
C17 P1 C11B C12B 55.5(19) . . . . ?
C18 P1 C11B C12B 160.3(17) . . . . ?
Rh P1 C11B C12B -73(2) . . . . ?
C17 P1 C11B C16B -131.0(17) . . . . ?
C18 P1 C11B C16B -26(2) . . . . ?
Rh P1 C11B C16B 100.1(17) . . . . ?
C16B C11B C12B C13B 1(3) . . . . ?
P1 C11B C12B C13B 175.1(13) . . . . ?
C11B C12B C13B C14B -1(3) . . . . ?
C12B C13B C14B C15B 0(3) . . . . ?
C13B C14B C15B C16B 0(3) . . . . ?
C14B C15B C16B C11B 0(3) . . . . ?
C12B C11B C16B C15B -1(3) . . . . ?
P1 C11B C16B C15B -174.6(14) . . . . ?
C28 P2 C21A C26A 4(2) . . . . ?
C27 P2 C21A C26A -100.3(19) . . . . ?
Rh P2 C21A C26A 133.8(18) . . . . ?
C28 P2 C21A C22A -178.7(16) . . . . ?
C27 P2 C21A C22A 76.7(17) . . . . ?
Rh P2 C21A C22A -49.3(18) . . . . ?
C26A C21A C22A C23A -1(3) . . . . ?
P2 C21A C22A C23A -178(2) . . . . ?
C21A C22A C23A C24A 1(4) . . . . ?
C22A C23A C24A C25A -3(4) . . . . ?
C23A C24A C25A C26A 5(4) . . . . ?
C22A C21A C26A C25A 3(3) . . . . ?
P2 C21A C26A C25A -180.0(16) . . . . ?
C24A C25A C26A C21A -5(3) . . . . ?
C26B C21B C22B C23B 4(3) . . . . ?
P2 C21B C22B C23B 178.9(15) . . . . ?
C21B C22B C23B C24B -3(3) . . . . ?
C22B C23B C24B C25B 3(3) . . . . ?
C23B C24B C25B C26B -4(4) . . . . ?
C22B C21B C26B C25B -5(3) . . . . ?
P2 C21B C26B C25B 180.0(16) . . . . ?
C24B C25B C26B C21B 5(4) . . . . ?
C36 C31 C32 C33 0.5(3) . . . . ?
B C31 C32 C33 -176.3(2) . . . . ?
C31 C32 C33 C34 -1.5(4) . . . . ?
C31 C32 C33 C37 180.0(2) . . . . ?
C32 C33 C34 C35 0.8(4) . . . . ?
C37 C33 C34 C35 179.3(2) . . . . ?
C33 C34 C35 C36 0.9(3) . . . . ?
C33 C34 C35 C38 180.0(2) . . . . ?
C34 C35 C36 C31 -2.0(3) . . . . ?
C38 C35 C36 C31 178.9(2) . . . . ?
C32 C31 C36 C35 1.3(3) . . . . ?
B C31 C36 C35 177.89(19) . . . . ?
C34 C33 C37 F33 174.3(3) . . . . ?
C32 C33 C37 F33 -7.1(4) . . . . ?
C34 C33 C37 F32 -63.0(3) . . . . ?
C32 C33 C37 F32 115.5(3) . . . . ?
C34 C33 C37 F31 52.8(3) . . . . ?
C32 C33 C37 F31 -128.7(3) . . . . ?
C34 C35 C38 F34 -104.3(3) . . . . ?
C36 C35 C38 F34 74.8(3) . . . . ?
C34 C35 C38 F35 18.7(3) . . . . ?
C36 C35 C38 F35 -162.2(2) . . . . ?
C34 C35 C38 F36 134.7(2) . . . . ?
C36 C35 C38 F36 -46.2(3) . . . . ?
C46 C41 C42 C43 -1.4(3) . . . . ?
B C41 C42 C43 -179.3(2) . . . . ?
C41 C42 C43 C44 1.2(4) . . . . ?
C41 C42 C43 C47 -176.6(2) . . . . ?
C42 C43 C44 C45 -0.1(4) . . . . ?
C47 C43 C44 C45 177.7(3) . . . . ?
C43 C44 C45 C46 -0.7(3) . . . . ?
C43 C44 C45 C48 176.9(2) . . . . ?
C44 C45 C46 C41 0.5(3) . . . . ?
C48 C45 C46 C41 -177.2(2) . . . . ?
C42 C41 C46 C45 0.5(3) . . . . ?
B C41 C46 C45 178.44(18) . . . . ?
C44 C43 C47 F43 -100.0(4) . . . . ?
C42 C43 C47 F43 77.9(4) . . . . ?
C44 C43 C47 F42 141.2(3) . . . . ?
C42 C43 C47 F42 -40.9(4) . . . . ?
C44 C43 C47 F41 22.2(4) . . . . ?
C42 C43 C47 F41 -160.0(3) . . . . ?
C44 C45 C48 F44 141.9(2) . . . . ?
C46 C45 C48 F44 -40.4(3) . . . . ?
C44 C45 C48 F46 20.3(3) . . . . ?
C46 C45 C48 F46 -161.9(2) . . . . ?
C44 C45 C48 F45 -99.4(3) . . . . ?
C46 C45 C48 F45 78.3(3) . . . . ?
C56 C51 C52 C53 -1.2(3) . . . . ?
B C51 C52 C53 -179.5(2) . . . . ?
C51 C52 C53 C54 0.6(4) . . . . ?
C51 C52 C53 C57 179.3(2) . . . . ?
C52 C53 C54 C55 0.2(4) . . . . ?
C57 C53 C54 C55 -178.6(2) . . . . ?
C53 C54 C55 C56 -0.3(4) . . . . ?
C53 C54 C55 C58 178.6(3) . . . . ?
C54 C55 C56 C51 -0.3(4) . . . . ?
C58 C55 C56 C51 -179.3(2) . . . . ?
C52 C51 C56 C55 1.0(3) . . . . ?
B C51 C56 C55 179.3(2) . . . . ?
C52 C53 C57 F56 16.2(4) . . . . ?
C54 C53 C57 F56 -165.0(3) . . . . ?
C52 C53 C57 F55 -104.4(3) . . . . ?
C54 C53 C57 F55 74.4(3) . . . . ?
C52 C53 C57 F54 136.1(2) . . . . ?
C54 C53 C57 F54 -45.2(3) . . . . ?
C54 C55 C58 F52 30.9(4) . . . . ?
C56 C55 C58 F52 -150.1(3) . . . . ?
C54 C55 C58 F53 -90.3(4) . . . . ?
C56 C55 C58 F53 88.7(4) . . . . ?
C54 C55 C58 F51 152.9(3) . . . . ?
C56 C55 C58 F51 -28.1(4) . . . . ?
C2 C1 B C51 147.7(2) . . . . ?
C5 C1 B C51 -42.3(2) . . . . ?
Rh C1 B C51 49.1(2) . . . . ?
C2 C1 B C31 24.9(3) . . . . ?
C5 C1 B C31 -165.23(18) . . . . ?
Rh C1 B C31 -73.7(2) . . . . ?
C2 C1 B C41 -93.7(2) . . . . ?
C5 C1 B C41 76.2(2) . . . . ?
Rh C1 B C41 167.71(14) . . . . ?
C52 C51 B C1 78.7(2) . . . . ?
C56 C51 B C1 -99.6(2) . . . . ?
C52 C51 B C31 -156.05(19) . . . . ?
C56 C51 B C31 25.7(3) . . . . ?
C52 C51 B C41 -37.0(3) . . . . ?
C56 C51 B C41 144.7(2) . . . . ?
C32 C31 B C1 -151.69(19) . . . . ?
C36 C31 B C1 31.9(3) . . . . ?
C32 C31 B C51 85.8(2) . . . . ?
C36 C31 B C51 -90.6(2) . . . . ?
C32 C31 B C41 -34.5(3) . . . . ?
C36 C31 B C41 149.04(19) . . . . ?
C42 C41 B C1 -148.76(19) . . . . ?
C46 C41 B C1 33.5(2) . . . . ?
C42 C41 B C51 -31.1(3) . . . . ?
C46 C41 B C51 151.17(18) . . . . ?
C42 C41 B C31 89.0(2) . . . . ?
C46 C41 B C31 -88.8(2) . . . . ?

_refine_diff_density_max         1.112
_refine_diff_density_min         -0.806
_refine_diff_density_rms         0.060


####################################################################### 
# 
# 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_riv13f2_cmpd_5
_database_code_depnum_ccdc_archive 'CCDC 1416195'
_audit_update_record             
;
2015-07-30 deposited with the CCDC.
2015-09-09 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2013
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C41 H66 Cl2 Ge O5 P2 Pt W, 0.5(C6 H14)'
_chemical_formula_sum            'C44 H73 Cl2 Ge O5 P2 Pt W'
_chemical_formula_weight         1266.39

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'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ge Ge 0.1547 1.8001 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
W W -0.8490 6.8722 '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'

_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'

_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. 
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   10.172(2)
_cell_length_b                   12.807(3)
_cell_length_c                   20.478(4)
_cell_angle_alpha                105.848(2)
_cell_angle_beta                 103.959(2)
_cell_angle_gamma                93.004(3)
_cell_volume                     2470.6(8)
_cell_formula_units_Z            2
_cell_measurement_temperature    173(2)
_cell_measurement_reflns_used    9783
_cell_measurement_theta_min      2.23
_cell_measurement_theta_max      27.52

_exptl_crystal_description       fragment
_exptl_crystal_colour            yellow
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.702
_exptl_crystal_F_000             1250
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.297
_exptl_crystal_size_mid          0.099
_exptl_crystal_size_min          0.060
_exptl_absorpt_coefficient_mu    5.964
_shelx_estimated_absorpt_T_min   0.270
_shelx_estimated_absorpt_T_max   0.716
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_correction_T_min  0.3812
_exptl_absorpt_correction_T_max  0.7960
_exptl_absorpt_process_details   'SADABS (Sheldrick, 2008)'

