# Electronic Supplementary Material (ESI) for Journal of Materials Chemistry C.
# This journal is © The Royal Society of Chemistry 2021

####################################################################### 
# 
# 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_ptppyh
_database_code_depnum_ccdc_archive 'CCDC 2032296'
loop_
_audit_author_name
_audit_author_address
'Bin Zhang'
;Zhengzhou University
China
;
_audit_update_record             
;
2020-09-16 deposited with the CCDC.	2021-06-21 downloaded from the CCDC.
;
_audit_creation_date             2020-09-07
_audit_creation_method           
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_shelx_SHELXL_version_number     2014/7
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C36 H26 N3 O P Pt, 2(C H Cl3)'
_chemical_formula_sum            'C38 H28 Cl6 N3 O P Pt'
_chemical_formula_weight         981.39
_chemical_melting_point          ?
_chemical_oxdiff_usercomment     r
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 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'
Cl Cl 0.3639 0.7018 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0311 0.0180 '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'
Pt Pt -4.5932 6.9264 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_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.
;
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   12.0268(4)
_cell_length_b                   12.3029(3)
_cell_length_c                   13.5666(5)
_cell_angle_alpha                80.235(3)
_cell_angle_beta                 77.228(3)
_cell_angle_gamma                89.628(2)
_cell_volume                     1928.34(11)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    7655
_cell_measurement_temperature    291(2)
_cell_measurement_theta_max      70.7700
_cell_measurement_theta_min      3.6300
_shelx_estimated_absorpt_T_max   0.235
_shelx_estimated_absorpt_T_min   0.190
_exptl_absorpt_coefficient_mu    11.303
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.56321
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro 1.171.40.53 (Rigaku Oxford Diffraction, 2019)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.690
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       prism
_exptl_crystal_F_000             960
_exptl_crystal_size_max          0.22
_exptl_crystal_size_mid          0.2
_exptl_crystal_size_min          0.18
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0363
_diffrn_reflns_av_unetI/netI     0.0460
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.999
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       11
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_number            13895
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.999
_diffrn_reflns_theta_full        66.597
_diffrn_reflns_theta_max         66.597
_diffrn_reflns_theta_min         3.391
_diffrn_ambient_temperature      291.15
_diffrn_detector                 'CCD plate'
_diffrn_detector_area_resol_mean 16.2312
_diffrn_detector_type            Eos
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_details      
;
List of Runs (angles in degrees, time in seconds):

  # Type    Start    End  Width  tₑₓₚ   ω     θ     κ     φ   Frames
#--------------------------------------------------------------------------
  1  ω   -108.00 -32.00   1.00    1.00    --  -33.50 178.00-150.00   76
  2  ω    -59.00 -25.00   1.00    1.00    --  -33.50  77.00 120.00   34
  3  ω     10.00  36.00   1.00    1.00    --  -33.50  77.00 120.00   26
  4  ω   -107.00 -81.00   1.00    1.00    --  -33.50 178.00   0.00   26
  5  ω    -69.00 -39.00   1.00    1.00    --  -33.50 178.00   0.00   30
  6  ω    -53.00 -16.00   1.00    1.00    --  -33.50 -57.00 150.00   37
  7  ω     55.00 103.00   1.00    1.00    --   36.47  77.00  60.00   48
  8  ω      5.00  34.00   1.00    1.00    --   36.47 -99.00  30.00   29
  9  ω     13.00  39.00   1.00    1.00    --   36.47-105.00-119.00   26
 10  ω     68.00 106.00   1.00    1.00    --   36.47  37.00 120.00   38
 11  ω     44.00 105.00   1.00    1.00    --   36.47  57.00-150.00   61
 12  ω      9.00  43.00   1.00    1.00    --   36.47  77.00  60.00   34
 13  ω     16.00  41.00   1.00    1.00    --   36.47  37.00 120.00   25
 14  ω     38.00  72.00   1.00    1.00    --   36.47 -99.00  30.00   34
