#------------------------------------------------------------------------------
#$Date: 2020-05-19 04:38:53 +0300 (Tue, 19 May 2020) $
#$Revision: 252160 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/24/05/7240552.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_7240552
loop_
_publ_author_name
'Suslonov, Vitalii V.'
'Eliseeva, Anastasiya A.'
'Novikov, Alexander S.'
'Ivanov, Daniil M.'
'Dubovtsev, Alexey Yu.'
'Bokach, Nadezhda A.'
'Kukushkin, Vadim Yu.'
_publ_section_title
;
 Tetrachloroplatinate(II) Anion as a Square-planar Tecton for Crystal
 Engineering Involving Halogen Bonding
;
_journal_name_full               CrystEngComm
_journal_paper_doi               10.1039/D0CE00576B
_journal_year                    2020
_chemical_formula_moiety         'Cl4 Pt, C6 F4 I2, 2(C36 H30 N P2)'
_chemical_formula_sum            'C78 H60 Cl4 F4 I2 N2 P4 Pt'
_chemical_formula_weight         1815.85
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     dual
_audit_creation_date             2020-02-21
_audit_creation_method
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_audit_update_record
;
2020-03-10 deposited with the CCDC.	2020-05-18 downloaded from the CCDC.
;
_cell_angle_alpha                109.418(4)
_cell_angle_beta                 92.227(4)
_cell_angle_gamma                97.782(4)
_cell_formula_units_Z            1
_cell_length_a                   10.8208(5)
_cell_length_b                   12.0593(6)
_cell_length_c                   14.2648(7)
_cell_measurement_reflns_used    6747
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      31.0710
_cell_measurement_theta_min      2.9630
_cell_volume                     1732.36(15)
_computing_cell_refinement
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.32 (release 02-08-2013 CrysAlis171 .NET)
(compiled Aug  2 2013,16:46:58)
;
_computing_data_collection
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.32 (release 02-08-2013 CrysAlis171 .NET)
(compiled Aug  2 2013,16:46:58)
;
_computing_data_reduction
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.32 (release 02-08-2013 CrysAlis171 .NET)
(compiled Aug  2 2013,16:46:58)
;
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2015)'
_computing_structure_solution    'ShelXT (Sheldrick, 2015)'
_diffrn_ambient_temperature      100(2)
_diffrn_detector_area_resol_mean 16.2096
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.874
_diffrn_measurement_details
;
#__ type_ start__ end____ width___ exp.time_
  1 omega  -91.00  -66.00   1.0000    3.6000
omega____ theta____ kappa____ phi______ frames
    -      -23.3621 -178.0000 -150.0000 25

#__ type_ start__ end____ width___ exp.time_
  2 omega  -31.00   12.00   1.0000    3.6000
omega____ theta____ kappa____ phi______ frames
    -      -23.3621  -93.0000   -4.0000 43

#__ type_ start__ end____ width___ exp.time_
  3 omega  -59.00   11.00   1.0000    3.6000
omega____ theta____ kappa____ phi______ frames
    -      -23.3621   93.0000  106.0000 70

#__ type_ start__ end____ width___ exp.time_
  4 omega  -21.00   12.00   1.0000    3.6000
omega____ theta____ kappa____ phi______ frames
    -       24.2996  -99.0000   90.0000 33

#__ type_ start__ end____ width___ exp.time_
  5 omega   35.00   62.00   1.0000    3.6000
omega____ theta____ kappa____ phi______ frames
    -       24.2996  -99.0000  -90.0000 27

#__ type_ start__ end____ width___ exp.time_
  6 omega  -45.00   36.00   1.0000    3.6000
omega____ theta____ kappa____ phi______ frames
    -       24.2996  -57.0000 -150.0000 81

#__ type_ start__ end____ width___ exp.time_
  7 omega   22.00   48.00   1.0000    3.6000
omega____ theta____ kappa____ phi______ frames
    -       24.2996   57.0000 -150.0000 26

#__ type_ start__ end____ width___ exp.time_
  8 omega   53.00   79.00   1.0000    3.6000
omega____ theta____ kappa____ phi______ frames
