#------------------------------------------------------------------------------
#$Date: 2016-02-20 18:35:30 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176787 $
#$URL: svn://www.crystallography.net/cod/cif/2/21/19/2211910.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2211910
loop_
_publ_author_name
'Muller, Alfred'
_publ_section_title
;[1,1'-Bis(diphenylphosphino)ferrocene-κ²P,P']dichloroplatinum(II)
 chloroform solvate
;
_journal_coeditor_code           NG2176
_journal_issue                   1
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m210
_journal_page_last               m212
_journal_paper_doi               10.1107/S1600536806052834
_journal_volume                  63
_journal_year                    2007
_chemical_formula_iupac          '[Pt1 Fe1 Cl2 (C17 H14 P1)2] , C H Cl3'
_chemical_formula_moiety         'C34 H28 Cl2 Fe P2 Pt , C H Cl3'
_chemical_formula_sum            'C35 H29 Cl5 Fe P2 Pt'
_chemical_formula_weight         939.71
_chemical_name_systematic
;
[1,1'-Bis(diphenylphosphine)ferrocene-κ²P,P']dichloroplatinum(II)
chloroform solvate
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_audit_creation_method           'WinGX routine CIF_UPDATE'
_cell_angle_alpha                90
_cell_angle_beta                 94.394(3)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   12.1534(6)
_cell_length_b                   16.4121(8)
_cell_length_c                   16.7053(8)
_cell_measurement_reflns_used    6624
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      28.26
_cell_measurement_theta_min      2.35
_cell_volume                     3322.3(3)
_computing_cell_refinement       'SAINT-Plus (Bruker, 2004)'
_computing_data_collection       'APEX2 (Bruker, 2005)'
_computing_data_reduction        'SAINT-Plus and XPREP (Bruker, 2004)'
_computing_molecular_graphics    'DIAMOND (Brandenburg & Putz, 2005)'
_computing_publication_material  'WinGX (Farrugia, 1999)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 1997)'
_computing_structure_solution    'SIR97 (Altomare et al.,  1999)'
_diffrn_ambient_temperature      100(2)
_diffrn_detector_area_resol_mean 512
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'Bruker X8 APEXII 4K KappaCCD area-detector'
_diffrn_measurement_method       'ω and φ'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0399
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_k_min       -21
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            38208
_diffrn_reflns_theta_full        28.29
_diffrn_reflns_theta_max         28.29
_diffrn_reflns_theta_min         2.09
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    5.168
_exptl_absorpt_correction_T_max  0.6003
_exptl_absorpt_correction_T_min  0.3157
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(SADABS, Bruker, 2004)'
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.879
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       cuboid