 15  ω     -7.00  29.00   1.00    1.00    --   36.47 -37.00 -60.00   36
 16  ω    -18.00  48.00   1.00    1.00    --   36.47 -57.00 120.00   66
 17  ω    -32.00   5.00   1.00    1.00    --   36.47 -77.00  30.00   37
 18  ω      3.00  72.00   1.00    1.00    --   36.47 -99.00 -90.00   69
 19  ω     -5.00  31.00   1.00    1.00    --   36.47 -57.00 -60.00   36
 20  ω      8.00  34.00   1.00    1.00    --   36.47 -77.00  30.00   26
 21  ω     46.00  77.00   1.00    1.00    --   36.47-105.00-119.00   31
 22  ω     49.00  85.00   1.00    2.00    --  108.00 -77.00 120.00   36
 23  ω     38.00  63.00   1.00    2.00    --  108.00-111.00-120.00   25
 24  ω     36.00 130.00   1.00    2.00    --  108.00 -15.00 -30.00   94
 25  ω     44.00 124.00   1.00    2.00    --  108.00 -45.00   0.00   80
 26  ω    143.00 169.00   1.00    2.00    --  108.00  61.00 -30.00   26
 27  ω     94.00 120.00   1.00    2.00    --  108.00  61.00 -30.00   26
 28  ω     58.00 110.00   1.00    2.00    --  108.00 -94.00  60.00   52
 29  ω     56.00 133.00   1.00    2.00    --  108.00 -30.00-180.00   77
 30  ω     87.00 135.00   1.00    2.00    --  108.00 -77.00 120.00   48
 31  ω    105.00 148.00   1.00    2.00    --  108.00 111.00 -90.00   43
 32  ω     41.00 128.00   1.00    2.00    --  108.00 -61.00 -90.00   87
 33  ω     89.00 123.00   1.00    2.00    --  108.00  45.00-120.00   34
 34  ω     86.00 112.00   1.00    2.00    --  108.00-111.00-120.00   26
 35  ω    102.00 177.00   1.00    2.00    --  108.00 111.00 -60.00   75
 36  ω     90.00 165.00   1.00    2.00    --  108.00  45.00   0.00   75
 37  ω     81.00 110.00   1.00    2.00    --  108.00 -94.00 -30.00   29
 38  ω     37.00 112.00   1.00    2.00    --  108.00-111.00 -60.00   75
;
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'Xcalibur, Eos, Gemini'
_diffrn_measurement_method       'ω scans'
_diffrn_orient_matrix_type       
'CrysAlisPro convention (1999,Acta A55,543-557)'
_diffrn_orient_matrix_UB_11      0.1280632000
_diffrn_orient_matrix_UB_12      -0.0171550000
_diffrn_orient_matrix_UB_13      -0.0395349000
_diffrn_orient_matrix_UB_21      0.0209484000
_diffrn_orient_matrix_UB_22      0.0060297000
_diffrn_orient_matrix_UB_23      0.1069676000
_diffrn_orient_matrix_UB_31      -0.0207397000
_diffrn_orient_matrix_UB_32      -0.1258187000
_diffrn_orient_matrix_UB_33      0.0311122000
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54184
_diffrn_source                   'fine-focus sealed X-ray tube'
_diffrn_source_type              'Enhance (Cu) X-ray Source'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                6208
_reflns_number_total             6817
_reflns_odcompleteness_completeness 99.91
_reflns_odcompleteness_iscentric 1
_reflns_odcompleteness_theta     66.97
_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.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'CrysAlisPro 1.171.40.53 (Rigaku OD, 2019)'
_computing_data_collection       'CrysAlisPro 1.171.40.53 (Rigaku OD, 2019)'
_computing_data_reduction        'CrysAlisPro 1.171.40.53 (Rigaku OD, 2019)'
_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)'
_refine_diff_density_max         1.299
_refine_diff_density_min         -0.943
_refine_diff_density_rms         0.109
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.021
_refine_ls_hydrogen_treatment    noref
_refine_ls_matrix_type           full
_refine_ls_number_parameters     451
_refine_ls_number_reflns         6817
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0389
_refine_ls_R_factor_gt           0.0346
_refine_ls_restrained_S_all      1.021
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0543P)²+1.2797P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0888
_refine_ls_wR_factor_ref         0.0918
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups
2.a Ternary CH refined with riding coordinates:
 C36(H36), C37(H37)
2.b Aromatic/amide H refined with riding coordinates:
 C2(H2), C3(H3), C4(H4), C5(H5), C8(H8), C9(H9), C10(H10), C11(H11), C13(H13),
 C14(H14), C15(H15), C16(H16), C20(H20), C21(H21), C22(H22), C23(H23), C25(H25),
  C26(H26), C27(H27), C28(H28), C29(H29), C31(H31), C32(H32), C33(H33),
 C34(H34), C35(H35)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     dual
_atom_sites_solution_secondary   ?