    -       24.2996   57.0000 -150.0000 26

#__ type_ start__ end____ width___ exp.time_
  9 omega  -20.00   94.00   1.0000    3.6000
omega____ theta____ kappa____ phi______ frames
    -       24.2996   19.0000   30.0000 114
;
_diffrn_measurement_device_type  'Xcalibur, Eos'
_diffrn_measurement_method       'ω scans'
_diffrn_orient_matrix_UB_11      0.0331723000
_diffrn_orient_matrix_UB_12      0.0560110000
_diffrn_orient_matrix_UB_13      0.0308382000
_diffrn_orient_matrix_UB_21      0.0114528000
_diffrn_orient_matrix_UB_22      -0.0241724000
_diffrn_orient_matrix_UB_23      0.0379624000
_diffrn_orient_matrix_UB_31      0.0564007000
_diffrn_orient_matrix_UB_32      -0.0163282000
_diffrn_orient_matrix_UB_33      -0.0202507000
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0297
_diffrn_reflns_av_unetI/netI     0.0518
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.874
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_l_max       20
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_number            18135
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.874
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         31.412
_diffrn_reflns_theta_min         2.606
_diffrn_source                   'Enhance (Mo) X-ray Source'
_exptl_absorpt_coefficient_mu    3.221
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.74284
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.32 (release 02-08-2013 CrysAlis171 .NET)
(compiled Aug  2 2013,16:46:58)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            'clear yellow'
_exptl_crystal_colour_lustre     clear
_exptl_crystal_colour_primary    yellow
_exptl_crystal_density_diffrn    1.741
_exptl_crystal_description       prism
_exptl_crystal_F_000             890
_exptl_crystal_size_max          0.2
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.15
_refine_diff_density_max         1.599
_refine_diff_density_min         -1.738
_refine_diff_density_rms         0.126
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.045
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     430
_refine_ls_number_reflns         10013
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.045
_refine_ls_R_factor_all          0.0378
_refine_ls_R_factor_gt           0.0308
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0227P)²+0.6586P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0663
_refine_ls_wR_factor_ref         0.0708
_reflns_Friedel_coverage         0.000
_reflns_number_gt                8817
_reflns_number_total             10013
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d0ce00576b2.cif
_cod_data_source_block           PPN2PtCl4_14FIB
_cod_database_code               7240552
_shelx_shelxl_version_number     2014/7
_chemical_oxdiff_formula         'C84 H60 P4 N2 Pt1 Cl4 I4 F8'
_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.
;
_reflns_odcompleteness_completeness 99.91
_reflns_odcompleteness_iscentric 1
_reflns_odcompleteness_theta     28.98
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups
2.a Aromatic/amide H refined with riding coordinates:
 C2A(H2A), C3A(H3A), C4A(H4A), C5A(H5A), C6A(H6A), C8A(H8A), C9A(H9A),
 C10A(H10A), C11A(H11A), C12A(H12A), C14A(H14A), C15A(H15A), C16A(H16A),
 C17A(H17A), C18A(H18A), C20A(H20A), C21A(H21A), C22A(H22A), C23A(H23A),
 C24A(H24A), C26A(H26A), C27A(H27A), C28A(H28A), C29A(H29A), C30A(H30A),
 C32A(H32A), C33A(H33A), C34A(H34A), C35A(H35A), C36A(H36A)
;
_olex2_submission_special_instructions 'No special instructions were received'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -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_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
Pt1 Pt 1.0000 1.0000 1.0000 0.01374(4) Uani 1 2 d S T P . .
Cl1 Cl 0.91777(8) 0.99323(7) 0.84700(5) 0.02502(17) Uani 1 1 d . . . . .