_exptl_crystal_F_000             1832
_exptl_crystal_size_max          0.29
_exptl_crystal_size_mid          0.17
_exptl_crystal_size_min          0.11
_refine_diff_density_max         0.987
_refine_diff_density_min         -0.771
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.061
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     397
_refine_ls_number_reflns         8237
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.061
_refine_ls_R_factor_gt           0.022
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w = 1/[σ²(Fo²)+(0.0212P)²+1.9034P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_ref         0.0518
_reflns_number_gt                7233
_reflns_number_total             8237
_reflns_threshold_expression     I>2σ(I)
_cod_data_source_file            ng2176.cif
_cod_data_source_block           I
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               2211910
_cod_database_fobs_code          2211910
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_occupancy
Pt Pt 0.159641(8) 0.203369(6) 0.093315(6) 0.00816(3) Uani d . 1
P P1 0.29023(5) 0.11864(4) 0.05244(4) 0.00905(13) Uani d . 1
P P2 0.14131(5) 0.28742(4) -0.01479(4) 0.00977(13) Uani d . 1
Cl Cl1 0.02287(5) 0.28611(4) 0.14371(4) 0.01461(13) Uani d . 1
Cl Cl2 0.14449(5) 0.12252(4) 0.20851(4) 0.01342(13) Uani d . 1
Fe Fe 0.38292(3) 0.24013(2) -0.09034(2) 0.01047(8) Uani d . 1
C C11 0.2319(2) 0.04027(15) -0.01498(16) 0.0106(5) Uani d . 1
C C12 0.1217(2) 0.04545(16) -0.04483(16) 0.0124(5) Uani d . 1
H H12 0.0785 0.091 -0.0316 0.015 Uiso calc R 1
C C13 0.0749(2) -0.01548(17) -0.09367(17) 0.0163(6) Uani d . 1
H H13 0 -0.0113 -0.1142 0.02 Uiso calc R 1
C C14 0.1373(2) -0.08279(17) -0.11275(16) 0.0151(6) Uani d . 1
H H14 0.1046 -0.1249 -0.1456 0.018 Uiso calc R 1
C C15 0.2466(2) -0.08849(17) -0.08396(17) 0.0161(6) Uani d . 1
H H15 0.2894 -0.1341 -0.0979 0.019 Uiso calc R 1
C C16 0.2944(2) -0.02776(16) -0.03465(16) 0.0135(5) Uani d . 1
H H16 0.3693 -0.0323 -0.0143 0.016 Uiso calc R 1
C C21 0.3688(2) 0.06000(16) 0.13081(15) 0.0113(5) Uani d . 1
C C22 0.3231(2) -0.00903(16) 0.16433(16) 0.0145(6) Uani d . 1
H H22 0.2506 -0.026 0.1465 0.017 Uiso calc R 1
C C23 0.3836(2) -0.05259(17) 0.22354(17) 0.0181(6) Uani d . 1
H H23 0.3521 -0.0992 0.2466 0.022 Uiso calc R 1
C C24 0.4900(2) -0.02856(17) 0.24946(17) 0.0180(6) Uani d . 1
H H24 0.5309 -0.0586 0.2903 0.022 Uiso calc R 1
C C25 0.5365(2) 0.03903(17) 0.21583(17) 0.0161(6) Uani d . 1
H H25 0.6097 0.0551 0.2329 0.019 Uiso calc R 1
C C26 0.4755(2) 0.08332(17) 0.15682(16) 0.0140(5) Uani d . 1
H H26 0.5072 0.13 0.1341 0.017 Uiso calc R 1
C C31 0.4004(2) 0.16553(16) 0.00395(16) 0.0106(5) Uani d . 1
C C32 0.4597(2) 0.13331(17) -0.06050(17) 0.0143(6) Uani d . 1
H H32 0.4478 0.0819 -0.0858 0.017 Uiso calc R 1
C C33 0.5391(2) 0.19232(17) -0.07922(18) 0.0171(6) Uani d . 1
H H33 0.5888 0.1874 -0.1202 0.02 Uiso calc R 1
C C34 0.5323(2) 0.25980(18) -0.02677(18) 0.0182(6) Uani d . 1