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 0.46647(2) 0.20571(2) 0.57445(2) 0.02947(8) Uani 1 1 d . . . . .
P1 P 0.21002(10) 0.29683(10) 0.61842(9) 0.0320(2) Uani 1 1 d . . . . .
O1 O 0.3143(3) 0.2744(3) 0.5384(3) 0.0398(8) Uani 1 1 d . . . . .
N1 N 0.5089(3) 0.1545(3) 0.4380(3) 0.0322(8) Uani 1 1 d . . . . .
N2 N 0.4313(3) 0.2638(3) 0.7091(3) 0.0319(8) Uani 1 1 d . . . . .
N3 N 0.3441(4) 0.2943(4) 0.8673(3) 0.0406(9) Uani 1 1 d . . . . .
C00Q C 0.4387(4) 0.3652(4) 0.8298(4) 0.0399(11) Uani 1 1 d . . . . .
C1 C 0.6093(4) 0.1353(4) 0.5918(4) 0.0320(9) Uani 1 1 d . . . . .
C2 C 0.6603(5) 0.1233(5) 0.6754(4) 0.0462(12) Uani 1 1 d . . . . .
H2 H 0.6265 0.1535 0.7328 0.055 Uiso 1 1 calc R . . . .
C3 C 0.7609(5) 0.0669(5) 0.6746(5) 0.0567(15) Uani 1 1 d . . . . .
H3 H 0.7931 0.0596 0.7316 0.068 Uiso 1 1 calc R . . . .
C4 C 0.8132(6) 0.0221(5) 0.5918(6) 0.0629(17) Uani 1 1 d . . . . .
H4 H 0.8802 -0.0158 0.5929 0.075 Uiso 1 1 calc R . . . .
C5 C 0.7671(5) 0.0329(5) 0.5065(5) 0.0527(14) Uani 1 1 d . . . . .
H5 H 0.8035 0.0033 0.4496 0.063 Uiso 1 1 calc R . . . .
C6 C 0.6654(4) 0.0884(4) 0.5055(4) 0.0375(10) Uani 1 1 d . . . . .
C7 C 0.6092(4) 0.1018(4) 0.4200(4) 0.0340(10) Uani 1 1 d . . . . .
C8 C 0.6466(5) 0.0662(4) 0.3264(4) 0.0482(13) Uani 1 1 d . . . . .
H8 H 0.7144 0.0290 0.3138 0.058 Uiso 1 1 calc R . . . .
C9 C 0.5837(6) 0.0859(5) 0.2529(4) 0.0535(15) Uani 1 1 d . . . . .
H9 H 0.6086 0.0627 0.1901 0.064 Uiso 1 1 calc R . . . .
C10 C 0.4829(5) 0.1407(5) 0.2730(4) 0.0512(14) Uani 1 1 d . . . . .
H10 H 0.4395 0.1551 0.2237 0.061 Uiso 1 1 calc R . . . .
C11 C 0.4473(5) 0.1737(4) 0.3656(4) 0.0416(11) Uani 1 1 d . . . . .
H11 H 0.3790 0.2101 0.3789 0.050 Uiso 1 1 calc R . . . .
C12 C 0.1756(4) 0.1837(4) 0.7259(4) 0.0355(10) Uani 1 1 d . . . . .
C13 C 0.0807(5) 0.1142(4) 0.7362(5) 0.0477(13) Uani 1 1 d . . . . .
H13 H 0.0354 0.1265 0.6883 0.057 Uiso 1 1 calc R . . . .
C14 C 0.0542(5) 0.0274(5) 0.8177(5) 0.0597(16) Uani 1 1 d . . . . .
H14 H -0.0085 -0.0193 0.8241 0.072 Uiso 1 1 calc R . . . .
C15 C 0.1207(5) 0.0100(5) 0.8893(5) 0.0566(16) Uani 1 1 d . . . . .
H15 H 0.1029 -0.0488 0.9436 0.068 Uiso 1 1 calc R . . . .
