#------------------------------------------------------------------------------
#$Date: 2016-03-22 23:43:21 +0200 (Tue, 22 Mar 2016) $
#$Revision: 179074 $
#$URL: svn://www.crystallography.net/cod/cif/4/30/36/4303695.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_4303695
loop_
_publ_author_name
'Fengli Liu'
'Sumod A. Pullarkat'
'Kien-Wee Tan'
'Yongxin Li'
'Pak-Hing Leung'
_publ_section_title
;
Organoplatinum Complex Promoted the Asymmetric Endo Stereochemically
Controlled Diels-Alder Reaction between 3-Diphenylphosphinofuran and
Diphenylvinylphosphine
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              11394
_journal_page_last               11398
_journal_paper_doi               10.1021/ic9014543
_journal_volume                  48
_journal_year                    2009
_chemical_absolute_configuration ad
_chemical_formula_sum            'C30 H26 Cl2 O P2 Pt'
_chemical_formula_weight         730.44
_chemical_name_systematic
;

 ?

;
_space_group_IT_number           4
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  'P 2yb'
_symmetry_space_group_name_H-M   'P 1 21 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 90.983(2)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   11.1119(5)
_cell_length_b                   17.0141(6)
_cell_length_c                   14.4999(6)
_cell_measurement_reflns_used    7862
_cell_measurement_temperature    173(2)
_cell_measurement_theta_max      30.46
_cell_measurement_theta_min      2.33
_cell_volume                     2740.93(19)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      173(2)
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0286
_diffrn_reflns_av_sigmaI/netI    0.0403
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       22
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            48195
_diffrn_reflns_theta_full        28.00
_diffrn_reflns_theta_max         28.00
_diffrn_reflns_theta_min         1.40
_exptl_absorpt_coefficient_mu    5.454
_exptl_absorpt_correction_T_max  0.4951
_exptl_absorpt_correction_T_min  0.3426
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.770
_exptl_crystal_density_meas      0
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       fragment
_exptl_crystal_F_000             1424
_exptl_crystal_size_max          0.25
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.15
_refine_diff_density_max         0.794
_refine_diff_density_min         -0.590
_refine_diff_density_rms         0.072
_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   0.003(2)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.947
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     649
_refine_ls_number_reflns         12971
_refine_ls_number_restraints     85
_refine_ls_restrained_S_all      0.945
_refine_ls_R_factor_all          0.0198
_refine_ls_R_factor_gt           0.0181
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0000P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0381
_refine_ls_wR_factor_ref         0.0388
_reflns_number_gt                12377
_reflns_number_total             12971
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic9014543_si_001_1.cif
_cod_data_source_block           leung165m
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_database_code               4303695
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt1 Pt 0.831211(9) 0.421055(6) 0.863983(7) 0.01962(3) Uani 1 1 d . . .
Pt2 Pt 0.430973(9) 0.451135(6) 0.359054(7) 0.01866(3) Uani 1 1 d . . .
Cl1 Cl 0.65678(7) 0.35330(5) 0.90794(6) 0.0356(2) Uani 1 1 d . . .
Cl2 Cl 0.92365(7) 0.38859(5) 1.00606(5) 0.02760(16) Uani 1 1 d . . .
Cl3 Cl 0.33698(7) 0.50266(6) 0.48966(6) 0.0371(2) Uani 1 1 d . . .
Cl4 Cl 0.60962(7) 0.51666(5) 0.40250(6) 0.03284(19) Uani 1 1 d . . .
P1 P 0.73503(6) 0.45022(5) 0.73205(5) 0.02259(15) Uani 1 1 d . . .
P2 P 1.00683(7) 0.47912(5) 0.83288(5) 0.01939(15) Uani 1 1 d . . .
P3 P 0.25753(7) 0.38904(5) 0.32921(5) 0.01889(15) Uani 1 1 d . . .
P4 P 0.52929(6) 0.41241(5) 0.23423(5) 0.02095(16) Uani 1 1 d . . .
C1 C 0.6139(3) 0.52043(18) 0.7440(2) 0.0237(7) Uani 1 1 d . . .
C2 C 0.5732(3) 0.5415(2) 0.8309(2) 0.0335(8) Uani 1 1 d . . .
H2 H 0.6082 0.5185 0.8847 0.040 Uiso 1 1 calc R . .
C3 C 0.4814(3) 0.5961(2) 0.8384(3) 0.0396(9) Uani 1 1 d . . .
H3 H 0.4549 0.6115 0.8977 0.048 Uiso 1 1 calc R . .