H H34 0.577 0.3073 -0.0261 0.022 Uiso calc R 1
C C35 0.4469(2) 0.24386(17) 0.02469(17) 0.0150(6) Uani d . 1
H H35 0.4244 0.2789 0.0656 0.018 Uiso calc R 1
C C41 0.2289(2) 0.28393(16) -0.09738(16) 0.0115(5) Uani d . 1
C C42 0.2364(2) 0.21791(17) -0.15316(16) 0.0140(5) Uani d . 1
H H42 0.1954 0.1686 -0.1537 0.017 Uiso calc R 1
C C43 0.3163(2) 0.23967(18) -0.20747(17) 0.0179(6) Uani d . 1
H H43 0.338 0.2071 -0.2505 0.022 Uiso calc R 1
C C44 0.3577(2) 0.31805(18) -0.18641(18) 0.0185(6) Uani d . 1
H H44 0.4123 0.3468 -0.2129 0.022 Uiso calc R 1
C C45 0.3041(2) 0.34664(17) -0.11910(17) 0.0152(6) Uani d . 1
H H45 0.3158 0.3978 -0.0932 0.018 Uiso calc R 1
C C51 0.1568(2) 0.39478(16) 0.01319(17) 0.0145(5) Uani d . 1
C C52 0.2200(2) 0.41481(17) 0.08345(18) 0.0178(6) Uani d . 1
H H52 0.2484 0.373 0.1185 0.021 Uiso calc R 1
C C53 0.2415(3) 0.49624(18) 0.1022(2) 0.0247(7) Uani d . 1
H H53 0.2837 0.5099 0.1506 0.03 Uiso calc R 1
C C54 0.2018(3) 0.55712(18) 0.0510(2) 0.0253(7) Uani d . 1
H H54 0.2178 0.6125 0.0636 0.03 Uiso calc R 1
C C55 0.1386(3) 0.53747(18) -0.0186(2) 0.0248(7) Uani d . 1
H H55 0.1106 0.5795 -0.0537 0.03 Uiso calc R 1
C C56 0.1158(2) 0.45633(17) -0.03763(19) 0.0202(6) Uani d . 1
H H56 0.0721 0.4431 -0.0855 0.024 Uiso calc R 1
C C61 0.0074(2) 0.27138(16) -0.07031(16) 0.0111(5) Uani d . 1
C C62 -0.0122(2) 0.30336(16) -0.14761(17) 0.0154(6) Uani d . 1
H H62 0.0436 0.3342 -0.1705 0.018 Uiso calc R 1
C C63 -0.1125(2) 0.29056(16) -0.19134(17) 0.0159(6) Uani d . 1
H H63 -0.126 0.3144 -0.243 0.019 Uiso calc R 1
C C64 -0.1928(2) 0.24322(17) -0.15999(17) 0.0161(6) Uani d . 1
H H64 -0.2612 0.2341 -0.1901 0.019 Uiso calc R 1
C C65 -0.1731(2) 0.20898(16) -0.08414(17) 0.0146(6) Uani d . 1
H H65 -0.2274 0.1753 -0.063 0.018 Uiso calc R 1
C C66 -0.0744(2) 0.22384(16) -0.03918(17) 0.0132(5) Uani d . 1
H H66 -0.0624 0.2015 0.0132 0.016 Uiso calc R 1
C C 0.9468(3) -0.0399(2) 0.3066(2) 0.0280(7) Uani d . 1
H H0 0.975 0.0119 0.2844 0.034 Uiso calc R 1
Cl Cl3 1.01653(7) -0.12216(5) 0.26529(5) 0.0341(2) Uani d . 1
Cl Cl4 0.97166(9) -0.03814(6) 0.41147(6) 0.0448(3) Uani d . 1
Cl Cl5 0.80373(7) -0.04613(5) 0.28071(5) 0.03336(19) Uani d . 1
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 0 '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'
Fe Fe 0.3463 0.8444 '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_publ_flag
P1 Pt P2 99.34(2) y
P1 Pt Cl1 176.11(2) y
P2 Pt Cl1 84.54(2) y
P1 Pt Cl2 90.05(2) y
P2 Pt Cl2 169.41(2) y
Cl1 Pt Cl2 86.06(2) y
C31 P1 C11 107.08(12) ?
C31 P1 C21 100.47(12) ?
C11 P1 C21 103.19(12) ?
C31 P1 Pt 116.10(9) ?
C11 P1 Pt 111.94(9) ?
C21 P1 Pt 116.60(9) ?
C41 P2 C51 99.83(12) ?
C41 P2 C61 99.32(12) ?
C51 P2 C61 109.76(12) ?
C41 P2 Pt 124.09(9) ?
C51 P2 Pt 112.35(9) ?
C61 P2 Pt 110.19(9) ?
C12 C11 C16 119.1(2) ?
C12 C11 P1 119.8(2) ?
C16 C11 P1 121.03(19) ?
C13 C12 C11 120.4(3) ?
C13 C12 H12 119.8 ?
C11 C12 H12 119.8 ?
C12 C13 C14 120.2(3) ?
C12 C13 H13 119.9 ?
C14 C13 H13 119.9 ?