C16 C 0.2138(5) 0.0793(4) 0.8810(4) 0.0456(12) Uani 1 1 d . . . . .
H16 H 0.2561 0.0687 0.9313 0.055 Uiso 1 1 calc R . . . .
C17 C 0.2444(4) 0.1652(4) 0.7974(4) 0.0349(10) Uani 1 1 d . . . . .
C18 C 0.3421(4) 0.2391(4) 0.7921(4) 0.0337(10) Uani 1 1 d . . . . .
C19 C 0.4944(4) 0.3452(4) 0.7320(4) 0.0354(10) Uani 1 1 d . . . . .
C20 C 0.5893(5) 0.4061(5) 0.6759(4) 0.0463(12) Uani 1 1 d . . . . .
H20 H 0.6265 0.3920 0.6118 0.056 Uiso 1 1 calc R . . . .
C21 C 0.6277(5) 0.4895(5) 0.7182(5) 0.0567(15) Uani 1 1 d . . . . .
H21 H 0.6919 0.5322 0.6819 0.068 Uiso 1 1 calc R . . . .
C22 C 0.5713(6) 0.5105(5) 0.8149(6) 0.0624(17) Uani 1 1 d . . . . .
H22 H 0.5984 0.5677 0.8411 0.075 Uiso 1 1 calc R . . . .
C23 C 0.4781(5) 0.4493(5) 0.8712(5) 0.0528(14) Uani 1 1 d . . . . .
H23 H 0.4416 0.4632 0.9356 0.063 Uiso 1 1 calc R . . . .
C24 C 0.0895(4) 0.3117(4) 0.5596(4) 0.0409(11) Uani 1 1 d . . . . .
C25 C 0.0954(6) 0.2721(7) 0.4700(6) 0.0683(19) Uani 1 1 d . . . . .
H25 H 0.1619 0.2404 0.4397 0.082 Uiso 1 1 calc R . . . .
C26 C 0.0030(8) 0.2793(8) 0.4247(7) 0.096(3) Uani 1 1 d . . . . .
H26 H 0.0071 0.2527 0.3638 0.115 Uiso 1 1 calc R . . . .
C27 C -0.0949(7) 0.3259(7) 0.4699(7) 0.080(2) Uani 1 1 d . . . . .
H27 H -0.1580 0.3291 0.4405 0.096 Uiso 1 1 calc R . . . .
C28 C -0.1003(6) 0.3669(7) 0.5564(7) 0.084(2) Uani 1 1 d . . . . .
H28 H -0.1667 0.3993 0.5857 0.101 Uiso 1 1 calc R . . . .
C29 C -0.0089(5) 0.3616(6) 0.6022(6) 0.0697(19) Uani 1 1 d . . . . .
H29 H -0.0130 0.3913 0.6614 0.084 Uiso 1 1 calc R . . . .
C30 C 0.2309(4) 0.4207(4) 0.6679(4) 0.0359(10) Uani 1 1 d . . . . .
C31 C 0.3218(5) 0.4909(4) 0.6132(5) 0.0496(14) Uani 1 1 d . . . . .
H31 H 0.3689 0.4730 0.5543 0.060 Uiso 1 1 calc R . . . .
C32 C 0.3417(7) 0.5858(5) 0.6457(6) 0.069(2) Uani 1 1 d . . . . .
H32 H 0.4027 0.6325 0.6087 0.083 Uiso 1 1 calc R . . . .
C33 C 0.2756(8) 0.6129(5) 0.7294(7) 0.078(3) Uani 1 1 d . . . . .
H33 H 0.2902 0.6789 0.7497 0.094 Uiso 1 1 calc R . . . .
C34 C 0.1837(8) 0.5434(6) 0.7879(6) 0.076(2) Uani 1 1 d . . . . .
H34 H 0.1382 0.5624 0.8470 0.091 Uiso 1 1 calc R . . . .
C35 C 0.1622(6) 0.4464(5) 0.7560(5) 0.0555(15) Uani 1 1 d . . . . .
H35 H 0.1020 0.3989 0.7935 0.067 Uiso 1 1 calc R . . . .
Cl1 Cl 0.02601(18) 0.27092(19) 1.0419(2) 0.0944(7) Uani 1 1 d . . . . .