C4 C 0.4281(3) 0.6284(2) 0.7603(3) 0.0393(9) Uani 1 1 d . . .
H4 H 0.3641 0.6650 0.7660 0.047 Uiso 1 1 calc R . .
C5 C 0.4675(3) 0.6078(2) 0.6748(3) 0.0386(9) Uani 1 1 d . . .
H5 H 0.4302 0.6300 0.6214 0.046 Uiso 1 1 calc R . .
C6 C 0.5620(3) 0.5546(2) 0.6655(2) 0.0322(8) Uani 1 1 d . . .
H6 H 0.5907 0.5416 0.6061 0.039 Uiso 1 1 calc R . .
C7 C 0.6774(3) 0.36444(19) 0.6717(2) 0.0289(7) Uani 1 1 d . . .
C8 C 0.5668(3) 0.3636(2) 0.6258(3) 0.0390(9) Uani 1 1 d . . .
H8 H 0.5196 0.4101 0.6231 0.047 Uiso 1 1 calc R . .
C9 C 0.5246(4) 0.2960(3) 0.5841(3) 0.0504(11) Uani 1 1 d . . .
H9 H 0.4487 0.2964 0.5530 0.061 Uiso 1 1 calc R . .
C10 C 0.5916(5) 0.2279(3) 0.5870(3) 0.0570(12) Uani 1 1 d . . .
H10 H 0.5599 0.1807 0.5616 0.068 Uiso 1 1 calc R . .
C11 C 0.7046(6) 0.2289(3) 0.6270(4) 0.0731(16) Uani 1 1 d . . .
H11 H 0.7537 0.1832 0.6256 0.088 Uiso 1 1 calc R . .
C12 C 0.7473(4) 0.2977(2) 0.6700(3) 0.0562(12) Uani 1 1 d . . .
H12 H 0.8251 0.2982 0.6981 0.067 Uiso 1 1 calc R . .
C13 C 0.8338(3) 0.4980(2) 0.6526(2) 0.0270(7) Uani 1 1 d . . .
C14 C 0.8874(3) 0.4720(2) 0.5780(2) 0.0369(8) Uani 1 1 d . . .
H14 H 0.8635 0.4286 0.5407 0.044 Uiso 1 1 calc R . .
C15 C 0.9944(3) 0.5253(2) 0.5639(2) 0.0378(9) Uani 1 1 d . . .
H15 H 1.0273 0.5257 0.5001 0.045 Uiso 1 1 calc R . .
C16 C 1.0844(3) 0.5020(2) 0.6410(2) 0.0359(9) Uani 1 1 d . . .
H16A H 1.1650 0.5248 0.6306 0.043 Uiso 1 1 calc R . .
H16B H 1.0914 0.4442 0.6467 0.043 Uiso 1 1 calc R . .
C17 C 1.0248(3) 0.53846(19) 0.7263(2) 0.0252(7) Uani 1 1 d . . .
H17 H 1.0743 0.5854 0.7441 0.030 Uiso 1 1 calc R . .
C18 C 0.9060(3) 0.5705(2) 0.6818(2) 0.0296(7) Uani 1 1 d . . .
H18 H 0.8615 0.6096 0.7198 0.035 Uiso 1 1 calc R . .
C19 C 1.1304(2) 0.40932(18) 0.82567(19) 0.0214(6) Uani 1 1 d . . .
C20 C 1.1079(3) 0.32923(18) 0.8262(2) 0.0251(7) Uani 1 1 d . . .
H20 H 1.0283 0.3106 0.8350 0.030 Uiso 1 1 calc R . .
C21 C 1.2009(3) 0.2763(2) 0.8140(2) 0.0354(8) Uani 1 1 d . . .
H21 H 1.1846 0.2215 0.8144 0.042 Uiso 1 1 calc R . .
C22 C 1.3170(3) 0.3025(3) 0.8013(3) 0.0428(10) Uani 1 1 d . . .
H22 H 1.3804 0.2659 0.7925 0.051 Uiso 1 1 calc R . .
C23 C 1.3404(3) 0.3819(3) 0.8014(3) 0.0440(10) Uani 1 1 d . . .
H23 H 1.4204 0.4002 0.7938 0.053 Uiso 1 1 calc R . .
C24 C 1.2484(3) 0.4349(2) 0.8124(2) 0.0355(8) Uani 1 1 d . . .
H24 H 1.2652 0.4896 0.8110 0.043 Uiso 1 1 calc R . .