Cl2 Cl 1.15980(7) 0.89973(7) 0.93049(5) 0.02345(16) Uani 1 1 d . . . . .
I1 I 0.98156(2) 0.77613(2) 0.67817(2) 0.01550(5) Uani 1 1 d . . . . .
F1 F 0.77379(15) 0.55183(16) 0.56107(13) 0.0220(4) Uani 1 1 d . . . . .
F2 F 0.78837(15) 0.33893(16) 0.42950(13) 0.0209(4) Uani 1 1 d . . . . .
C1 C 0.9922(3) 0.6136(3) 0.5689(2) 0.0149(6) Uani 1 1 d . . . . .
C2 C 0.8873(3) 0.5275(3) 0.5316(2) 0.0159(6) Uani 1 1 d . . . . .
C3 C 0.8947(3) 0.4171(3) 0.4645(2) 0.0153(6) Uani 1 1 d . . . . .
P1A P 0.66164(6) 0.34279(6) 0.78247(5) 0.01034(13) Uani 1 1 d . . . . .
P2A P 0.42798(6) 0.31062(6) 0.65969(5) 0.01088(14) Uani 1 1 d . . . . .
N1A N 0.5654(2) 0.3711(2) 0.70973(16) 0.0122(5) Uani 1 1 d . . . . .
C1A C 0.7524(2) 0.4802(2) 0.8627(2) 0.0119(5) Uani 1 1 d . . . . .
C2A C 0.7774(3) 0.5772(3) 0.8296(2) 0.0146(6) Uani 1 1 d . . . . .
H2A H 0.7452 0.5716 0.7650 0.017 Uiso 1 1 calc R . . . .
C3A C 0.8494(3) 0.6816(3) 0.8920(2) 0.0187(6) Uani 1 1 d . . . . .
H3A H 0.8660 0.7480 0.8701 0.022 Uiso 1 1 calc R . . . .
C4A C 0.8977(3) 0.6904(3) 0.9861(2) 0.0191(6) Uani 1 1 d . . . . .
H4A H 0.9473 0.7623 1.0281 0.023 Uiso 1 1 calc R . . . .
C5A C 0.8736(3) 0.5944(3) 1.0189(2) 0.0203(6) Uani 1 1 d . . . . .
H5A H 0.9070 0.6006 1.0833 0.024 Uiso 1 1 calc R . . . .
C6A C 0.8008(3) 0.4888(3) 0.9579(2) 0.0164(6) Uani 1 1 d . . . . .
H6A H 0.7840 0.4230 0.9806 0.020 Uiso 1 1 calc R . . . .
C7A C 0.7712(2) 0.2546(2) 0.7133(2) 0.0131(5) Uani 1 1 d . . . . .
C8A C 0.7641(3) 0.2239(3) 0.6098(2) 0.0181(6) Uani 1 1 d . . . . .
H8A H 0.6987 0.2449 0.5759 0.022 Uiso 1 1 calc R . . . .
C9A C 0.8532(3) 0.1622(3) 0.5562(2) 0.0227(7) Uani 1 1 d . . . . .
H9A H 0.8489 0.1413 0.4857 0.027 Uiso 1 1 calc R . . . .
C10A C 0.9479(3) 0.1316(3) 0.6060(2) 0.0242(7) Uani 1 1 d . . . . .
H10A H 1.0089 0.0897 0.5696 0.029 Uiso 1 1 calc R . . . .
C11A C 0.9542(3) 0.1616(3) 0.7088(2) 0.0227(7) Uani 1 1 d . . . . .
H11A H 1.0190 0.1395 0.7424 0.027 Uiso 1 1 calc R . . . .
C12A C 0.8669(3) 0.2236(3) 0.7628(2) 0.0180(6) Uani 1 1 d . . . . .
H12A H 0.8722 0.2449 0.8334 0.022 Uiso 1 1 calc R . . . .
C13A C 0.5885(2) 0.2729(3) 0.86396(19) 0.0126(5) Uani 1 1 d . . . . .