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      173(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            22384
_diffrn_reflns_av_unetI/netI     0.0222
_diffrn_reflns_av_R_equivalents  0.0148
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_l_min       -26
_diffrn_reflns_limit_l_max       26
_diffrn_reflns_theta_min         1.072
_diffrn_reflns_theta_max         27.589
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.989
_diffrn_measured_fraction_theta_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.989
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.989
_diffrn_reflns_point_group_measured_fraction_full 0.999
_reflns_number_total             11338
_reflns_number_gt                9930
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_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. 
;

_computing_data_collection       'Bruker APEX2'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXT-2013 (Sheldrick 2013)'
_computing_structure_refinement  'SHELXL-2013 (Sheldrick, 2013)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'

_refine_special_details          
; 
 ? 
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0333P)²+0.5140P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         11338
_refine_ls_number_parameters     534
_refine_ls_number_restraints     3
_refine_ls_R_factor_all          0.0276
_refine_ls_R_factor_gt           0.0212
_refine_ls_wR_factor_ref         0.0603
_refine_ls_wR_factor_gt          0.0533
_refine_ls_goodness_of_fit_ref   1.117
_refine_ls_restrained_S_all      1.118
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000

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
Pt Pt 0.38138(2) 0.42202(2) 0.26899(2) 0.01895(4) Uani 1 1 d . . . . .
W W 0.33479(2) 0.18198(2) 0.04126(2) 0.02766(4) Uani 1 1 d . . . . .
Ge Ge 0.29273(3) 0.31805(2) 0.15041(2) 0.01764(7) Uani 1 1 d . . . . .
Cl1 Cl 0.48170(8) 0.51936(6) 0.39191(4) 0.02982(17) Uani 1 1 d . . . . .
Cl2 Cl 0.07760(8) 0.35748(7) 0.12046(4) 0.0374(2) Uani 1 1 d . . . . .
P1 P 0.33508(7) 0.27140(6) 0.30728(4) 0.01869(15) Uani 1 1 d . . . . .
P2 P 0.44572(8) 0.58025(6) 0.24119(4) 0.02103(15) Uani 1 1 d . . . . .
O1 O 0.3745(3) 0.0350(3) -0.10202(14) 0.0583(8) Uani 1 1 d . . . . .
O2 O 0.0118(3) 0.1176(2) -0.01439(15) 0.0546(8) Uani 1 1 d . . . . .
O3 O 0.3342(3) -0.0261(2) 0.09738(18) 0.0548(8) Uani 1 1 d . . . . .
O4 O 0.6563(3) 0.2231(2) 0.10624(16) 0.0516(7) Uani 1 1 d . . . . .
O5 O 0.3208(4) 0.3762(3) -0.02813(17) 0.0720(10) Uani 1 1 d . . . . .
C1 C 0.3609(4) 0.0873(3) -0.04894(19) 0.0392(9) Uani 1 1 d . . . . .
C2 C 0.1266(4) 0.1427(3) 0.00486(18) 0.0391(9) Uani 1 1 d . . . . .
C3 C 0.3347(3) 0.0488(3) 0.0781(2) 0.0357(8) Uani 1 1 d . . . . .
C4 C 0.5416(4) 0.2115(3) 0.08312(18) 0.0327(7) Uani 1 1 d . . . . .
C5 C 0.3272(4) 0.3080(3) -0.00164(19) 0.0424(9) Uani 1 1 d . . . . .
C11 C 0.2804(3) 0.3144(2) 0.38903(15) 0.0219(6) Uani 1 1 d . . . . .
H11 H 0.3626 0.3603 0.4248 0.026 Uiso 1 1 calc R U . . .
C12 C 0.1697(3) 0.3912(3) 0.38723(16) 0.0285(7) Uani 1 1 d . . . . .
H12A H 0.1933 0.4489 0.3667 0.034 Uiso 1 1 calc R U . . .
H12B H 0.0810 0.3495 0.3573 0.034 Uiso 1 1 calc R U . . .
C13 C 0.1585(4) 0.4434(3) 0.46199(18) 0.0399(9) Uani 1 1 d . . . . .
H13A H 0.2452 0.4897 0.4908 0.048 Uiso 1 1 calc R U . . .
H13B H 0.0847 0.4908 0.4606 0.048 Uiso 1 1 calc R U . . .
C14 C 0.1281(4) 0.3554(4) 0.49572(18) 0.0443(10) Uani 1 1 d . . . . .
H14A H 0.1273 0.3909 0.5450 0.053 Uiso 1 1 calc R U . . .
H14B H 0.0361 0.3153 0.4701 0.053 Uiso 1 1 calc R U . . .
C15 C 0.2323(4) 0.2745(3) 0.49491(17) 0.0359(8) Uani 1 1 d . . . . .
H15A H 0.2040 0.2158 0.5135 0.043 Uiso 1 1 calc R U . . .
H15B H 0.3221 0.3125 0.5260 0.043 Uiso 1 1 calc R U . . .
C16 C 0.2463(3) 0.2235(3) 0.42019(16) 0.0291(7) Uani 1 1 d . . . . .
H16A H 0.3196 0.1756 0.4217 0.035 Uiso 1 1 calc R U . . .
H16B H 0.1597 0.1783 0.3901 0.035 Uiso 1 1 calc R U . . .
C21 C 0.4922(3) 0.2080(2) 0.32981(15) 0.0217(6) Uani 1 1 d . . . . .
H21 H 0.4653 0.1383 0.3391 0.026 Uiso 1 1 calc R U . . .
C22 C 0.6013(3) 0.2775(3) 0.39554(16) 0.0283(7) Uani 1 1 d . . . . .
H22A H 0.6282 0.3484 0.3886 0.034 Uiso 1 1 calc R U . . .
H22B H 0.5628 0.2928 0.4367 0.034 Uiso 1 1 calc R U . . .
C23 C 0.7272(3) 0.2188(3) 0.41004(18) 0.0315(7) Uani 1 1 d . . . . .
H23A H 0.7969 0.2661 0.4518 0.038 Uiso 1 1 calc R U . . .
H23B H 0.7018 0.1506 0.4205 0.038 Uiso 1 1 calc R U . . .
C24 C 0.7869(3) 0.1912(3) 0.34679(19) 0.0372(8) Uani 1 1 d . . . . .
H24A H 0.8182 0.2596 0.3383 0.045 Uiso 1 1 calc R U . . .
H24B H 0.8668 0.1516 0.3568 0.045 Uiso 1 1 calc R U . . .
C25 C 0.6807(4) 0.1208(3) 0.28143(19) 0.0408(9) Uani 1 1 d . . . . .
H25A H 0.6552 0.0497 0.2884 0.049 Uiso 1 1 calc R U . . .
H25B H 0.7200 0.1063 0.2405 0.049 Uiso 1 1 calc R U . . .
C26 C 0.5536(3) 0.1780(3) 0.26655(16) 0.0314(7) Uani 1 1 d . . . . .
H26A H 0.4843 0.1292 0.2252 0.038 Uiso 1 1 calc R U . . .
H26B H 0.5778 0.2453 0.2549 0.038 Uiso 1 1 calc R U . . .
C31 C 0.2097(3) 0.1559(2) 0.24230(15) 0.0219(6) Uani 1 1 d . . . . .
H31 H 0.2316 0.1465 0.1961 0.026 Uiso 1 1 calc R U . . .
C32 C 0.2148(3) 0.0438(2) 0.25567(17) 0.0289(7) Uani 1 1 d . . . . .
H32A H 0.3077 0.0227 0.2582 0.035 Uiso 1 1 calc R U . . .
H32B H 0.1957 0.0491 0.3016 0.035 Uiso 1 1 calc R U . . .
C33 C 0.1111(4) -0.0445(3) 0.19773(19) 0.0360(8) Uani 1 1 d . . . . .
H33A H 0.1388 -0.0582 0.1533 0.043 Uiso 1 1 calc R U . . .
H33B H 0.1110 -0.1135 0.2108 0.043 Uiso 1 1 calc R U . . .
C34 C -0.0330(3) -0.0116(3) 0.1859(2) 0.0406(9) Uani 1 1 d . . . . .
H34A H -0.0656 -0.0069 0.2283 0.049 Uiso 1 1 calc R U . . .
H34B H -0.0956 -0.0683 0.1458 0.049 Uiso 1 1 calc R U . . .
C35 C -0.0352(3) 0.0988(3) 0.17055(19) 0.0377(8) Uani 1 1 d . . . . .
H35A H -0.0078 0.0932 0.1266 0.045 Uiso 1 1 calc R U . . .
H35B H -0.1289 0.1195 0.1640 0.045 Uiso 1 1 calc R U . . .
C36 C 0.0631(3) 0.1862(3) 0.23185(17) 0.0290(7) Uani 1 1 d . . . . .
H36A H 0.0341 0.1930 0.2755 0.035 Uiso 1 1 calc R U . . .
H36B H 0.0606 0.2578 0.2221 0.035 Uiso 1 1 calc R U . . .
C41 C 0.4385(3) 0.7031(2) 0.31263(15) 0.0240(6) Uani 1 1 d . . . . .
H41 H 0.5065 0.6961 0.3550 0.029 Uiso 1 1 calc R U . . .
C42 C 0.3021(3) 0.7045(3) 0.33308(17) 0.0300(7) Uani 1 1 d . . . . .
H42A H 0.2312 0.7234 0.2971 0.036 Uiso 1 1 calc R U . . .
H42B H 0.2716 0.6311 0.3352 0.036 Uiso 1 1 calc R U . . .
C43 C 0.3210(4) 0.7889(3) 0.40487(18) 0.0369(8) Uani 1 1 d . . . . .
H43A H 0.2331 0.7907 0.4176 0.044 Uiso 1 1 calc R U . . .
H43B H 0.3881 0.7674 0.4412 0.044 Uiso 1 1 calc R U . . .
C44 C 0.3710(4) 0.9022(3) 0.4032(2) 0.0418(9) Uani 1 1 d . . . . .
H44A H 0.3878 0.9547 0.4508 0.050 Uiso 1 1 calc R U . . .
H44B H 0.2995 0.9268 0.3706 0.050 Uiso 1 1 calc R U . . .
C45 C 0.5022(4) 0.9014(3) 0.37938(19) 0.0395(9) Uani 1 1 d . . . . .
H45A H 0.5765 0.8849 0.4149 0.047 Uiso 1 1 calc R U . . .
H45B H 0.5289 0.9748 0.3760 0.047 Uiso 1 1 calc R U . . .
C46 C 0.4841(4) 0.8158(3) 0.30743(18) 0.0323(7) Uani 1 1 d . . . . .
H46A H 0.4146 0.8346 0.2708 0.039 Uiso 1 1 calc R U . . .
H46B H 0.5714 0.8148 0.2941 0.039 Uiso 1 1 calc R U . . .
C51 C 0.6262(3) 0.5848(3) 0.23832(15) 0.0250(6) Uani 1 1 d . . . . .
H51 H 0.6509 0.6538 0.2277 0.030 Uiso 1 1 calc R U . . .
C52 C 0.7267(3) 0.5861(3) 0.30799(17) 0.0341(8) Uani 1 1 d . . . . .
H52A H 0.7197 0.6513 0.3457 0.041 Uiso 1 1 calc R U . . .
H52B H 0.7018 0.5203 0.3211 0.041 Uiso 1 1 calc R U . . .
C53 C 0.8736(4) 0.5882(4) 0.30225(19) 0.0480(11) Uani 1 1 d . . . . .
H53A H 0.9017 0.6576 0.2940 0.058 Uiso 1 1 calc R U . . .
H53B H 0.9347 0.5852 0.3472 0.058 Uiso 1 1 calc R U . . .
C54 C 0.8886(4) 0.4922(4) 0.2424(2) 0.0485(10) Uani 1 1 d . . . . .
H54A H 0.9837 0.4978 0.2385 0.058 Uiso 1 1 calc R U . . .
H54B H 0.8690 0.4227 0.2527 0.058 Uiso 1 1 calc R U . . .
C55 C 0.7916(4) 0.4919(4) 0.17363(19) 0.0424(9) Uani 1 1 d . . . . .
H55A H 0.7996 0.4272 0.1358 0.051 Uiso 1 1 calc R U . . .
H55B H 0.8169 0.5583 0.1613 0.051 Uiso 1 1 calc R U . . .
C56 C 0.6436(3) 0.4888(3) 0.17853(17) 0.0335(8) Uani 1 1 d . . . . .
H56A H 0.6157 0.4192 0.1866 0.040 Uiso 1 1 calc R U . . .
H56B H 0.5832 0.4915 0.1333 0.040 Uiso 1 1 calc R U . . .
C61 C 0.3533(3) 0.5966(3) 0.15506(16) 0.0272(7) Uani 1 1 d . . . . .
H61 H 0.3407 0.5227 0.1200 0.033 Uiso 1 1 calc R U . . .
C62 C 0.4274(4) 0.6749(3) 0.12649(17) 0.0357(8) Uani 1 1 d . . . . .
H62A H 0.4384 0.7506 0.1580 0.043 Uiso 1 1 calc R U . . .
H62B H 0.5195 0.6542 0.1255 0.043 Uiso 1 1 calc R U . . .
C63 C 0.3463(4) 0.6704(3) 0.05215(18) 0.0433(9) Uani 1 1 d . . . . .
H63A H 0.3924 0.7248 0.0360 0.052 Uiso 1 1 calc R U . . .
H63B H 0.3452 0.5970 0.0197 0.052 Uiso 1 1 calc R U . . .
C64 C 0.2010(4) 0.6936(3) 0.0492(2) 0.0485(10) Uani 1 1 d . . . . .
H64A H 0.2016 0.7707 0.0761 0.058 Uiso 1 1 calc R U . . .
H64B H 0.1502 0.6834 -0.0004 0.058 Uiso 1 1 calc R U . . .
C65 C 0.1288(4) 0.6190(3) 0.07903(19) 0.0446(9) Uani 1 1 d . . . . .
H65A H 0.1182 0.5426 0.0487 0.053 Uiso 1 1 calc R U . . .
H65B H 0.0365 0.6398 0.0793 0.053 Uiso 1 1 calc R U . . .
C66 C 0.2096(3) 0.6265(3) 0.15460(17) 0.0330(7) Uani 1 1 d . . . . .
H66A H 0.2155 0.7018 0.1858 0.040 Uiso 1 1 calc R U . . .
H66B H 0.1617 0.5759 0.1727 0.040 Uiso 1 1 calc R U . . .
C1SA C 0.0077(14) -0.0033(10) 0.4654(5) 0.070(3) Uani 0.6 1 d . . P A 1
H1SA H 0.1046 -0.0105 0.4666 0.084 Uiso 0.6 1 calc R U P A 1
H1SB H -0.0109 0.0674 0.4564 0.084 Uiso 0.6 1 calc R U P A 1
C2SA C -0.0770(12) -0.0915(10) 0.4046(5) 0.068(3) Uani 0.6 1 d . . P A 1
H2SA H -0.0597 -0.1621 0.4139 0.081 Uiso 0.6 1 calc R U P A 1
H2SB H -0.1740 -0.0835 0.4028 0.081 Uiso 0.6 1 calc R U P A 1
C3SA C -0.0593(14) -0.0983(8) 0.3370(6) 0.089(3) Uani 0.6 1 d . . P A 1
H3SA H -0.1367 -0.1456 0.3007 0.106 Uiso 0.6 1 calc R U P A 1
H3SB H 0.0255 -0.1291 0.3325 0.106 Uiso 0.6 1 calc R U P A 1
H3SC H -0.0544 -0.0251 0.3309 0.106 Uiso 0.6 1 calc R U P A 1
C1SB C 0.052(3) -0.0356(14) 0.4848(12) 0.119(10) Uani 0.4 1 d D . P B 2
H1SC H 0.0483 -0.1065 0.4954 0.143 Uiso 0.4 1 calc R U P B 2
H1SD H 0.1459 0.0028 0.5050 0.143 Uiso 0.4 1 calc R U P B 2
C2SB C 0.0048(16) -0.0536(16) 0.4028(10) 0.091(5) Uani 0.4 1 d D . P B 2
H2SC H 0.0289 0.0162 0.3940 0.110 Uiso 0.4 1 calc R U P B 2
H2SD H 0.0585 -0.1078 0.3803 0.110 Uiso 0.4 1 calc R U P B 2
C3SB C -0.1452(16) -0.0919(17) 0.3665(14) 0.113(8) Uani 0.4 1 d D . P B 2
H3SD H -0.1625 -0.0976 0.3163 0.136 Uiso 0.4 1 calc R U P B 2
H3SE H -0.2004 -0.0392 0.3879 0.136 Uiso 0.4 1 calc R U P B 2
H3SF H -0.1698 -0.1637 0.3716 0.136 Uiso 0.4 1 calc R U P B 2