C15 C14 C13 120.0(3) ?
C15 C14 H14 120 ?
C13 C14 H14 120 ?
C14 C15 C16 120.3(3) ?
C14 C15 H15 119.9 ?
C16 C15 H15 119.9 ?
C15 C16 C11 120.0(2) ?
C15 C16 H16 120 ?
C11 C16 H16 120 ?
C26 C21 C22 119.2(2) ?
C26 C21 P1 120.1(2) ?
C22 C21 P1 120.7(2) ?
C23 C22 C21 119.9(3) ?
C23 C22 H22 120 ?
C21 C22 H22 120 ?
C22 C23 C24 120.4(3) ?
C22 C23 H23 119.8 ?
C24 C23 H23 119.8 ?
C25 C24 C23 120.0(3) ?
C25 C24 H24 120 ?
C23 C24 H24 120 ?
C24 C25 C26 119.6(3) ?
C24 C25 H25 120.2 ?
C26 C25 H25 120.2 ?
C21 C26 C25 120.8(3) ?
C21 C26 H26 119.6 ?
C25 C26 H26 119.6 ?
C35 C31 C32 107.4(2) ?
C35 C31 P1 124.7(2) ?
C32 C31 P1 127.9(2) ?
C33 C32 C31 107.6(2) ?
C33 C32 H32 126.2 ?
C31 C32 H32 126.2 ?
C34 C33 C32 108.9(3) ?
C34 C33 H33 125.5 ?
C32 C33 H33 125.5 ?
C33 C34 C35 108.0(2) ?
C33 C34 H34 126 ?
C35 C34 H34 126 ?
C34 C35 C31 108.1(2) ?
C34 C35 H35 126 ?
C31 C35 H35 126 ?
C42 C41 C45 107.6(2) ?
C42 C41 P2 126.1(2) ?
C45 C41 P2 126.3(2) ?
C43 C42 C41 107.7(2) ?
C43 C42 H42 126.1 ?
C41 C42 H42 126.1 ?
C44 C43 C42 108.5(3) ?
C44 C43 H43 125.8 ?
C42 C43 H43 125.8 ?
C43 C44 C45 108.7(3) ?
C43 C44 H44 125.7 ?
C45 C44 H44 125.7 ?
C44 C45 C41 107.5(2) ?
C44 C45 H45 126.2 ?
C41 C45 H45 126.2 ?
C56 C51 C52 119.5(3) ?
C56 C51 P2 121.3(2) ?
C52 C51 P2 118.8(2) ?
C51 C52 C53 119.9(3) ?
C51 C52 H52 120.1 ?
C53 C52 H52 120.1 ?
C54 C53 C52 120.4(3) ?
C54 C53 H53 119.8 ?
C52 C53 H53 119.8 ?
C53 C54 C55 119.9(3) ?
C53 C54 H54 120 ?
C55 C54 H54 120 ?
C54 C55 C56 120.2(3) ?
C54 C55 H55 119.9 ?
C56 C55 H55 119.9 ?
C51 C56 C55 120.1(3) ?
C51 C56 H56 120 ?
C55 C56 H56 120 ?
C66 C61 C62 118.6(2) ?
C66 C61 P2 121.5(2) ?
C62 C61 P2 119.8(2) ?
C63 C62 C61 120.7(3) ?
C63 C62 H62 119.7 ?
C61 C62 H62 119.7 ?
C64 C63 C62 120.2(3) ?
C64 C63 H63 119.9 ?
C62 C63 H63 119.9 ?
C63 C64 C65 119.7(2) ?
C63 C64 H64 120.2 ?
C65 C64 H64 120.2 ?
C66 C65 C64 120.3(3) ?
C66 C65 H65 119.9 ?
C64 C65 H65 119.9 ?
C65 C66 C61 120.5(3) ?
C65 C66 H66 119.8 ?
C61 C66 H66 119.8 ?
Cl4 C Cl3 110.66(17) ?
Cl4 C Cl5 109.7(2) ?