C14A C 0.6051(3) 0.1617(3) 0.8661(2) 0.0200(6) Uani 1 1 d . . . . .
H14A H 0.6618 0.1185 0.8249 0.024 Uiso 1 1 calc R . . . .
C15A C 0.5390(3) 0.1138(3) 0.9283(3) 0.0287(8) Uani 1 1 d . . . . .
H15A H 0.5509 0.0379 0.9301 0.034 Uiso 1 1 calc R . . . .
C16A C 0.4553(3) 0.1757(3) 0.9881(2) 0.0267(7) Uani 1 1 d . . . . .
H16A H 0.4093 0.1416 1.0299 0.032 Uiso 1 1 calc R . . . .
C17A C 0.4389(3) 0.2870(3) 0.9871(2) 0.0196(6) Uani 1 1 d . . . . .
H17A H 0.3819 0.3296 1.0283 0.024 Uiso 1 1 calc R . . . .
C18A C 0.5056(3) 0.3360(3) 0.9259(2) 0.0150(6) Uani 1 1 d . . . . .
H18A H 0.4952 0.4129 0.9258 0.018 Uiso 1 1 calc R . . . .
C19A C 0.3206(3) 0.4125(3) 0.7097(2) 0.0126(5) Uani 1 1 d . . . . .
C20A C 0.1934(3) 0.3823(3) 0.6738(2) 0.0171(6) Uani 1 1 d . . . . .
H20A H 0.1640 0.3090 0.6218 0.020 Uiso 1 1 calc R . . . .
C21A C 0.1110(3) 0.4609(3) 0.7149(2) 0.0214(7) Uani 1 1 d . . . . .
H21A H 0.0244 0.4399 0.6923 0.026 Uiso 1 1 calc R . . . .
C22A C 0.1544(3) 0.5700(3) 0.7890(2) 0.0222(7) Uani 1 1 d . . . . .
H22A H 0.0979 0.6237 0.8161 0.027 Uiso 1 1 calc R . . . .
C23A C 0.2802(3) 0.6003(3) 0.8231(2) 0.0201(6) Uani 1 1 d . . . . .
H23A H 0.3098 0.6749 0.8734 0.024 Uiso 1 1 calc R . . . .
C24A C 0.3632(3) 0.5218(3) 0.7840(2) 0.0162(6) Uani 1 1 d . . . . .
H24A H 0.4493 0.5427 0.8081 0.019 Uiso 1 1 calc R . . . .
C25A C 0.4224(3) 0.2801(3) 0.5270(2) 0.0138(5) Uani 1 1 d . . . . .
C26A C 0.3353(3) 0.1887(3) 0.4609(2) 0.0188(6) Uani 1 1 d . . . . .
H26A H 0.2781 0.1403 0.4856 0.023 Uiso 1 1 calc R . . . .
C27A C 0.3324(3) 0.1686(3) 0.3589(2) 0.0262(8) Uani 1 1 d . . . . .
H27A H 0.2741 0.1058 0.3138 0.031 Uiso 1 1 calc R . . . .
C28A C 0.4143(3) 0.2400(3) 0.3236(2) 0.0280(8) Uani 1 1 d . . . . .
H28A H 0.4115 0.2267 0.2540 0.034 Uiso 1 1 calc R . . . .
C29A C 0.5005(3) 0.3310(3) 0.3886(2) 0.0228(7) Uani 1 1 d . . . . .
H29A H 0.5563 0.3802 0.3637 0.027 Uiso 1 1 calc R . . . .
C30A C 0.5055(3) 0.3504(3) 0.4906(2) 0.0184(6) Uani 1 1 d . . . . .
H30A H 0.5657 0.4118 0.5352 0.022 Uiso 1 1 calc R . . . .
C31A C 0.3725(2) 0.1723(2) 0.6767(2) 0.0127(5) Uani 1 1 d . . . . .
C32A C 0.2888(3) 0.1643(3) 0.7470(2) 0.0148(6) Uani 1 1 d . . . . .