_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
Pt P1 2.3381(8) . ?
Pt P2 2.3516(9) . ?
Pt Ge 2.3526(5) . ?
Pt Cl1 2.4176(8) . ?
W C1 2.000(4) . ?
W C5 2.034(4) . ?
W C4 2.043(4) . ?
W C3 2.045(4) . ?
W C2 2.054(4) . ?
W Ge 2.5745(5) . ?
Ge Cl2 2.2489(9) . ?
P1 C11 1.842(3) . ?
P1 C21 1.847(3) . ?
P1 C31 1.869(3) . ?
P2 C51 1.849(3) . ?
P2 C41 1.852(3) . ?
P2 C61 1.860(3) . ?
O1 C1 1.155(4) . ?
O2 C2 1.136(4) . ?
O3 C3 1.133(4) . ?
O4 C4 1.133(4) . ?
O5 C5 1.144(5) . ?
C11 C16 1.533(4) . ?
C11 C12 1.533(4) . ?
C12 C13 1.529(4) . ?
C13 C14 1.528(6) . ?
C14 C15 1.521(5) . ?
C15 C16 1.535(4) . ?
C21 C22 1.535(4) . ?
C21 C26 1.536(4) . ?
C22 C23 1.527(4) . ?
C23 C24 1.524(5) . ?
C24 C25 1.521(5) . ?
C25 C26 1.527(4) . ?
C31 C32 1.534(4) . ?
C31 C36 1.541(4) . ?
C32 C33 1.529(4) . ?
C33 C34 1.528(5) . ?
C34 C35 1.530(5) . ?
C35 C36 1.530(4) . ?
C41 C46 1.531(4) . ?
C41 C42 1.542(4) . ?
C42 C43 1.530(5) . ?
C43 C44 1.525(5) . ?
C44 C45 1.527(5) . ?
C45 C46 1.540(5) . ?
C51 C56 1.532(4) . ?
C51 C52 1.537(4) . ?
C52 C53 1.526(5) . ?
C53 C54 1.525(5) . ?
C54 C55 1.511(5) . ?
C55 C56 1.532(5) . ?
C61 C66 1.528(5) . ?
C61 C62 1.540(5) . ?
C62 C63 1.530(5) . ?
C63 C64 1.513(6) . ?
C64 C65 1.513(6) . ?
C65 C66 1.542(5) . ?
C1SA C1SA 1.44(2) 2_556 ?
C1SA C2SA 1.477(15) . ?
C2SA C3SA 1.419(14) . ?
C1SB C1SB 1.56(2) 2_556 ?
C1SB C2SB 1.578(19) . ?
C2SB C3SB 1.516(17) . ?