Cl2 Cl 0.1940(3) 0.2034(3) 1.1582(2) 0.1268(10) Uani 1 1 d . . . . .
Cl3 Cl 0.1550(2) 0.4346(2) 1.0991(3) 0.1251(10) Uani 1 1 d . . . . .
C36 C 0.1581(6) 0.3030(6) 1.0637(6) 0.0711(19) Uani 1 1 d . . . . .
H36 H 0.2159 0.3050 0.9999 0.085 Uiso 1 1 calc R . . . .
Cl4 Cl 0.3314(3) 0.6909(2) 0.96393(18) 0.1245(11) Uani 1 1 d . . . . .
Cl5 Cl 0.3982(3) 0.8762(2) 1.0411(2) 0.1260(11) Uani 1 1 d . . . . .
Cl6 Cl 0.1799(3) 0.7721(3) 1.1263(3) 0.1403(12) Uani 1 1 d . . . . .
C37 C 0.3208(8) 0.7516(6) 1.0719(6) 0.077(2) Uani 1 1 d . . . . .
H37 H 0.3528 0.7019 1.1223 0.092 Uiso 1 1 calc R . . . .


_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
Pt1 O1 2.130(3) . ?
Pt1 N1 2.015(4) . ?
Pt1 N2 2.031(4) . ?
Pt1 C1 1.962(4) . ?
P1 O1 1.525(3) . ?
P1 C12 1.813(5) . ?
P1 C24 1.797(5) . ?
P1 C30 1.806(5) . ?
N1 C7 1.359(6) . ?
N1 C11 1.346(7) . ?
N2 C18 1.366(6) . ?
N2 C19 1.376(6) . ?
N3 C00Q 1.385(7) . ?
N3 C18 1.322(6) . ?
C00Q C19 1.409(7) . ?
C00Q C23 1.390(8) . ?
C1 C2 1.391(7) . ?
C1 C6 1.426(7) . ?
C2 H2 0.9300 . ?
C2 C3 1.390(8) . ?
C3 H3 0.9300 . ?
C3 C4 1.361(9) . ?
C4 H4 0.9300 . ?
C4 C5 1.377(9) . ?
C5 H5 0.9300 . ?
C5 C6 1.398(7) . ?
C6 C7 1.453(7) . ?
C7 C8 1.393(7) . ?
C8 H8 0.9300 . ?
C8 C9 1.369(8) . ?
C9 H9 0.9300 . ?
C9 C10 1.380(8) . ?
C10 H10 0.9300 . ?
C10 C11 1.362(7) . ?
C11 H11 0.9300 . ?
C12 C13 1.398(7) . ?
C12 C17 1.398(7) . ?
C13 H13 0.9300 . ?
C13 C14 1.383(8) . ?
C14 H14 0.9300 . ?
C14 C15 1.378(10) . ?
C15 H15 0.9300 . ?
C15 C16 1.385(8) . ?
C16 H16 0.9300 . ?
C16 C17 1.397(7) . ?
C17 C18 1.472(7) . ?
C19 C20 1.369(7) . ?
C20 H20 0.9300 . ?
C20 C21 1.385(8) . ?
C21 H21 0.9300 . ?
C21 C22 1.403(9) . ?
C22 H22 0.9300 . ?
C22 C23 1.359(9) . ?
C23 H23 0.9300 . ?
C24 C25 1.372(9) . ?
C24 C29 1.385(8) . ?
C25 H25 0.9300 . ?
C25 C26 1.379(10) . ?
C26 H26 0.9300 . ?
C26 C27 1.372(12) . ?
C27 H27 0.9300 . ?
C27 C28 1.343(12) . ?
C28 H28 0.9300 . ?
C28 C29 1.372(10) . ?
C29 H29 0.9300 . ?
C30 C31 1.389(7) . ?
C30 C35 1.378(8) . ?
C31 H31 0.9300 . ?
C31 C32 1.356(9) . ?
C32 H32 0.9300 . ?
C32 C33 1.327(12) . ?
C33 H33 0.9300 . ?
C33 C34 1.406(12) . ?
C34 H34 0.9300 . ?
C34 C35 1.382(9) . ?
C35 H35 0.9300 . ?
Cl1 C36 1.739(7) . ?
Cl2 C36 1.743(8) . ?