H32A H 0.2518 0.2315 0.7823 0.018 Uiso 1 1 calc R . . . .
C33A C 0.2595(3) 0.0584(3) 0.7652(2) 0.0193(6) Uani 1 1 d . . . . .
H33A H 0.2035 0.0536 0.8139 0.023 Uiso 1 1 calc R . . . .
C34A C 0.3114(3) -0.0405(3) 0.7129(2) 0.0203(6) Uani 1 1 d . . . . .
H34A H 0.2903 -0.1132 0.7252 0.024 Uiso 1 1 calc R . . . .
C35A C 0.3944(3) -0.0335(3) 0.6425(2) 0.0179(6) Uani 1 1 d . . . . .
H35A H 0.4297 -0.1016 0.6066 0.022 Uiso 1 1 calc R . . . .
C36A C 0.4261(3) 0.0718(3) 0.6244(2) 0.0161(6) Uani 1 1 d . . . . .
H36A H 0.4837 0.0766 0.5768 0.019 Uiso 1 1 calc R . . . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
I I -0.4742 1.8119 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 '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'
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
Cl1 Pt1 Cl1 180.0 . 2_777 ?
Cl1 Pt1 Cl2 87.90(3) . 2_777 ?
Cl1 Pt1 Cl2 92.10(3) . . ?
Cl1 Pt1 Cl2 92.10(3) 2_777 2_777 ?
Cl1 Pt1 Cl2 87.90(3) 2_777 . ?
Cl2 Pt1 Cl2 180.0 . 2_777 ?
C2 C1 I1 121.4(2) . . ?
C3 C1 I1 121.7(2) 2_766 . ?
C3 C1 C2 116.8(3) 2_766 . ?
F1 C2 C1 119.7(3) . . ?
F1 C2 C3 118.5(3) . . ?
C3 C2 C1 121.8(3) . . ?
F2 C3 C1 120.0(3) . 2_766 ?
F2 C3 C2 118.5(2) . . ?
C2 C3 C1 121.4(3) . 2_766 ?
N1A P1A C1A 109.01(13) . . ?
N1A P1A C7A 110.98(13) . . ?
N1A P1A C13A 113.92(12) . . ?
C1A P1A C7A 106.48(13) . . ?
C1A P1A C13A 105.84(13) . . ?
C13A P1A C7A 110.21(13) . . ?
N1A P2A C19A 108.94(13) . . ?
N1A P2A C25A 109.84(13) . . ?
N1A P2A C31A 114.89(13) . . ?
C19A P2A C25A 108.05(13) . . ?
C31A P2A C19A 108.40(13) . . ?
C31A P2A C25A 106.48(13) . . ?
P1A N1A P2A 133.74(16) . . ?
C2A C1A P1A 120.3(2) . . ?
C2A C1A C6A 120.0(3) . . ?
C6A C1A P1A 119.7(2) . . ?
C1A C2A H2A 120.3 . . ?
C3A C2A C1A 119.4(3) . . ?
C3A C2A H2A 120.3 . . ?
C2A C3A H3A 119.6 . . ?
C4A C3A C2A 120.7(3) . . ?
C4A C3A H3A 119.6 . . ?
C3A C4A H4A 120.0 . . ?
C5A C4A C3A 120.0(3) . . ?
C5A C4A H4A 120.0 . . ?
C4A C5A H5A 119.8 . . ?
C4A C5A C6A 120.3(3) . . ?
C6A C5A H5A 119.8 . . ?
C1A C6A H6A 120.3 . . ?
C5A C6A C1A 119.5(3) . . ?
C5A C6A H6A 120.3 . . ?
C8A C7A P1A 119.3(2) . . ?
C12A C7A P1A 120.5(2) . . ?
C12A C7A C8A 120.1(3) . . ?
C7A C8A H8A 120.1 . . ?
C9A C8A C7A 119.7(3) . . ?