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
P1 Pt P2 174.18(3) . . ?
P1 Pt Ge 91.40(2) . . ?
P2 Pt Ge 93.82(2) . . ?
P1 Pt Cl1 86.21(3) . . ?
P2 Pt Cl1 88.45(3) . . ?
Ge Pt Cl1 176.20(2) . . ?
C1 W C5 87.70(15) . . ?
C1 W C4 89.96(14) . . ?
C5 W C4 94.24(16) . . ?
C1 W C3 89.46(16) . . ?
C5 W C3 176.23(15) . . ?
C4 W C3 88.24(14) . . ?
C1 W C2 91.40(14) . . ?
C5 W C2 91.00(17) . . ?
C4 W C2 174.64(15) . . ?
C3 W C2 86.59(15) . . ?
C1 W Ge 174.08(11) . . ?
C5 W Ge 86.62(10) . . ?
C4 W Ge 92.11(9) . . ?
C3 W Ge 96.14(10) . . ?
C2 W Ge 87.05(9) . . ?
Cl2 Ge Pt 104.87(2) . . ?
Cl2 Ge W 107.66(2) . . ?
Pt Ge W 147.463(16) . . ?
C11 P1 C21 105.60(13) . . ?
C11 P1 C31 109.09(13) . . ?
C21 P1 C31 103.99(13) . . ?
C11 P1 Pt 110.80(10) . . ?
C21 P1 Pt 110.10(10) . . ?
C31 P1 Pt 116.53(10) . . ?
C51 P2 C41 105.70(14) . . ?
C51 P2 C61 103.93(14) . . ?
C41 P2 C61 109.12(14) . . ?
C51 P2 Pt 109.61(10) . . ?
C41 P2 Pt 109.53(10) . . ?
C61 P2 Pt 118.15(11) . . ?
O1 C1 W 177.9(4) . . ?
O2 C2 W 177.4(4) . . ?
O3 C3 W 178.8(3) . . ?
O4 C4 W 177.0(3) . . ?
O5 C5 W 177.5(4) . . ?
C16 C11 C12 111.0(3) . . ?
C16 C11 P1 116.5(2) . . ?
C12 C11 P1 114.5(2) . . ?
C13 C12 C11 109.6(3) . . ?
C14 C13 C12 110.6(3) . . ?
C15 C14 C13 112.4(3) . . ?
C14 C15 C16 111.4(3) . . ?
C11 C16 C15 109.7(3) . . ?
C22 C21 C26 109.8(2) . . ?
C22 C21 P1 114.8(2) . . ?
C26 C21 P1 109.8(2) . . ?
C23 C22 C21 111.1(3) . . ?
C24 C23 C22 110.8(3) . . ?
C25 C24 C23 110.6(3) . . ?
C24 C25 C26 110.7(3) . . ?
C25 C26 C21 111.9(3) . . ?
C32 C31 C36 110.2(3) . . ?
C32 C31 P1 116.8(2) . . ?
C36 C31 P1 111.0(2) . . ?
C33 C32 C31 111.9(3) . . ?
C34 C33 C32 112.0(3) . . ?
C33 C34 C35 110.8(3) . . ?
C36 C35 C34 109.7(3) . . ?
C35 C36 C31 110.4(3) . . ?
C46 C41 C42 109.9(3) . . ?
C46 C41 P2 118.5(2) . . ?
C42 C41 P2 114.1(2) . . ?
C43 C42 C41 109.5(3) . . ?
C44 C43 C42 110.6(3) . . ?
C43 C44 C45 111.2(3) . . ?
C44 C45 C46 111.5(3) . . ?
C41 C46 C45 108.8(3) . . ?
C56 C51 C52 109.7(3) . . ?
C56 C51 P2 110.4(2) . . ?
C52 C51 P2 113.9(2) . . ?
C53 C52 C51 111.6(3) . . ?
C54 C53 C52 111.5(3) . . ?
C55 C54 C53 110.4(3) . . ?
C54 C55 C56 111.3(3) . . ?
C55 C56 C51 111.7(3) . . ?
C66 C61 C62 109.7(3) . . ?
C66 C61 P2 112.0(2) . . ?
C62 C61 P2 116.5(2) . . ?
C63 C62 C61 110.5(3) . . ?
C64 C63 C62 112.1(3) . . ?
C65 C64 C63 111.6(3) . . ?
C64 C65 C66 111.0(3) . . ?
C61 C66 C65 109.9(3) . . ?
C1SA C1SA C2SA 118.5(12) 2_556 . ?
C3SA C2SA C1SA 118.0(11) . . ?
C1SB C1SB C2SB 105(2) 2_556 . ?
C3SB C2SB C1SB 116.9(19) . . ?

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
P1 Pt Ge Cl2 97.77(3) . . . . ?
P2 Pt Ge Cl2 -84.82(4) . . . . ?
P1 Pt Ge W -83.04(3) . . . . ?
P2 Pt Ge W 94.36(3) . . . . ?
Ge Pt P1 C11 -143.60(10) . . . . ?
Cl1 Pt P1 C11 39.36(10) . . . . ?
Ge Pt P1 C21 99.96(10) . . . . ?
Cl1 Pt P1 C21 -77.09(10) . . . . ?
Ge Pt P1 C31 -18.10(11) . . . . ?
Cl1 Pt P1 C31 164.86(11) . . . . ?
Ge Pt P2 C51 -93.96(10) . . . . ?
Cl1 Pt P2 C51 82.98(10) . . . . ?
Ge Pt P2 C41 150.49(11) . . . . ?
Cl1 Pt P2 C41 -32.57(11) . . . . ?
Ge Pt P2 C61 24.75(12) . . . . ?
Cl1 Pt P2 C61 -158.30(12) . . . . ?
C21 P1 C11 C16 -60.9(2) . . . . ?
C31 P1 C11 C16 50.3(3) . . . . ?
Pt P1 C11 C16 179.91(19) . . . . ?
C21 P1 C11 C12 167.3(2) . . . . ?
C31 P1 C11 C12 -81.5(2) . . . . ?
Pt P1 C11 C12 48.1(2) . . . . ?
C16 C11 C12 C13 59.7(3) . . . . ?
P1 C11 C12 C13 -165.9(2) . . . . ?
C11 C12 C13 C14 -57.0(4) . . . . ?
C12 C13 C14 C15 55.1(4) . . . . ?
C13 C14 C15 C16 -54.2(4) . . . . ?
C12 C11 C16 C15 -58.4(3) . . . . ?
P1 C11 C16 C15 168.2(2) . . . . ?
C14 C15 C16 C11 55.1(4) . . . . ?
C11 P1 C21 C22 -50.8(3) . . . . ?
C31 P1 C21 C22 -165.6(2) . . . . ?
Pt P1 C21 C22 68.8(2) . . . . ?
C11 P1 C21 C26 -175.1(2) . . . . ?
C31 P1 C21 C26 70.1(2) . . . . ?
Pt P1 C21 C26 -55.5(2) . . . . ?
C26 C21 C22 C23 -55.6(4) . . . . ?
P1 C21 C22 C23 -180.0(2) . . . . ?
C21 C22 C23 C24 57.5(4) . . . . ?
C22 C23 C24 C25 -57.7(4) . . . . ?
C23 C24 C25 C26 56.8(4) . . . . ?
C24 C25 C26 C21 -56.2(4) . . . . ?
C22 C21 C26 C25 55.2(4) . . . . ?
P1 C21 C26 C25 -177.6(3) . . . . ?
C11 P1 C31 C32 -74.3(2) . . . . ?
C21 P1 C31 C32 38.0(3) . . . . ?
Pt P1 C31 C32 159.32(19) . . . . ?
C11 P1 C31 C36 53.2(3) . . . . ?
C21 P1 C31 C36 165.5(2) . . . . ?
Pt P1 C31 C36 -73.2(2) . . . . ?
C36 C31 C32 C33 54.1(4) . . . . ?
P1 C31 C32 C33 -178.0(2) . . . . ?
C31 C32 C33 C34 -53.1(4) . . . . ?
C32 C33 C34 C35 55.0(4) . . . . ?
C33 C34 C35 C36 -58.2(4) . . . . ?
C34 C35 C36 C31 60.0(4) . . . . ?
C32 C31 C36 C35 -57.9(4) . . . . ?
P1 C31 C36 C35 171.1(2) . . . . ?
C51 P2 C41 C46 58.7(3) . . . . ?
C61 P2 C41 C46 -52.5(3) . . . . ?
Pt P2 C41 C46 176.7(2) . . . . ?
C51 P2 C41 C42 -169.5(2) . . . . ?
C61 P2 C41 C42 79.3(3) . . . . ?
Pt P2 C41 C42 -51.4(2) . . . . ?
C46 C41 C42 C43 -60.9(3) . . . . ?
P2 C41 C42 C43 163.2(2) . . . . ?
C41 C42 C43 C44 58.2(4) . . . . ?
C42 C43 C44 C45 -55.7(4) . . . . ?
C43 C44 C45 C46 55.6(4) . . . . ?
C42 C41 C46 C45 59.8(4) . . . . ?
P2 C41 C46 C45 -166.5(2) . . . . ?
C44 C45 C46 C41 -57.3(4) . . . . ?
C41 P2 C51 C56 -177.6(2) . . . . ?
C61 P2 C51 C56 -62.7(2) . . . . ?
Pt P2 C51 C56 64.4(2) . . . . ?
C41 P2 C51 C52 58.5(3) . . . . ?
C61 P2 C51 C52 173.4(2) . . . . ?
Pt P2 C51 C52 -59.5(2) . . . . ?
C56 C51 C52 C53 54.9(4) . . . . ?
P2 C51 C52 C53 179.2(3) . . . . ?
C51 C52 C53 C54 -56.2(5) . . . . ?
C52 C53 C54 C55 56.4(5) . . . . ?
C53 C54 C55 C56 -56.5(5) . . . . ?
C54 C55 C56 C51 56.9(4) . . . . ?
C52 C51 C56 C55 -55.1(4) . . . . ?
P2 C51 C56 C55 178.6(3) . . . . ?
C51 P2 C61 C66 -164.2(2) . . . . ?
C41 P2 C61 C66 -51.8(3) . . . . ?
Pt P2 C61 C66 74.1(2) . . . . ?
C51 P2 C61 C62 -36.8(3) . . . . ?
C41 P2 C61 C62 75.6(3) . . . . ?
Pt P2 C61 C62 -158.5(2) . . . . ?
C66 C61 C62 C63 -57.6(4) . . . . ?
P2 C61 C62 C63 173.8(2) . . . . ?
C61 C62 C63 C64 55.1(4) . . . . ?
C62 C63 C64 C65 -54.0(4) . . . . ?
C63 C64 C65 C66 55.2(4) . . . . ?
C62 C61 C66 C65 59.0(4) . . . . ?
P2 C61 C66 C65 -170.0(2) . . . . ?
C64 C65 C66 C61 -58.1(4) . . . . ?
C1SA C1SA C2SA C3SA -178.9(16) 2_556 . . . ?
C1SB C1SB C2SB C3SB -49(3) 2_556 . . . ?