C25 C 1.0475(3) 0.55228(18) 0.9203(2) 0.0244(7) Uani 1 1 d . . .
C26 C 1.1466(4) 0.5467(2) 0.9773(3) 0.0427(10) Uani 1 1 d . . .
H26 H 1.1960 0.5012 0.9751 0.051 Uiso 1 1 calc R . .
C27 C 1.1758(4) 0.6079(3) 1.0390(3) 0.0600(13) Uani 1 1 d . . .
H27 H 1.2445 0.6033 1.0785 0.072 Uiso 1 1 calc R . .
C28 C 1.1059(4) 0.6739(2) 1.0423(3) 0.0483(11) Uani 1 1 d . . .
H28 H 1.1278 0.7162 1.0820 0.058 Uiso 1 1 calc R . .
C29 C 1.0029(4) 0.6785(2) 0.9875(3) 0.0379(9) Uani 1 1 d . . .
H29 H 0.9521 0.7232 0.9917 0.045 Uiso 1 1 calc R . .
C30 C 0.9734(3) 0.61887(19) 0.9268(2) 0.0301(7) Uani 1 1 d . . .
H30 H 0.9028 0.6228 0.8892 0.036 Uiso 1 1 calc R . .
C31 C 0.1294(2) 0.4546(2) 0.3188(2) 0.0242(6) Uani 1 1 d . . .
C32 C 0.0131(3) 0.4248(2) 0.3249(3) 0.0436(9) Uani 1 1 d . . .
H32 H 0.0009 0.3710 0.3395 0.052 Uiso 1 1 calc R . .
C33 C -0.0852(3) 0.4742(3) 0.3094(3) 0.0558(12) Uani 1 1 d . . .
H33 H -0.1646 0.4545 0.3158 0.067 Uiso 1 1 calc R . .
C34 C -0.0679(4) 0.5507(3) 0.2850(3) 0.0494(12) Uani 1 1 d . . .
H34 H -0.1349 0.5832 0.2698 0.059 Uiso 1 1 calc R . .
C35 C 0.0452(4) 0.5804(2) 0.2826(3) 0.0514(11) Uani 1 1 d . . .
H35 H 0.0565 0.6344 0.2689 0.062 Uiso 1 1 calc R . .
C36 C 0.1444(3) 0.5333(2) 0.2997(3) 0.0373(8) Uani 1 1 d . . .
H36 H 0.2230 0.5552 0.2982 0.045 Uiso 1 1 calc R . .
C37 C 0.2270(3) 0.31866(19) 0.4204(2) 0.0266(7) Uani 1 1 d U . .
C38 C 0.1561(4) 0.3367(3) 0.4934(3) 0.0580(12) Uani 1 1 d U . .
H38 H 0.1169 0.3863 0.4956 0.070 Uiso 1 1 calc R . .
C39 C 0.1410(6) 0.2838(3) 0.5632(3) 0.0870(19) Uani 1 1 d U . .
H39 H 0.0918 0.2972 0.6138 0.104 Uiso 1 1 calc R . .
C40 C 0.1961(5) 0.2116(3) 0.5611(3) 0.0689(15) Uani 1 1 d U . .
H40 H 0.1841 0.1749 0.6095 0.083 Uiso 1 1 calc R . .
C41 C 0.2669(4) 0.1931(2) 0.4902(3) 0.0514(11) Uani 1 1 d U . .
H41 H 0.3058 0.1434 0.4883 0.062 Uiso 1 1 calc R . .
C42 C 0.2827(3) 0.2464(2) 0.4205(3) 0.0391(9) Uani 1 1 d U . .
H42 H 0.3334 0.2330 0.3708 0.047 Uiso 1 1 calc R . .
C43 C 0.2416(3) 0.3277(2) 0.2254(2) 0.0262(7) Uani 1 1 d . . .
H43 H 0.1887 0.2827 0.2426 0.031 Uiso 1 1 calc R . .
C44 C 0.1834(3) 0.3652(2) 0.1386(2) 0.0357(9) Uani 1 1 d . . .
H44A H 0.1821 0.4233 0.1429 0.043 Uiso 1 1 calc R . .
H44B H 0.1006 0.3456 0.1276 0.043 Uiso 1 1 calc R . .
C45 C 0.2702(3) 0.3366(2) 0.0632(2) 0.0367(9) Uani 1 1 d . . .
H45 H 0.2359 0.3357 -0.0010 0.044 Uiso 1 1 calc R . .