C9A C8A H8A 120.1 . . ?
C8A C9A H9A 120.1 . . ?
C10A C9A C8A 119.8(3) . . ?
C10A C9A H9A 120.1 . . ?
C9A C10A H10A 119.9 . . ?
C9A C10A C11A 120.3(3) . . ?
C11A C10A H10A 119.9 . . ?
C10A C11A H11A 119.8 . . ?
C12A C11A C10A 120.4(3) . . ?
C12A C11A H11A 119.8 . . ?
C7A C12A H12A 120.2 . . ?
C11A C12A C7A 119.6(3) . . ?
C11A C12A H12A 120.2 . . ?
C14A C13A P1A 124.7(2) . . ?
C14A C13A C18A 119.5(3) . . ?
C18A C13A P1A 115.8(2) . . ?
C13A C14A H14A 120.1 . . ?
C15A C14A C13A 119.8(3) . . ?
C15A C14A H14A 120.1 . . ?
C14A C15A H15A 119.7 . . ?
C14A C15A C16A 120.5(3) . . ?
C16A C15A H15A 119.7 . . ?
C15A C16A H16A 119.9 . . ?
C17A C16A C15A 120.1(3) . . ?
C17A C16A H16A 119.9 . . ?
C16A C17A H17A 120.1 . . ?
C18A C17A C16A 119.7(3) . . ?
C18A C17A H17A 120.1 . . ?
C13A C18A H18A 119.8 . . ?
C17A C18A C13A 120.4(3) . . ?
C17A C18A H18A 119.8 . . ?
C20A C19A P2A 120.1(2) . . ?
C24A C19A P2A 120.2(2) . . ?
C24A C19A C20A 119.7(3) . . ?
C19A C20A H20A 120.3 . . ?
C21A C20A C19A 119.5(3) . . ?
C21A C20A H20A 120.3 . . ?
C20A C21A H21A 119.8 . . ?
C20A C21A C22A 120.4(3) . . ?
C22A C21A H21A 119.8 . . ?
C21A C22A H22A 120.0 . . ?
C23A C22A C21A 120.0(3) . . ?
C23A C22A H22A 120.0 . . ?
C22A C23A H23A 119.9 . . ?
C22A C23A C24A 120.2(3) . . ?
C24A C23A H23A 119.9 . . ?
C19A C24A H24A 119.9 . . ?
C23A C24A C19A 120.2(3) . . ?
C23A C24A H24A 119.9 . . ?
C26A C25A P2A 121.4(2) . . ?
C30A C25A P2A 118.8(2) . . ?
C30A C25A C26A 119.7(3) . . ?
C25A C26A H26A 120.1 . . ?
C27A C26A C25A 119.9(3) . . ?
C27A C26A H26A 120.1 . . ?
C26A C27A H27A 120.0 . . ?
C28A C27A C26A 119.9(3) . . ?
C28A C27A H27A 120.0 . . ?
C27A C28A H28A 119.8 . . ?
C27A C28A C29A 120.5(3) . . ?
C29A C28A H28A 119.8 . . ?
C28A C29A H29A 120.0 . . ?
C28A C29A C30A 119.9(3) . . ?
C30A C29A H29A 120.0 . . ?
C25A C30A C29A 120.0(3) . . ?
C25A C30A H30A 120.0 . . ?
C29A C30A H30A 120.0 . . ?
C32A C31A P2A 122.2(2) . . ?
C32A C31A C36A 119.5(3) . . ?
C36A C31A P2A 118.0(2) . . ?
C31A C32A H32A 120.0 . . ?
C33A C32A C31A 120.0(3) . . ?
C33A C32A H32A 120.0 . . ?
C32A C33A H33A 119.8 . . ?
C32A C33A C34A 120.3(3) . . ?
C34A C33A H33A 119.8 . . ?
C33A C34A H34A 120.0 . . ?
C33A C34A C35A 120.0(3) . . ?
C35A C34A H34A 120.0 . . ?