_refine_diff_density_max         1.248
_refine_diff_density_min         -1.042
_refine_diff_density_rms         0.128

_shelxl_version_number           2013-3

####################################################################### 
# 
# 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_riv13g2_cmpd_6
_database_code_depnum_ccdc_archive 'CCDC 1416196'
_audit_update_record             
;
2015-07-30 deposited with the CCDC.
2015-09-09 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2013
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C47 H80 Cl2 O5 P2 Pt Sn W'
_chemical_formula_weight         1355.58

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'
Cl Cl 0.1484 0.1585 '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'
W W -0.8490 6.8722 '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'

_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'

_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. 
;

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                   14.8910(4)
_cell_length_b                   16.3240(4)
_cell_length_c                   22.1599(6)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_volume                     5386.6(2)
_cell_formula_units_Z            4
_cell_measurement_temperature    173(2)
_cell_measurement_reflns_used    9906
_cell_measurement_theta_min      2.22
_cell_measurement_theta_max      25.81

_exptl_crystal_description       fragment
_exptl_crystal_colour            orange
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.672
_exptl_crystal_F_000             2672
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.238
_exptl_crystal_size_mid          0.182
_exptl_crystal_size_min          0.092
_exptl_absorpt_coefficient_mu    5.379
_shelx_estimated_absorpt_T_min   0.361
_shelx_estimated_absorpt_T_max   0.637
_exptl_absorpt_correction_type   integration
_exptl_absorpt_correction_T_min  0.4584
_exptl_absorpt_correction_T_max  0.6982
_exptl_absorpt_process_details   'SADABS (Sheldrick, 2008)'

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      173(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            47820
_diffrn_reflns_av_unetI/netI     0.0326
_diffrn_reflns_av_R_equivalents  0.0289
_diffrn_reflns_limit_h_min       -19
_diffrn_reflns_limit_h_max       19
_diffrn_reflns_limit_k_min       -21
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_l_min       -28
_diffrn_reflns_limit_l_max       28
_diffrn_reflns_theta_min         1.549
_diffrn_reflns_theta_max         27.490
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measured_fraction_theta_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 1.000
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.997
_diffrn_reflns_point_group_measured_fraction_full 0.996
_reflns_number_total             12339
_reflns_number_gt                11780
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.818
_reflns_Friedel_fraction_max     0.994
_reflns_Friedel_fraction_full    0.993

_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. 
;

_computing_data_collection       'Bruker APEX2'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXT (Sheldrick 2008)'
_computing_structure_refinement  'SHELXL-2013 (Sheldrick, 2013)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'

_refine_special_details          
; 
 ? 
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0115P)²] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_abs_structure_details 
; 
 Flack x determined using 5110 quotients [(I+)-(I-)]/[(I+)+(I-)] 
 (Parsons and Flack (2004), Acta Cryst. A60, s61). 
;
_refine_ls_abs_structure_Flack   0.0093(19)
_chemical_absolute_configuration ?
_refine_ls_number_reflns         12339
_refine_ls_number_parameters     512
_refine_ls_number_restraints     18
_refine_ls_R_factor_all          0.0193
_refine_ls_R_factor_gt           0.0176
_refine_ls_wR_factor_ref         0.0404
_refine_ls_wR_factor_gt          0.0399
_refine_ls_goodness_of_fit_ref   1.005
_refine_ls_restrained_S_all      1.008
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000