C46 C 0.3813(3) 0.3878(2) 0.0773(2) 0.0372(8) Uani 1 1 d . . .
H46 H 0.4075 0.4299 0.0396 0.045 Uiso 1 1 calc R . .
C47 C 0.4342(3) 0.3602(2) 0.1551(2) 0.0298(8) Uani 1 1 d . . .
C48 C 0.3561(3) 0.2913(2) 0.1842(2) 0.0294(7) Uani 1 1 d . . .
H48 H 0.3976 0.2511 0.2239 0.035 Uiso 1 1 calc R . .
C49 C 0.6535(3) 0.34579(18) 0.2586(2) 0.0217(6) Uani 1 1 d . . .
C50 C 0.7224(3) 0.3148(2) 0.1876(2) 0.0305(8) Uani 1 1 d . . .
H50 H 0.7024 0.3263 0.1250 0.037 Uiso 1 1 calc R . .
C51 C 0.8208(3) 0.2668(2) 0.2092(3) 0.0422(10) Uani 1 1 d . . .
H51 H 0.8700 0.2477 0.1611 0.051 Uiso 1 1 calc R . .
C52 C 0.8474(3) 0.2468(2) 0.2983(3) 0.0411(10) Uani 1 1 d . . .
H52 H 0.9145 0.2139 0.3117 0.049 Uiso 1 1 calc R . .
C53 C 0.7771(3) 0.2742(2) 0.3691(3) 0.0396(9) Uani 1 1 d . . .
H53 H 0.7943 0.2587 0.4308 0.047 Uiso 1 1 calc R . .
C54 C 0.6813(3) 0.3243(2) 0.3500(2) 0.0323(8) Uani 1 1 d . . .
H54 H 0.6344 0.3441 0.3989 0.039 Uiso 1 1 calc R . .
C55 C 0.5800(3) 0.49662(19) 0.1697(2) 0.0278(7) Uani 1 1 d . . .
C56 C 0.5025(4) 0.5617(2) 0.1653(3) 0.0412(9) Uani 1 1 d . . .
H56 H 0.4303 0.5612 0.1994 0.049 Uiso 1 1 calc R . .
C57 C 0.5294(4) 0.6258(2) 0.1128(3) 0.0531(12) Uani 1 1 d . . .
H57 H 0.4753 0.6690 0.1094 0.064 Uiso 1 1 calc R . .
C58 C 0.6363(4) 0.6275(3) 0.0644(3) 0.0536(12) Uani 1 1 d . . .
H58 H 0.6555 0.6717 0.0273 0.064 Uiso 1 1 calc R . .
C59 C 0.7139(4) 0.5649(3) 0.0707(3) 0.0529(12) Uani 1 1 d . . .
H59 H 0.7879 0.5670 0.0389 0.063 Uiso 1 1 calc R . .
C60 C 0.6872(3) 0.4992(2) 0.1219(2) 0.0365(9) Uani 1 1 d . . .
H60 H 0.7415 0.4560 0.1244 0.044 Uiso 1 1 calc R . .
O1 O 0.9491(2) 0.59922(16) 0.59594(17) 0.0379(6) Uani 1 1 d . . .
O2 O 0.3099(2) 0.26277(15) 0.09815(17) 0.0390(6) Uani 1 1 d . . .
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'
Pt Pt -1.7033 8.3905 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
P1 Pt1 P2 97.78(3) . . ?
P1 Pt1 Cl2 177.25(3) . . ?
P2 Pt1 Cl2 84.90(3) . . ?
P1 Pt1 Cl1 87.51(3) . . ?
P2 Pt1 Cl1 174.45(3) . . ?
Cl2 Pt1 Cl1 89.83(3) . . ?
P4 Pt2 P3 97.82(3) . . ?
P4 Pt2 Cl3 174.83(3) . . ?
P3 Pt2 Cl3 86.48(3) . . ?
P4 Pt2 Cl4 86.24(3) . . ?
P3 Pt2 Cl4 175.60(3) . . ?
Cl3 Pt2 Cl4 89.54(3) . . ?
C13 P1 C1 103.04(15) . . ?
C13 P1 C7 105.61(15) . . ?
C1 P1 C7 108.68(15) . . ?
C13 P1 Pt1 111.17(10) . . ?
C1 P1 Pt1 114.25(10) . . ?
C7 P1 Pt1 113.27(11) . . ?
C19 P2 C25 107.84(14) . . ?
C19 P2 C17 102.40(14) . . ?
C25 P2 C17 100.22(14) . . ?