Cl3 C Cl5 110.78(17) ?
Cl4 C H0 108.5 ?
Cl3 C H0 108.5 ?
Cl5 C H0 108.5 ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_publ_flag
Pt P1 2.2549(7) y
Pt P2 2.2699(7) y
Pt Cl1 2.3517(6) y
Pt Cl2 2.3562(6) y
P1 C31 1.791(3) ?
P1 C11 1.818(3) ?
P1 C21 1.833(3) ?
P2 C41 1.807(3) ?
P2 C51 1.829(3) ?
P2 C61 1.830(3) ?
C11 C12 1.395(4) ?
C11 C16 1.403(4) ?
C12 C13 1.385(4) ?
C12 H12 0.95 ?
C13 C14 1.390(4) ?
C13 H13 0.95 ?
C14 C15 1.381(4) ?
C14 H14 0.95 ?
C15 C16 1.391(4) ?
C15 H15 0.95 ?
C16 H16 0.95 ?
C21 C26 1.389(4) ?
C21 C22 1.398(4) ?
C22 C23 1.385(4) ?
C22 H22 0.95 ?
C23 C24 1.390(4) ?
C23 H23 0.95 ?
C24 C25 1.384(4) ?
C24 H24 0.95 ?
C25 C26 1.392(4) ?
C25 H25 0.95 ?
C26 H26 0.95 ?
C31 C35 1.436(4) ?
C31 C32 1.441(4) ?
C32 C33 1.419(4) ?
C32 H32 0.95 ?
C33 C34 1.418(4) ?
C33 H33 0.95 ?
C34 C35 1.422(4) ?
C34 H34 0.95 ?
C35 H35 0.95 ?
C41 C42 1.437(4) ?
C41 C45 1.441(4) ?
C42 C43 1.424(4) ?
C42 H42 0.95 ?
C43 C44 1.416(4) ?
C43 H43 0.95 ?
C44 C45 1.421(4) ?
C44 H44 0.95 ?
C45 H45 0.95 ?
C51 C56 1.387(4) ?
C51 C52 1.392(4) ?
C52 C53 1.393(4) ?
C52 H52 0.95 ?
C53 C54 1.378(4) ?
C53 H53 0.95 ?
C54 C55 1.382(5) ?
C54 H54 0.95 ?
C55 C56 1.392(4) ?
C55 H55 0.95 ?
C56 H56 0.95 ?
C61 C66 1.395(4) ?
C61 C62 1.397(4) ?
C62 C63 1.388(4) ?
C62 H62 0.95 ?
C63 C64 1.381(4) ?
C63 H63 0.95 ?
C64 C65 1.390(4) ?
C64 H64 0.95 ?
C65 C66 1.387(4) ?
C65 H65 0.95 ?
C66 H66 0.95 ?
C Cl4 1.755(3) ?
C Cl3 1.762(3) ?
C Cl5 1.762(3) ?
C H0 1 ?