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
Pt Pt -0.00361(2) 0.04966(2) 0.04345(2) 0.01963(4) Uani 1 1 d . . . . .
W W 0.21272(2) -0.10637(2) 0.17069(2) 0.02977(5) Uani 1 1 d . . . . .
Sn Sn 0.11222(2) -0.05292(2) 0.07543(2) 0.02217(6) Uani 1 1 d . . . . .
Cl1 Cl -0.11567(8) 0.15364(7) 0.02611(6) 0.0346(3) Uani 1 1 d . . . . .
Cl2 Cl 0.15099(8) -0.13452(7) -0.01165(5) 0.0337(3) Uani 1 1 d . . . . .
P1 P -0.11927(7) -0.03590(6) 0.07632(5) 0.0218(2) Uani 1 1 d . . . . .
P2 P 0.10789(8) 0.14078(7) 0.01092(5) 0.0217(2) Uani 1 1 d . . . . .
O1 O 0.3317(3) -0.1703(3) 0.27741(19) 0.0766(15) Uani 1 1 d . . . . .
O2 O 0.1422(3) 0.0415(2) 0.25176(16) 0.0584(11) Uani 1 1 d . . . . .
O3 O 0.0524(3) -0.2096(3) 0.2253(2) 0.0642(12) Uani 1 1 d . . . . .
O4 O 0.2655(3) -0.2625(3) 0.0933(2) 0.0720(14) Uani 1 1 d . . . . .
O5 O 0.3774(3) -0.0055(3) 0.1186(3) 0.0893(17) Uani 1 1 d . . . . .
C1 C 0.2887(4) -0.1459(3) 0.2388(2) 0.0497(14) Uani 1 1 d . . . . .
C2 C 0.1686(4) -0.0115(3) 0.2214(2) 0.0403(12) Uani 1 1 d . . . . .
C3 C 0.1097(4) -0.1725(3) 0.2048(2) 0.0394(12) Uani 1 1 d . . . . .
C4 C 0.2473(4) -0.2055(4) 0.1203(2) 0.0452(13) Uani 1 1 d . . . . .
C5 C 0.3182(4) -0.0409(4) 0.1379(3) 0.0530(15) Uani 1 1 d . . . . .
C11 C -0.0908(3) -0.1472(2) 0.0805(2) 0.0259(9) Uani 1 1 d . . . . .
H11 H -0.0308 -0.1496 0.1007 0.031 Uiso 1 1 calc R U . . .
C12 C -0.0759(3) -0.1829(3) 0.0180(2) 0.0309(10) Uani 1 1 d . . . . .
H12A H -0.0348 -0.1470 -0.0050 0.037 Uiso 1 1 calc R U . . .
H12B H -0.1338 -0.1854 -0.0038 0.037 Uiso 1 1 calc R U . . .
C13 C -0.0354(4) -0.2697(3) 0.0225(3) 0.0430(13) Uani 1 1 d . . . . .
H13A H -0.0274 -0.2925 -0.0186 0.052 Uiso 1 1 calc R U . . .
H13B H 0.0245 -0.2666 0.0418 0.052 Uiso 1 1 calc R U . . .
C14 C -0.0950(4) -0.3252(3) 0.0585(3) 0.0470(14) Uani 1 1 d . . . . .
H14A H -0.0664 -0.3797 0.0621 0.056 Uiso 1 1 calc R U . . .
H14B H -0.1529 -0.3322 0.0371 0.056 Uiso 1 1 calc R U . . .
C15 C -0.1127(4) -0.2901(3) 0.1222(3) 0.0460(13) Uani 1 1 d . . . . .
H15A H -0.1555 -0.3259 0.1439 0.055 Uiso 1 1 calc R U . . .
H15B H -0.0558 -0.2890 0.1453 0.055 Uiso 1 1 calc R U . . .
C16 C -0.1514(4) -0.2030(3) 0.1179(2) 0.0395(12) Uani 1 1 d . . . . .
H16A H -0.2118 -0.2052 0.0993 0.047 Uiso 1 1 calc R U . . .
H16B H -0.1579 -0.1799 0.1590 0.047 Uiso 1 1 calc R U . . .
C21 C -0.2189(3) -0.0222(3) 0.02792(19) 0.0277(9) Uani 1 1 d . . . . .
H21 H -0.2387 0.0354 0.0355 0.033 Uiso 1 1 calc R U . . .
C22 C -0.1989(3) -0.0252(3) -0.0394(2) 0.0341(10) Uani 1 1 d . . . . .
H22A H -0.1868 -0.0824 -0.0518 0.041 Uiso 1 1 calc R U . . .
H22B H -0.1449 0.0080 -0.0484 0.041 Uiso 1 1 calc R U . . .
C23 C -0.2799(4) 0.0086(3) -0.0751(2) 0.0468(13) Uani 1 1 d . . . . .
H23A H -0.2890 0.0671 -0.0649 0.056 Uiso 1 1 calc R U . . .
H23B H -0.2675 0.0048 -0.1189 0.056 Uiso 1 1 calc R U . . .
C24 C -0.3646(4) -0.0395(4) -0.0602(3) 0.0547(16) Uani 1 1 d . . . . .
H24A H -0.4165 -0.0137 -0.0808 0.066 Uiso 1 1 calc R U . . .
H24B H -0.3584 -0.0960 -0.0758 0.066 Uiso 1 1 calc R U . . .
C25 C -0.3823(3) -0.0425(4) 0.0065(3) 0.0493(14) Uani 1 1 d . . . . .
H25A H -0.4348 -0.0782 0.0142 0.059 Uiso 1 1 calc R U . . .
H25B H -0.3973 0.0132 0.0209 0.059 Uiso 1 1 calc R U . . .
C26 C -0.3019(3) -0.0747(3) 0.0421(2) 0.0383(11) Uani 1 1 d . . . . .
H26A H -0.2902 -0.1325 0.0309 0.046 Uiso 1 1 calc R U . . .
H26B H -0.3151 -0.0725 0.0858 0.046 Uiso 1 1 calc R U . . .
C31 C -0.1557(3) -0.0086(3) 0.15360(19) 0.0285(10) Uani 1 1 d . . . . .
H31 H -0.2028 -0.0487 0.1664 0.034 Uiso 1 1 calc R U . . .
C32 C -0.0768(4) -0.0156(3) 0.1973(2) 0.0404(12) Uani 1 1 d . . . . .
H32A H -0.0282 0.0219 0.1842 0.048 Uiso 1 1 calc R U . . .
H32B H -0.0530 -0.0722 0.1962 0.048 Uiso 1 1 calc R U . . .
C33 C -0.1043(5) 0.0059(4) 0.2624(2) 0.0544(16) Uani 1 1 d . . . . .
H33A H -0.1472 -0.0357 0.2775 0.065 Uiso 1 1 calc R U . . .
H33B H -0.0506 0.0046 0.2887 0.065 Uiso 1 1 calc R U . . .
C34 C -0.1472(5) 0.0898(3) 0.2656(3) 0.0611(18) Uani 1 1 d . . . . .
H34A H -0.1689 0.0997 0.3072 0.073 Uiso 1 1 calc R U . . .
H34B H -0.1015 0.1319 0.2562 0.073 Uiso 1 1 calc R U . . .
C35 C -0.2235(5) 0.0976(4) 0.2229(3) 0.071(2) Uani 1 1 d . . . . .
H35A H -0.2468 0.1544 0.2241 0.086 Uiso 1 1 calc R U . . .
H35B H -0.2725 0.0604 0.2355 0.086 Uiso 1 1 calc R U . . .
C36 C -0.1952(4) 0.0766(3) 0.1579(2) 0.0504(15) Uani 1 1 d . . . . .
H36A H -0.2482 0.0804 0.1310 0.060 Uiso 1 1 calc R U . . .
H36B H -0.1502 0.1170 0.1439 0.060 Uiso 1 1 calc R U . . .
C41 C 0.2120(3) 0.0931(2) -0.01900(18) 0.0246(9) Uani 1 1 d . . . . .
H41 H 0.2261 0.0460 0.0082 0.029 Uiso 1 1 calc R U . . .
C42 C 0.1957(3) 0.0564(3) -0.08217(18) 0.0278(9) Uani 1 1 d . . . . .
H42A H 0.1429 0.0196 -0.0808 0.033 Uiso 1 1 calc R U . . .
H42B H 0.1825 0.1010 -0.1110 0.033 Uiso 1 1 calc R U . . .
C43 C 0.2772(3) 0.0086(3) -0.1039(2) 0.0372(11) Uani 1 1 d . . . . .
H43A H 0.2659 -0.0120 -0.1452 0.045 Uiso 1 1 calc R U . . .
H43B H 0.2869 -0.0393 -0.0772 0.045 Uiso 1 1 calc R U . . .
C44 C 0.3619(3) 0.0624(3) -0.1040(2) 0.0434(13) Uani 1 1 d . . . . .
H44A H 0.4145 0.0292 -0.1162 0.052 Uiso 1 1 calc R U . . .
H44B H 0.3547 0.1074 -0.1336 0.052 Uiso 1 1 calc R U . . .
C45 C 0.3774(3) 0.0973(4) -0.0429(3) 0.0483(13) Uani 1 1 d . . . . .
H45A H 0.4314 0.1327 -0.0440 0.058 Uiso 1 1 calc R U . . .
H45B H 0.3892 0.0521 -0.0142 0.058 Uiso 1 1 calc R U . . .
C46 C 0.2970(3) 0.1478(3) -0.0203(2) 0.0400(12) Uani 1 1 d . . . . .
H46A H 0.2870 0.1952 -0.0473 0.048 Uiso 1 1 calc R U . . .
H46B H 0.3095 0.1689 0.0208 0.048 Uiso 1 1 calc R U . . .
C51 C 0.0615(3) 0.2138(2) -0.0446(2) 0.0268(9) Uani 1 1 d . . . . .
H51 H 0.0124 0.2422 -0.0220 0.032 Uiso 1 1 calc R U . . .
C52 C 0.0125(3) 0.1728(3) -0.09807(19) 0.0322(10) Uani 1 1 d . . . . .
H52A H 0.0570 0.1499 -0.1267 0.039 Uiso 1 1 calc R U . . .
H52B H -0.0256 0.1274 -0.0832 0.039 Uiso 1 1 calc R U . . .
C53 C -0.0452(4) 0.2366(3) -0.1296(2) 0.0440(13) Uani 1 1 d . . . . .
H53A H -0.0753 0.2111 -0.1647 0.053 Uiso 1 1 calc R U . . .
H53B H -0.0923 0.2558 -0.1015 0.053 Uiso 1 1 calc R U . . .
C54 C 0.0093(4) 0.3086(3) -0.1507(2) 0.0515(14) Uani 1 1 d . . . . .
H54A H -0.0314 0.3504 -0.1681 0.062 Uiso 1 1 calc R U . . .
H54B H 0.0511 0.2906 -0.1828 0.062 Uiso 1 1 calc R U . . .
C55 C 0.0625(4) 0.3466(3) -0.0994(2) 0.0457(14) Uani 1 1 d . . . . .
H55A H 0.0204 0.3714 -0.0700 0.055 Uiso 1 1 calc R U . . .
H55B H 0.1011 0.3908 -0.1156 0.055 Uiso 1 1 calc R U . . .
C56 C 0.1212(3) 0.2840(3) -0.0670(2) 0.0367(11) Uani 1 1 d . . . . .
H56A H 0.1520 0.3102 -0.0324 0.044 Uiso 1 1 calc R U . . .
H56B H 0.1674 0.2625 -0.0949 0.044 Uiso 1 1 calc R U . . .
C61 C 0.1455(3) 0.2060(3) 0.07398(19) 0.0280(9) Uani 1 1 d . . . . .
H61 H 0.1918 0.2449 0.0583 0.034 Uiso 1 1 calc R U . . .
C62 C 0.1887(3) 0.1539(3) 0.1238(2) 0.0358(11) Uani 1 1 d . . . . .
H62A H 0.1444 0.1134 0.1387 0.043 Uiso 1 1 calc R U . . .
H62B H 0.2403 0.1234 0.1068 0.043 Uiso 1 1 calc R U . . .
C63 C 0.2210(3) 0.2068(4) 0.1766(2) 0.0466(13) Uani 1 1 d . . . . .
H63A H 0.2466 0.1713 0.2085 0.056 Uiso 1 1 calc R U . . .
H63B H 0.2688 0.2444 0.1626 0.056 Uiso 1 1 calc R U . . .
C64 C 0.1434(4) 0.2563(3) 0.2026(2) 0.0444(13) Uani 1 1 d . . . . .
H64A H 0.0986 0.2187 0.2204 0.053 Uiso 1 1 calc R U . . .
H64B H 0.1660 0.2925 0.2351 0.053 Uiso 1 1 calc R U . . .
C65 C 0.0989(4) 0.3079(3) 0.1540(2) 0.0441(13) Uani 1 1 d . . . . .
H65A H 0.0460 0.3362 0.1713 0.053 Uiso 1 1 calc R U . . .
H65B H 0.1416 0.3501 0.1398 0.053 Uiso 1 1 calc R U . . .
C66 C 0.0695(4) 0.2557(3) 0.1014(2) 0.0392(12) Uani 1 1 d . . . . .
H66A H 0.0436 0.2916 0.0699 0.047 Uiso 1 1 calc R U . . .
H66B H 0.0217 0.2179 0.1151 0.047 Uiso 1 1 calc R U . . .
C1SA C 0.4796(14) 0.0063(10) 0.2860(11) 0.205(4) Uiso 0.65 1 d D U P A 1
H1SA H 0.5271 -0.0353 0.2868 0.245 Uiso 0.65 1 calc R U P A 1
H1SB H 0.4681 0.0227 0.2442 0.245 Uiso 0.65 1 calc R U P A 1
H1SC H 0.4246 -0.0165 0.3036 0.245 Uiso 0.65 1 calc R U P A 1
C2SA C 0.5082(11) 0.0783(9) 0.3212(12) 0.205(4) Uiso 0.65 1 d D U P A 1
H2SA H 0.5646 0.1007 0.3043 0.245 Uiso 0.65 1 calc R U P A 1
H2SB H 0.5195 0.0621 0.3636 0.245 Uiso 0.65 1 calc R U P A 1
C3SA C 0.4356(8) 0.1425(7) 0.3191(8) 0.205(4) Uiso 0.65 1 d D U P A 1
H3SA H 0.4064 0.1422 0.2789 0.245 Uiso 0.65 1 calc R U P A 1
H3SB H 0.3894 0.1307 0.3500 0.245 Uiso 0.65 1 calc R U P A 1
C4SA C 0.4769(10) 0.2239(8) 0.3307(12) 0.205(4) Uiso 0.65 1 d D U P A 1
H4SA H 0.5235 0.2355 0.3000 0.245 Uiso 0.65 1 calc R U P A 1
H4SB H 0.5058 0.2242 0.3709 0.245 Uiso 0.65 1 calc R U P A 1
C5SA C 0.4051(10) 0.2883(8) 0.3281(12) 0.205(4) Uiso 0.65 1 d D U P A 1
H5SA H 0.3569 0.2698 0.3005 0.245 Uiso 0.65 1 calc R U P A 1
H5SB H 0.3785 0.2950 0.3688 0.245 Uiso 0.65 1 calc R U P A 1
C6SA C 0.4393(13) 0.3684(9) 0.3072(10) 0.205(4) Uiso 0.65 1 d D U P A 1
H6SA H 0.3888 0.4056 0.3002 0.245 Uiso 0.65 1 calc R U P A 1
H6SB H 0.4729 0.3610 0.2696 0.245 Uiso 0.65 1 calc R U P A 1
H6SC H 0.4790 0.3917 0.3380 0.245 Uiso 0.65 1 calc R U P A 1
C1SB C 0.565(3) 0.002(2) 0.2726(17) 0.205(4) Uiso 0.35 1 d D U P B 2
H1SD H 0.5850 -0.0548 0.2786 0.245 Uiso 0.35 1 calc R U P B 2
H1SE H 0.6101 0.0313 0.2484 0.245 Uiso 0.35 1 calc R U P B 2
H1SF H 0.5075 0.0023 0.2515 0.245 Uiso 0.35 1 calc R U P B 2
C2SB C 0.5555(19) 0.0429(17) 0.3322(14) 0.205(4) Uiso 0.35 1 d D U P B 2
H2SC H 0.6119 0.0367 0.3554 0.245 Uiso 0.35 1 calc R U P B 2
H2SD H 0.5067 0.0161 0.3552 0.245 Uiso 0.35 1 calc R U P B 2
C3SB C 0.5345(10) 0.1323(14) 0.325(2) 0.205(4) Uiso 0.35 1 d D U P B 2
H3SC H 0.5567 0.1633 0.3601 0.245 Uiso 0.35 1 calc R U P B 2
H3SD H 0.5646 0.1539 0.2882 0.245 Uiso 0.35 1 calc R U P B 2
C4SB C 0.4356(8) 0.1425(7) 0.3191(8) 0.205(4) Uiso 0.35 1 d D U P B 2
H4SC H 0.4142 0.1108 0.2838 0.245 Uiso 0.35 1 calc R U P B 2
H4SD H 0.4062 0.1198 0.3555 0.245 Uiso 0.35 1 calc R U P B 2
C5SB C 0.4089(17) 0.2287(10) 0.3118(19) 0.205(4) Uiso 0.35 1 d D U P B 2
H5SC H 0.3480 0.2364 0.3288 0.245 Uiso 0.35 1 calc R U P B 2
H5SD H 0.4064 0.2421 0.2683 0.245 Uiso 0.35 1 calc R U P B 2
C6SB C 0.472(3) 0.2859(12) 0.342(2) 0.205(4) Uiso 0.35 1 d D U P B 2
H6SD H 0.4521 0.3425 0.3367 0.245 Uiso 0.35 1 calc R U P B 2
H6SE H 0.5326 0.2794 0.3251 0.245 Uiso 0.35 1 calc R U P B 2
H6SF H 0.4744 0.2734 0.3857 0.245 Uiso 0.35 1 calc R U P B 2