Cl3 C36 1.763(8) . ?
C36 H36 0.9800 . ?
Cl4 C37 1.734(8) . ?
Cl5 C37 1.738(8) . ?
Cl6 C37 1.727(9) . ?
C37 H37 0.9800 . ?

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
N1 Pt1 O1 90.93(15) . . ?
N1 Pt1 N2 176.71(14) . . ?
N2 Pt1 O1 90.25(14) . . ?
C1 Pt1 O1 172.94(16) . . ?
C1 Pt1 N1 82.04(19) . . ?
C1 Pt1 N2 96.80(18) . . ?
O1 P1 C12 112.0(2) . . ?
O1 P1 C24 108.5(2) . . ?
O1 P1 C30 111.5(2) . . ?
C24 P1 C12 107.2(2) . . ?
C24 P1 C30 109.4(2) . . ?
C30 P1 C12 108.1(2) . . ?
P1 O1 Pt1 124.0(2) . . ?
C7 N1 Pt1 115.5(3) . . ?
C11 N1 Pt1 124.1(3) . . ?
C11 N1 C7 120.4(4) . . ?
C18 N2 Pt1 130.3(3) . . ?
C18 N2 C19 105.0(4) . . ?
C19 N2 Pt1 124.6(3) . . ?
C18 N3 C00Q 104.3(4) . . ?
N3 C00Q C19 109.2(4) . . ?
N3 C00Q C23 130.3(5) . . ?
C23 C00Q C19 120.4(5) . . ?
C2 C1 Pt1 129.5(4) . . ?
C2 C1 C6 117.1(4) . . ?
C6 C1 Pt1 113.4(4) . . ?
C1 C2 H2 119.5 . . ?
C3 C2 C1 121.0(5) . . ?
C3 C2 H2 119.5 . . ?
C2 C3 H3 119.4 . . ?
C4 C3 C2 121.2(6) . . ?
C4 C3 H3 119.4 . . ?
C3 C4 H4 120.0 . . ?
C3 C4 C5 120.1(6) . . ?
C5 C4 H4 120.0 . . ?
C4 C5 H5 120.0 . . ?
C4 C5 C6 120.0(6) . . ?
C6 C5 H5 120.0 . . ?
C1 C6 C7 115.6(4) . . ?
C5 C6 C1 120.6(5) . . ?
C5 C6 C7 123.8(5) . . ?
N1 C7 C6 113.5(4) . . ?
N1 C7 C8 119.2(5) . . ?
C8 C7 C6 127.3(5) . . ?
C7 C8 H8 119.9 . . ?
C9 C8 C7 120.2(5) . . ?
C9 C8 H8 119.9 . . ?
C8 C9 H9 120.4 . . ?
C8 C9 C10 119.2(5) . . ?
C10 C9 H9 120.4 . . ?
C9 C10 H10 120.2 . . ?
C11 C10 C9 119.7(5) . . ?
C11 C10 H10 120.2 . . ?
N1 C11 C10 121.3(5) . . ?
N1 C11 H11 119.3 . . ?
C10 C11 H11 119.3 . . ?
C13 C12 P1 119.6(4) . . ?
C13 C12 C17 120.2(5) . . ?
C17 C12 P1 120.2(4) . . ?
C12 C13 H13 120.0 . . ?
C14 C13 C12 120.0(6) . . ?
C14 C13 H13 120.0 . . ?
C13 C14 H14 120.0 . . ?
C15 C14 C13 120.0(5) . . ?
C15 C14 H14 120.0 . . ?
C14 C15 H15 119.7 . . ?
C14 C15 C16 120.6(5) . . ?
C16 C15 H15 119.7 . . ?
C15 C16 H16 119.8 . . ?
C15 C16 C17 120.3(6) . . ?
C17 C16 H16 119.8 . . ?
C12 C17 C18 122.0(4) . . ?
C16 C17 C12 118.8(5) . . ?
C16 C17 C18 119.0(5) . . ?
N2 C18 C17 124.5(4) . . ?
N3 C18 N2 114.6(4) . . ?
N3 C18 C17 120.7(4) . . ?
N2 C19 C00Q 106.8(4) . . ?
C20 C19 N2 131.7(5) . . ?
C20 C19 C00Q 121.4(5) . . ?