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
C66 H66 Cl1 0.95 2.72 3.350(3) 124.2
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
P2 Pt P1 C31 41.75(10)
Cl1 Pt P1 C31 -142.5(3)
Cl2 Pt P1 C31 -143.17(10)
P2 Pt P1 C11 -81.62(9)
Cl1 Pt P1 C11 94.2(3)
Cl2 Pt P1 C11 93.46(9)
P2 Pt P1 C21 159.90(10)
Cl1 Pt P1 C21 -24.3(4)
Cl2 Pt P1 C21 -25.02(10)
P1 Pt P2 C41 -6.90(11)
Cl1 Pt P2 C41 173.39(11)
Cl2 Pt P2 C41 -159.09(14)
P1 Pt P2 C51 -126.98(10)
Cl1 Pt P2 C51 53.31(10)
Cl2 Pt P2 C51 80.84(16)
P1 Pt P2 C61 110.30(9)
Cl1 Pt P2 C61 -69.42(9)
Cl2 Pt P2 C61 -41.89(17)
C31 P1 C11 C12 -118.6(2)
C21 P1 C11 C12 135.9(2)
Pt P1 C11 C12 9.8(2)
C31 P1 C11 C16 64.5(2)
C21 P1 C11 C16 -41.0(2)
Pt P1 C11 C16 -167.16(19)
C16 C11 C12 C13 -0.4(4)
P1 C11 C12 C13 -177.4(2)
C11 C12 C13 C14 0.6(4)
C12 C13 C14 C15 -1.0(4)
C13 C14 C15 C16 1.1(4)
C14 C15 C16 C11 -1.0(4)
C12 C11 C16 C15 0.6(4)
P1 C11 C16 C15 177.6(2)
C31 P1 C21 C26 23.5(2)
C11 P1 C21 C26 134.0(2)
Pt P1 C21 C26 -102.9(2)
C31 P1 C21 C22 -155.7(2)
C11 P1 C21 C22 -45.2(3)
Pt P1 C21 C22 77.9(2)
C26 C21 C22 C23 0.9(4)
P1 C21 C22 C23 -179.9(2)
C21 C22 C23 C24 -0.6(4)
C22 C23 C24 C25 -0.3(4)
C23 C24 C25 C26 0.9(4)
C22 C21 C26 C25 -0.3(4)
P1 C21 C26 C25 -179.5(2)
C24 C25 C26 C21 -0.6(4)
C11 P1 C31 C35 161.1(2)
C21 P1 C31 C35 -91.5(2)
Pt P1 C31 C35 35.2(2)
C11 P1 C31 C32 -19.9(3)
C21 P1 C31 C32 87.5(2)
Pt P1 C31 C32 -145.8(2)
C35 C31 C32 C33 -1.2(3)
P1 C31 C32 C33 179.7(2)
C31 C32 C33 C34 1.3(3)
C32 C33 C34 C35 -0.9(3)
C33 C34 C35 C31 0.1(3)
C32 C31 C35 C34 0.6(3)
P1 C31 C35 C34 179.78(19)
C51 P2 C41 C42 -169.0(2)
C61 P2 C41 C42 -56.9(3)
Pt P2 C41 C42 65.3(3)
C51 P2 C41 C45 11.1(3)
C61 P2 C41 C45 123.2(2)
Pt P2 C41 C45 -114.5(2)
C45 C41 C42 C43 0.8(3)
P2 C41 C42 C43 -179.0(2)
C41 C42 C43 C44 -0.3(3)
C42 C43 C44 C45 -0.3(3)
C43 C44 C45 C41 0.8(3)
C42 C41 C45 C44 -1.0(3)
P2 C41 C45 C44 178.9(2)
C41 P2 C51 C56 67.1(3)
C61 P2 C51 C56 -36.6(3)
Pt P2 C51 C56 -159.6(2)
C41 P2 C51 C52 -106.8(2)
C61 P2 C51 C52 149.5(2)
Pt P2 C51 C52 26.5(3)
C56 C51 C52 C53 0.1(4)
P2 C51 C52 C53 174.0(2)
C51 C52 C53 C54 -0.9(5)
C52 C53 C54 C55 1.2(5)
C53 C54 C55 C56 -0.6(5)
C52 C51 C56 C55 0.5(4)
P2 C51 C56 C55 -173.3(2)
C54 C55 C56 C51 -0.2(5)
C41 P2 C61 C66 141.7(2)
C51 P2 C61 C66 -114.2(2)
Pt P2 C61 C66 10.0(2)
C41 P2 C61 C62 -34.6(2)
C51 P2 C61 C62 69.5(2)
Pt P2 C61 C62 -166.30(19)
C66 C61 C62 C63 2.3(4)
P2 C61 C62 C63 178.8(2)
C61 C62 C63 C64 -2.5(4)
C62 C63 C64 C65 0.5(4)
C63 C64 C65 C66 1.6(4)
C64 C65 C66 C61 -1.8(4)
C62 C61 C66 C65 -0.2(4)
P2 C61 C66 C65 -176.6(2)