_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
Pt P1 2.3341(11) . ?
Pt P2 2.3428(11) . ?
Pt Cl1 2.4110(11) . ?
Pt Sn 2.5061(3) . ?
W C1 1.993(5) . ?
W C3 2.023(6) . ?
W C2 2.024(5) . ?
W C4 2.032(6) . ?
W C5 2.035(6) . ?
W Sn 2.7309(3) . ?
Sn Cl2 2.4149(11) . ?
P1 C21 1.844(4) . ?
P1 C31 1.851(4) . ?
P1 C11 1.869(4) . ?
P2 C61 1.843(4) . ?
P2 C51 1.846(4) . ?
P2 C41 1.857(4) . ?
O1 C1 1.141(6) . ?
O2 C2 1.163(6) . ?
O3 C3 1.141(6) . ?
O4 C4 1.140(6) . ?
O5 C5 1.137(7) . ?
C11 C12 1.518(6) . ?
C11 C16 1.526(6) . ?
C12 C13 1.543(6) . ?
C13 C14 1.499(7) . ?
C14 C15 1.546(8) . ?
C15 C16 1.538(7) . ?
C21 C22 1.523(6) . ?
C21 C26 1.537(6) . ?
C22 C23 1.544(6) . ?
C23 C24 1.521(8) . ?
C24 C25 1.503(8) . ?
C25 C26 1.526(7) . ?
C31 C36 1.513(7) . ?
C31 C32 1.527(6) . ?
C32 C33 1.541(7) . ?
C33 C34 1.513(8) . ?
C34 C35 1.486(9) . ?
C35 C36 1.539(7) . ?
C41 C42 1.542(6) . ?
C41 C46 1.549(6) . ?
C42 C43 1.521(6) . ?
C43 C44 1.538(7) . ?
C44 C45 1.488(7) . ?
C45 C46 1.538(7) . ?
C51 C56 1.533(6) . ?
C51 C52 1.544(6) . ?
C52 C53 1.520(6) . ?
C53 C54 1.503(8) . ?
C54 C55 1.518(8) . ?
C55 C56 1.524(7) . ?
C61 C66 1.519(6) . ?
C61 C62 1.535(6) . ?
C62 C63 1.532(6) . ?
C63 C64 1.523(7) . ?
C64 C65 1.518(7) . ?
C65 C66 1.509(6) . ?
C1SA C2SA 1.475(9) . ?
C2SA C3SA 1.506(9) . ?
C3SA C4SA 1.487(9) . ?
C4SA C5SA 1.501(9) . ?
C5SA C6SA 1.477(9) . ?
C1SB C2SB 1.488(10) . ?
C2SB C3SB 1.503(9) . ?
C3SB C4SB 1.487(9) . ?
C4SB C5SB 1.472(9) . ?
C5SB C6SB 1.492(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
P1 Pt P2 177.31(4) . . ?
P1 Pt Cl1 87.72(4) . . ?
P2 Pt Cl1 89.69(4) . . ?
P1 Pt Sn 91.13(3) . . ?
P2 Pt Sn 91.35(3) . . ?
Cl1 Pt Sn 172.63(3) . . ?
C1 W C3 88.6(2) . . ?
C1 W C2 90.7(2) . . ?
C3 W C2 87.4(2) . . ?
C1 W C4 90.8(2) . . ?
C3 W C4 88.5(2) . . ?
C2 W C4 175.6(2) . . ?
C1 W C5 90.1(2) . . ?
C3 W C5 178.7(2) . . ?
C2 W C5 92.7(2) . . ?
C4 W C5 91.5(2) . . ?
C1 W Sn 178.53(17) . . ?
C3 W Sn 92.52(14) . . ?
C2 W Sn 90.39(13) . . ?
C4 W Sn 88.18(15) . . ?
C5 W Sn 88.80(15) . . ?
Cl2 Sn Pt 107.89(3) . . ?
Cl2 Sn W 108.08(3) . . ?
Pt Sn W 144.019(13) . . ?
C21 P1 C31 105.9(2) . . ?
C21 P1 C11 109.23(19) . . ?
C31 P1 C11 104.8(2) . . ?
C21 P1 Pt 109.84(14) . . ?
C31 P1 Pt 111.15(15) . . ?
C11 P1 Pt 115.49(14) . . ?
C61 P2 C51 104.2(2) . . ?
C61 P2 C41 105.04(19) . . ?
C51 P2 C41 110.19(19) . . ?
C61 P2 Pt 110.39(14) . . ?
C51 P2 Pt 110.45(14) . . ?
C41 P2 Pt 115.79(13) . . ?
O1 C1 W 178.4(5) . . ?
O2 C2 W 178.0(5) . . ?
O3 C3 W 178.5(5) . . ?
O4 C4 W 177.9(5) . . ?
O5 C5 W 178.5(6) . . ?
C12 C11 C16 110.7(4) . . ?
C12 C11 P1 111.2(3) . . ?
C16 C11 P1 118.2(3) . . ?
C11 C12 C13 110.6(4) . . ?
C14 C13 C12 110.9(4) . . ?
C13 C14 C15 111.3(4) . . ?
C16 C15 C14 110.5(4) . . ?
C11 C16 C15 111.3(4) . . ?
C22 C21 C26 109.8(4) . . ?
C22 C21 P1 114.2(3) . . ?
C26 C21 P1 117.4(3) . . ?
C21 C22 C23 109.7(4) . . ?
C24 C23 C22 110.6(4) . . ?
C25 C24 C23 112.0(4) . . ?
C24 C25 C26 112.4(4) . . ?
C25 C26 C21 109.5(4) . . ?
C36 C31 C32 109.1(4) . . ?
C36 C31 P1 113.2(3) . . ?
C32 C31 P1 110.1(3) . . ?
C31 C32 C33 111.9(4) . . ?
C34 C33 C32 111.2(5) . . ?
C35 C34 C33 111.8(5) . . ?
C34 C35 C36 111.6(5) . . ?
C31 C36 C35 111.7(4) . . ?
C42 C41 C46 109.6(3) . . ?
C42 C41 P2 110.9(3) . . ?
C46 C41 P2 116.5(3) . . ?
C43 C42 C41 111.2(4) . . ?
C42 C43 C44 111.2(4) . . ?
C45 C44 C43 110.2(4) . . ?
C44 C45 C46 112.4(4) . . ?
C45 C46 C41 109.5(4) . . ?
C56 C51 C52 110.4(4) . . ?
C56 C51 P2 118.7(3) . . ?
C52 C51 P2 114.1(3) . . ?
C53 C52 C51 108.8(4) . . ?
C54 C53 C52 112.0(4) . . ?
C53 C54 C55 111.6(4) . . ?
C54 C55 C56 112.3(4) . . ?
C55 C56 C51 108.7(4) . . ?
C66 C61 C62 108.7(4) . . ?
C66 C61 P2 112.7(3) . . ?
C62 C61 P2 110.7(3) . . ?
C63 C62 C61 111.7(4) . . ?
C64 C63 C62 110.4(4) . . ?
C65 C64 C63 111.0(4) . . ?
C66 C65 C64 111.2(4) . . ?
C65 C66 C61 113.3(4) . . ?
C1SA C2SA C3SA 109.3(9) . . ?
C4SA C3SA C2SA 108.6(8) . . ?
C3SA C4SA C5SA 108.9(9) . . ?
C6SA C5SA C4SA 112.7(9) . . ?
C1SB C2SB C3SB 111.1(10) . . ?
C4SB C3SB C2SB 108.9(9) . . ?
C5SB C4SB C3SB 112.5(9) . . ?
C4SB C5SB C6SB 112.3(10) . . ?