C19 C20 H20 121.2 . . ?
C19 C20 C21 117.6(5) . . ?
C21 C20 H20 121.2 . . ?
C20 C21 H21 119.5 . . ?
C20 C21 C22 121.0(5) . . ?
C22 C21 H21 119.5 . . ?
C21 C22 H22 119.3 . . ?
C23 C22 C21 121.5(6) . . ?
C23 C22 H22 119.3 . . ?
C00Q C23 H23 121.0 . . ?
C22 C23 C00Q 118.1(6) . . ?
C22 C23 H23 121.0 . . ?
C25 C24 P1 118.8(4) . . ?
C25 C24 C29 119.2(6) . . ?
C29 C24 P1 122.0(5) . . ?
C24 C25 H25 119.9 . . ?
C24 C25 C26 120.1(7) . . ?
C26 C25 H25 119.9 . . ?
C25 C26 H26 120.2 . . ?
C27 C26 C25 119.7(8) . . ?
C27 C26 H26 120.2 . . ?
C26 C27 H27 119.8 . . ?
C28 C27 C26 120.4(7) . . ?
C28 C27 H27 119.8 . . ?
C27 C28 H28 119.6 . . ?
C27 C28 C29 120.9(7) . . ?
C29 C28 H28 119.6 . . ?
C24 C29 H29 120.2 . . ?
C28 C29 C24 119.7(7) . . ?
C28 C29 H29 120.2 . . ?
C31 C30 P1 116.8(4) . . ?
C35 C30 P1 123.0(4) . . ?
C35 C30 C31 120.2(5) . . ?
C30 C31 H31 120.1 . . ?
C32 C31 C30 119.8(6) . . ?
C32 C31 H31 120.1 . . ?
C31 C32 H32 119.5 . . ?
C33 C32 C31 121.0(7) . . ?
C33 C32 H32 119.5 . . ?
C32 C33 H33 119.5 . . ?
C32 C33 C34 121.0(6) . . ?
C34 C33 H33 119.5 . . ?
C33 C34 H34 120.6 . . ?
C35 C34 C33 118.8(7) . . ?
C35 C34 H34 120.6 . . ?
C30 C35 C34 119.2(6) . . ?
C30 C35 H35 120.4 . . ?
C34 C35 H35 120.4 . . ?
Cl1 C36 Cl2 110.7(4) . . ?
Cl1 C36 Cl3 109.4(4) . . ?
Cl1 C36 H36 108.6 . . ?
Cl2 C36 Cl3 110.9(4) . . ?
Cl2 C36 H36 108.6 . . ?
Cl3 C36 H36 108.6 . . ?
Cl4 C37 Cl5 110.6(4) . . ?
Cl4 C37 H37 108.4 . . ?
Cl5 C37 H37 108.4 . . ?
Cl6 C37 Cl4 110.8(5) . . ?
Cl6 C37 Cl5 110.1(4) . . ?
Cl6 C37 H37 108.4 . . ?

_olex2_submission_special_instructions 'No special instructions were received'
_oxdiff_exptl_absorpt_empirical_details 
;
Empirical correction (ABSPACK) includes:
- Absorption correction using spherical harmonics
- Frame scaling
;
_oxdiff_exptl_absorpt_empirical_full_max 1.609
_oxdiff_exptl_absorpt_empirical_full_min 0.758
####################################################################### 
# 
# 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_gqpt203
_database_code_depnum_ccdc_archive 'CCDC 2032298'
loop_
_audit_author_name
_audit_author_address
'Bin Zhang'
;Zhengzhou University
China
;
_audit_update_record             
;
2020-09-16 deposited with the CCDC.	2021-06-21 downloaded from the CCDC.
;
_audit_creation_date             2020-09-07
_audit_creation_method           
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_shelx_SHELXL_version_number     2014/7
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C37 H25 F3 N3 O P Pt, C H Cl3'
_chemical_formula_sum            'C38 H26 Cl3 F3 N3 O P Pt'
_chemical_formula_weight         930.03
_chemical_melting_point          ?
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'
N N 0.0061 0.0033 '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'
Pt Pt -1.7033 8.3905 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_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.