C19 P2 Pt1 112.62(10) . . ?
C25 P2 Pt1 111.51(10) . . ?
C17 P2 Pt1 120.88(10) . . ?
C31 P3 C37 108.01(15) . . ?
C31 P3 C43 102.51(14) . . ?
C37 P3 C43 101.83(15) . . ?
C31 P3 Pt2 113.51(10) . . ?
C37 P3 Pt2 109.96(10) . . ?
C43 P3 Pt2 119.88(11) . . ?
C47 P4 C55 104.38(15) . . ?
C47 P4 C49 104.73(15) . . ?
C55 P4 C49 110.66(14) . . ?
C47 P4 Pt2 112.09(12) . . ?
C55 P4 Pt2 110.36(11) . . ?
C49 P4 Pt2 114.08(10) . . ?
C2 C1 C6 119.7(3) . . ?
C2 C1 P1 120.7(2) . . ?
C6 C1 P1 119.7(3) . . ?
C3 C2 C1 119.7(3) . . ?
C4 C3 C2 120.4(4) . . ?
C5 C4 C3 120.1(3) . . ?
C4 C5 C6 120.5(3) . . ?
C1 C6 C5 119.6(3) . . ?
C12 C7 C8 118.6(3) . . ?
C12 C7 P1 118.5(3) . . ?
C8 C7 P1 122.9(3) . . ?
C9 C8 C7 120.7(4) . . ?
C8 C9 C10 120.6(4) . . ?
C11 C10 C9 119.5(4) . . ?
C10 C11 C12 119.7(4) . . ?
C7 C12 C11 120.6(4) . . ?
C14 C13 C18 104.9(3) . . ?
C14 C13 P1 131.4(3) . . ?
C18 C13 P1 120.7(2) . . ?
C13 C14 C15 106.0(3) . . ?
O1 C15 C14 101.6(3) . . ?
O1 C15 C16 102.5(3) . . ?
C14 C15 C16 104.5(3) . . ?
C15 C16 C17 101.4(3) . . ?
C16 C17 C18 100.4(3) . . ?
C16 C17 P2 120.1(2) . . ?
C18 C17 P2 115.6(2) . . ?
O1 C18 C13 102.5(3) . . ?
O1 C18 C17 100.7(3) . . ?
C13 C18 C17 105.7(3) . . ?
C20 C19 C24 118.5(3) . . ?
C20 C19 P2 120.3(2) . . ?
C24 C19 P2 121.0(2) . . ?
C21 C20 C19 120.2(3) . . ?
C22 C21 C20 120.6(3) . . ?
C23 C22 C21 119.6(3) . . ?
C24 C23 C22 120.2(3) . . ?
C23 C24 C19 120.9(3) . . ?
C26 C25 C30 118.8(3) . . ?
C26 C25 P2 123.9(3) . . ?
C30 C25 P2 117.2(2) . . ?
C25 C26 C27 120.5(4) . . ?
C28 C27 C26 120.4(4) . . ?
C27 C28 C29 119.4(4) . . ?
C30 C29 C28 120.6(4) . . ?
C29 C30 C25 120.2(3) . . ?
C36 C31 C32 118.8(3) . . ?
C36 C31 P3 121.1(2) . . ?
C32 C31 P3 120.0(3) . . ?
C31 C32 C33 119.8(4) . . ?
C34 C33 C32 120.2(4) . . ?
C35 C34 C33 119.8(4) . . ?
C34 C35 C36 121.1(4) . . ?
C31 C36 C35 120.0(4) . . ?
C38 C37 C42 117.7(3) . . ?
C38 C37 P3 122.2(3) . . ?
C42 C37 P3 119.9(3) . . ?
C37 C38 C39 120.4(4) . . ?
C38 C39 C40 120.8(5) . . ?
C41 C40 C39 119.6(4) . . ?
C40 C41 C42 119.6(4) . . ?
C41 C42 C37 121.9(4) . . ?
C44 C43 C48 100.8(3) . . ?
C44 C43 P3 117.8(2) . . ?
C48 C43 P3 118.4(2) . . ?
C43 C44 C45 100.9(3) . . ?
O2 C45 C46 102.2(3) . . ?
O2 C45 C44 102.7(3) . . ?
C46 C45 C44 103.8(3) . . ?
C47 C46 C45 104.7(3) . . ?
C46 C47 C48 105.0(3) . . ?
C46 C47 P4 127.6(3) . . ?
C48 C47 P4 122.6(2) . . ?