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
P1 Pt Sn Cl2 95.40(4) . . . . ?
P2 Pt Sn Cl2 -85.64(4) . . . . ?
Cl1 Pt Sn Cl2 176.4(2) . . . . ?
P1 Pt Sn W -85.70(3) . . . . ?
P2 Pt Sn W 93.25(3) . . . . ?
Cl1 Pt Sn W -4.7(2) . . . . ?
C1 W Sn Cl2 36(7) . . . . ?
C3 W Sn Cl2 -100.46(14) . . . . ?
C2 W Sn Cl2 172.14(16) . . . . ?
C4 W Sn Cl2 -12.06(16) . . . . ?
C5 W Sn Cl2 79.45(19) . . . . ?
C1 W Sn Pt -143(7) . . . . ?
C3 W Sn Pt 80.65(14) . . . . ?
C2 W Sn Pt -6.75(16) . . . . ?
C4 W Sn Pt 169.05(16) . . . . ?
C5 W Sn Pt -99.44(18) . . . . ?
P2 Pt P1 C21 55.5(9) . . . . ?
Cl1 Pt P1 C21 39.87(15) . . . . ?
Sn Pt P1 C21 -147.41(15) . . . . ?
P2 Pt P1 C31 -61.3(9) . . . . ?
Cl1 Pt P1 C31 -76.95(16) . . . . ?
Sn Pt P1 C31 95.77(15) . . . . ?
P2 Pt P1 C11 180(100) . . . . ?
Cl1 Pt P1 C11 163.92(16) . . . . ?
Sn Pt P1 C11 -23.37(16) . . . . ?
P1 Pt P2 C61 69.9(9) . . . . ?
Cl1 Pt P2 C61 85.49(16) . . . . ?
Sn Pt P2 C61 -87.21(16) . . . . ?
P1 Pt P2 C51 -44.9(9) . . . . ?
Cl1 Pt P2 C51 -29.25(15) . . . . ?
Sn Pt P2 C51 158.04(15) . . . . ?
P1 Pt P2 C41 -171.0(8) . . . . ?
Cl1 Pt P2 C41 -155.36(15) . . . . ?
Sn Pt P2 C41 31.94(15) . . . . ?
C3 W C1 O1 54(20) . . . . ?
C2 W C1 O1 141(20) . . . . ?
C4 W C1 O1 -35(20) . . . . ?
C5 W C1 O1 -126(20) . . . . ?
Sn W C1 O1 -83(23) . . . . ?
C1 W C2 O2 -60(14) . . . . ?
C3 W C2 O2 29(14) . . . . ?
C4 W C2 O2 50(15) . . . . ?
C5 W C2 O2 -150(14) . . . . ?
Sn W C2 O2 121(14) . . . . ?
C1 W C3 O3 26(18) . . . . ?
C2 W C3 O3 -65(18) . . . . ?
C4 W C3 O3 117(18) . . . . ?
C5 W C3 O3 29(24) . . . . ?
Sn W C3 O3 -155(18) . . . . ?
C1 W C4 O4 63(14) . . . . ?
C3 W C4 O4 -25(14) . . . . ?
C2 W C4 O4 -46(16) . . . . ?
C5 W C4 O4 154(14) . . . . ?
Sn W C4 O4 -118(14) . . . . ?
C1 W C5 O5 108(22) . . . . ?
C3 W C5 O5 105(23) . . . . ?
C2 W C5 O5 -161(22) . . . . ?
C4 W C5 O5 17(22) . . . . ?
Sn W C5 O5 -71(22) . . . . ?
C21 P1 C11 C12 56.6(4) . . . . ?
C31 P1 C11 C12 169.6(3) . . . . ?
Pt P1 C11 C12 -67.8(3) . . . . ?
C21 P1 C11 C16 -73.0(4) . . . . ?
C31 P1 C11 C16 40.0(4) . . . . ?
Pt P1 C11 C16 162.6(3) . . . . ?
C16 C11 C12 C13 -57.2(5) . . . . ?
P1 C11 C12 C13 169.3(3) . . . . ?
C11 C12 C13 C14 57.8(6) . . . . ?
C12 C13 C14 C15 -56.7(6) . . . . ?
C13 C14 C15 C16 55.3(6) . . . . ?
C12 C11 C16 C15 56.4(5) . . . . ?
P1 C11 C16 C15 -173.8(4) . . . . ?
C14 C15 C16 C11 -54.8(6) . . . . ?
C31 P1 C21 C22 168.5(3) . . . . ?
C11 P1 C21 C22 -79.2(3) . . . . ?
Pt P1 C21 C22 48.4(3) . . . . ?
C31 P1 C21 C26 -60.8(4) . . . . ?
C11 P1 C21 C26 51.5(4) . . . . ?
Pt P1 C21 C26 179.1(3) . . . . ?
C26 C21 C22 C23 60.3(5) . . . . ?
P1 C21 C22 C23 -165.4(3) . . . . ?
C21 C22 C23 C24 -57.3(5) . . . . ?
C22 C23 C24 C25 53.9(6) . . . . ?
C23 C24 C25 C26 -54.0(7) . . . . ?
C24 C25 C26 C21 56.0(6) . . . . ?
C22 C21 C26 C25 -59.1(5) . . . . ?
P1 C21 C26 C25 168.2(3) . . . . ?
C21 P1 C31 C36 -55.9(4) . . . . ?
C11 P1 C31 C36 -171.3(4) . . . . ?
Pt P1 C31 C36 63.3(4) . . . . ?
C21 P1 C31 C32 -178.4(3) . . . . ?
C11 P1 C31 C32 66.3(4) . . . . ?
Pt P1 C31 C32 -59.1(3) . . . . ?
C36 C31 C32 C33 55.8(6) . . . . ?
P1 C31 C32 C33 -179.4(4) . . . . ?
C31 C32 C33 C34 -54.9(7) . . . . ?
C32 C33 C34 C35 54.0(7) . . . . ?
C33 C34 C35 C36 -54.8(8) . . . . ?
C32 C31 C36 C35 -56.3(6) . . . . ?
P1 C31 C36 C35 -179.2(4) . . . . ?
C34 C35 C36 C31 56.8(7) . . . . ?
C61 P2 C41 C42 -164.1(3) . . . . ?
C51 P2 C41 C42 -52.3(3) . . . . ?
Pt P2 C41 C42 73.9(3) . . . . ?
C61 P2 C41 C46 -37.8(4) . . . . ?
C51 P2 C41 C46 73.9(4) . . . . ?
Pt P2 C41 C46 -159.8(3) . . . . ?
C46 C41 C42 C43 56.6(5) . . . . ?
P2 C41 C42 C43 -173.3(3) . . . . ?
C41 C42 C43 C44 -56.4(5) . . . . ?
C42 C43 C44 C45 56.2(6) . . . . ?
C43 C44 C45 C46 -57.6(6) . . . . ?
C44 C45 C46 C41 58.3(6) . . . . ?
C42 C41 C46 C45 -56.2(5) . . . . ?
P2 C41 C46 C45 176.9(3) . . . . ?
C61 P2 C51 C56 55.6(4) . . . . ?
C41 P2 C51 C56 -56.7(4) . . . . ?
Pt P2 C51 C56 174.2(3) . . . . ?
C61 P2 C51 C52 -171.5(3) . . . . ?
C41 P2 C51 C52 76.3(4) . . . . ?
Pt P2 C51 C52 -52.9(3) . . . . ?
C56 C51 C52 C53 -59.8(5) . . . . ?
P2 C51 C52 C53 163.4(3) . . . . ?
C51 C52 C53 C54 57.2(5) . . . . ?
C52 C53 C54 C55 -54.7(6) . . . . ?
C53 C54 C55 C56 54.4(6) . . . . ?
C54 C55 C56 C51 -56.2(5) . . . . ?
C52 C51 C56 C55 59.2(5) . . . . ?
P2 C51 C56 C55 -166.2(3) . . . . ?
C51 P2 C61 C66 59.6(4) . . . . ?
C41 P2 C61 C66 175.5(3) . . . . ?
Pt P2 C61 C66 -59.0(4) . . . . ?
C51 P2 C61 C62 -178.4(3) . . . . ?
C41 P2 C61 C62 -62.5(3) . . . . ?
Pt P2 C61 C62 63.0(3) . . . . ?
C66 C61 C62 C63 -56.1(5) . . . . ?
P2 C61 C62 C63 179.7(3) . . . . ?
C61 C62 C63 C64 57.4(6) . . . . ?
C62 C63 C64 C65 -55.9(6) . . . . ?
C63 C64 C65 C66 54.9(6) . . . . ?
C64 C65 C66 C61 -55.9(6) . . . . ?
C62 C61 C66 C65 55.6(5) . . . . ?
P2 C61 C66 C65 178.7(3) . . . . ?
C1SA C2SA C3SA C4SA -156(2) . . . . ?
C2SA C3SA C4SA C5SA 180(2) . . . . ?
C3SA C4SA C5SA C6SA -150(2) . . . . ?
C1SB C2SB C3SB C4SB 88(3) . . . . ?
C2SB C3SB C4SB C5SB 179(3) . . . . ?
C3SB C4SB C5SB C6SB -30(4) . . . . ?

_refine_diff_density_max         0.737
_refine_diff_density_min         -0.323
_refine_diff_density_rms         0.069

_shelxl_version_number           2013-4