C34A C35A H35A 119.8 . . ?
C36A C35A C34A 120.4(3) . . ?
C36A C35A H35A 119.8 . . ?
C31A C36A H36A 120.1 . . ?
C35A C36A C31A 119.7(3) . . ?
C35A C36A H36A 120.1 . . ?
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 Cl1 2.2962(7) . ?
Pt1 Cl1 2.2962(7) 2_777 ?
Pt1 Cl2 2.3103(8) . ?
Pt1 Cl2 2.3103(8) 2_777 ?
I1 C1 2.081(3) . ?
F1 C2 1.352(3) . ?
F2 C3 1.346(3) . ?
C1 C2 1.384(4) . ?
C1 C3 1.383(4) 2_766 ?
C2 C3 1.372(4) . ?
C3 C1 1.383(4) 2_766 ?
P1A N1A 1.589(2) . ?
P1A C1A 1.798(3) . ?
P1A C7A 1.802(3) . ?
P1A C13A 1.798(3) . ?
P2A N1A 1.590(2) . ?
P2A C19A 1.799(3) . ?
P2A C25A 1.800(3) . ?
P2A C31A 1.792(3) . ?
C1A C2A 1.399(4) . ?
C1A C6A 1.401(4) . ?
C2A H2A 0.9500 . ?
C2A C3A 1.386(4) . ?
C3A H3A 0.9500 . ?
C3A C4A 1.386(4) . ?
C4A H4A 0.9500 . ?
C4A C5A 1.383(4) . ?
C5A H5A 0.9500 . ?
C5A C6A 1.393(4) . ?
C6A H6A 0.9500 . ?
C7A C8A 1.394(4) . ?
C7A C12A 1.391(4) . ?
C8A H8A 0.9500 . ?
C8A C9A 1.393(4) . ?
C9A H9A 0.9500 . ?
C9A C10A 1.382(5) . ?
C10A H10A 0.9500 . ?
C10A C11A 1.386(5) . ?
C11A H11A 0.9500 . ?
C11A C12A 1.382(4) . ?
C12A H12A 0.9500 . ?
C13A C14A 1.387(4) . ?
C13A C18A 1.401(4) . ?
C14A H14A 0.9500 . ?
C14A C15A 1.383(4) . ?
C15A H15A 0.9500 . ?
C15A C16A 1.387(5) . ?
C16A H16A 0.9500 . ?
C16A C17A 1.382(5) . ?
C17A H17A 0.9500 . ?
C17A C18A 1.382(4) . ?
C18A H18A 0.9500 . ?
C19A C20A 1.405(4) . ?
C19A C24A 1.394(4) . ?
C20A H20A 0.9500 . ?
C20A C21A 1.392(4) . ?
C21A H21A 0.9500 . ?
C21A C22A 1.392(5) . ?
C22A H22A 0.9500 . ?
C22A C23A 1.385(4) . ?
C23A H23A 0.9500 . ?
C23A C24A 1.390(4) . ?
C24A H24A 0.9500 . ?
C25A C26A 1.397(4) . ?
C25A C30A 1.386(4) . ?
C26A H26A 0.9500 . ?
C26A C27A 1.392(4) . ?
C27A H27A 0.9500 . ?
C27A C28A 1.378(5) . ?
C28A H28A 0.9500 . ?
C28A C29A 1.383(5) . ?
C29A H29A 0.9500 . ?
C29A C30A 1.392(4) . ?
C30A H30A 0.9500 . ?
C31A C32A 1.395(4) . ?
C31A C36A 1.408(4) . ?
C32A H32A 0.9500 . ?
C32A C33A 1.384(4) . ?
C33A H33A 0.9500 . ?
C33A C34A 1.385(4) . ?
C34A H34A 0.9500 . ?
C34A C35A 1.389(4) . ?
C35A H35A 0.9500 . ?
C35A C36A 1.380(4) . ?
C36A H36A 0.9500 . ?