O2 C48 C47 102.5(3) . . ?
O2 C48 C43 100.9(3) . . ?
C47 C48 C43 105.9(3) . . ?
C50 C49 C54 118.9(3) . . ?
C50 C49 P4 121.1(2) . . ?
C54 C49 P4 120.0(2) . . ?
C49 C50 C51 119.5(3) . . ?
C52 C51 C50 121.0(4) . . ?
C51 C52 C53 120.2(3) . . ?
C52 C53 C54 120.0(4) . . ?
C53 C54 C49 120.3(3) . . ?
C60 C55 C56 118.9(3) . . ?
C60 C55 P4 124.1(3) . . ?
C56 C55 P4 116.9(3) . . ?
C57 C56 C55 121.0(4) . . ?
C56 C57 C58 119.6(4) . . ?
C59 C58 C57 119.4(4) . . ?
C58 C59 C60 121.7(4) . . ?
C59 C60 C55 119.2(4) . . ?
C18 O1 C15 96.1(2) . . ?
C45 O2 C48 96.7(2) . . ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Pt1 P1 2.2311(7) . ?
Pt1 P2 2.2400(8) . ?
Pt1 Cl2 2.3519(7) . ?
Pt1 Cl1 2.3525(8) . ?
Pt2 P4 2.2297(7) . ?
Pt2 P3 2.2336(7) . ?
Pt2 Cl3 2.3481(8) . ?
Pt2 Cl4 2.3531(8) . ?
P1 C13 1.800(3) . ?
P1 C1 1.810(3) . ?
P1 C7 1.813(3) . ?
P2 C19 1.820(3) . ?
P2 C25 1.828(3) . ?
P2 C17 1.859(3) . ?
P3 C31 1.813(3) . ?
P3 C37 1.820(3) . ?
P3 C43 1.837(3) . ?
P4 C47 1.783(3) . ?
P4 C55 1.807(3) . ?
P4 C49 1.816(3) . ?
C1 C2 1.393(5) . ?
C1 C6 1.393(4) . ?
C2 C3 1.385(5) . ?
C3 C4 1.384(5) . ?
C4 C5 1.366(5) . ?
C5 C6 1.395(5) . ?
C7 C12 1.375(5) . ?
C7 C8 1.388(5) . ?
C8 C9 1.377(5) . ?
C9 C10 1.377(6) . ?
C10 C11 1.374(7) . ?
C11 C12 1.405(6) . ?
C13 C14 1.320(5) . ?
C13 C18 1.526(5) . ?
C14 C15 1.513(5) . ?
C15 O1 1.435(5) . ?
C15 C16 1.539(5) . ?
C16 C17 1.543(4) . ?
C17 C18 1.558(4) . ?
C18 O1 1.428(4) . ?
C19 C20 1.386(4) . ?
C19 C24 1.397(4) . ?
C20 C21 1.384(4) . ?
C21 C22 1.381(5) . ?
C22 C23 1.377(6) . ?
C23 C24 1.374(5) . ?
C25 C26 1.368(5) . ?
C25 C30 1.405(4) . ?
C26 C27 1.407(5) . ?
C27 C28 1.367(6) . ?
C28 C29 1.385(6) . ?
C29 C30 1.379(5) . ?
C31 C36 1.378(5) . ?
C31 C32 1.392(4) . ?
C32 C33 1.393(5) . ?
C33 C34 1.364(6) . ?
C34 C35 1.355(6) . ?
C35 C36 1.381(5) . ?
C37 C38 1.365(5) . ?
C37 C42 1.377(5) . ?
C38 C39 1.367(6) . ?
C39 C40 1.374(8) . ?
C40 C41 1.343(7) . ?
C41 C42 1.371(5) . ?
C43 C44 1.543(4) . ?
C43 C48 1.545(5) . ?
C44 C45 1.549(5) . ?
C45 O2 1.422(4) . ?
C45 C46 1.522(5) . ?
C46 C47 1.347(5) . ?
C47 C48 1.523(5) . ?
C48 O2 1.426(4) . ?
C49 C50 1.396(4) . ?
C49 C54 1.404(5) . ?
C50 C51 1.397(5) . ?
C51 C52 1.363(6) . ?
C52 C53 1.382(6) . ?
C53 C54 1.387(5) . ?
C55 C60 1.388(5) . ?
C55 C56 1.404(5) . ?
C56 C57 1.365(5) . ?
C57 C58 1.391(7) . ?
C58 C59 1.372(7) . ?
C59 C60 1.378(5) . ?