;
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   12.1541(10)
_cell_length_b                   13.0636(9)
_cell_length_c                   13.5513(11)
_cell_angle_alpha                88.629(7)
_cell_angle_beta                 63.523(8)
_cell_angle_gamma                72.753(7)
_cell_volume                     1824.5(3)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    5540
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      27.1390
_cell_measurement_theta_min      1.6980
_shelx_estimated_absorpt_T_max   0.681
_shelx_estimated_absorpt_T_min   0.556
_exptl_absorpt_coefficient_mu    4.159
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.47497
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro 1.171.40.53 (Rigaku Oxford Diffraction, 2019)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.693
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       prism
_exptl_crystal_F_000             908
_exptl_crystal_size_max          0.16
_exptl_crystal_size_mid          0.12
_exptl_crystal_size_min          0.1
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0578
_diffrn_reflns_av_unetI/netI     0.0725
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 0.828
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_number            16816
_diffrn_reflns_point_group_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 0.828
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         29.471
_diffrn_reflns_theta_min         1.645
_diffrn_ambient_temperature      293(2)
_diffrn_detector                 'CCD plate'
_diffrn_detector_area_resol_mean 16.2312
_diffrn_detector_type            Eos
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 0.828
_diffrn_measurement_details      
;
List of Runs (angles in degrees, time in seconds):

  # Type    Start    End  Width  tₑₓₚ   ω     θ     κ     φ   Frames
#--------------------------------------------------------------------------
  1  ω    -25.00  21.00   1.00    4.25    --  -15.33 -99.00 -30.00   46
  2  ω    -20.00  22.00   1.00    4.25    --  -15.33 -99.00 120.00   42
  3  ω     -1.00  86.00   1.00    4.25    --   18.07  37.00   0.00   87
  4  ω    -45.00 -20.00   1.00    4.25    --   18.07 -57.00-180.00   25
  5  ω    -18.00  46.00   1.00    4.25    --   18.07 -99.00  90.00   64
  6  ω     41.00  78.00   1.00    4.25    --   18.07 178.00-150.00   37
  7  ω     40.00  66.00   1.00    4.25    --   18.07  57.00  30.00   26
  8  ω    -49.00  35.00   1.00    4.25    --   18.07 -57.00-150.00   84
;
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'Xcalibur, Eos, Gemini'
_diffrn_measurement_method       'ω scans'
_diffrn_orient_matrix_type       
'CrysAlisPro convention (1999,Acta A55,543-557)'
_diffrn_orient_matrix_UB_11      -0.0504110000
_diffrn_orient_matrix_UB_12      0.0498539000
_diffrn_orient_matrix_UB_13      0.0249667000
_diffrn_orient_matrix_UB_21      0.0387204000
_diffrn_orient_matrix_UB_22      0.0272489000
_diffrn_orient_matrix_UB_23      -0.0398243000
_diffrn_orient_matrix_UB_31      -0.0263283000
_diffrn_orient_matrix_UB_32      -0.0075433000
_diffrn_orient_matrix_UB_33      -0.0355783000
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   'fine-focus sealed X-ray tube'
_diffrn_source_type              'Enhance (Mo) X-ray Source'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                7018
_reflns_number_total             8393
_reflns_odcompleteness_completeness 99.99
_reflns_odcompleteness_iscentric 1
_reflns_odcompleteness_theta     26.32
_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.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'CrysAlisPro 1.171.40.53 (Rigaku OD, 2019)'
_computing_data_collection       'CrysAlisPro 1.171.40.53 (Rigaku OD, 2019)'
_computing_data_reduction        'CrysAlisPro 1.171.40.53 (Rigaku OD, 2019)'
_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    'ShelXS (Sheldrick, 2008)'
_refine_diff_density_max         2.255
_refine_diff_density_min         -1.284
_refine_diff_density_rms         0.216
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.056
_refine_ls_hydrogen_treatment    noref
_refine_ls_matrix_type           full
_refine_ls_number_parameters     451
_refine_ls_number_reflns         8393
_refine_ls_number_restraints     42
_refine_ls_R_factor_all          0.0638
_refine_ls_R_factor_gt           0.0460
_refine_ls_restrained_S_all      1.112
_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)+(0.0597P)²+0.6458P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1081
_refine_ls_wR_factor_ref         0.1194
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups
2. Uiso/Uaniso restraints and constraints
Uanis(F2) \\sim Ueq, Uanis(F3) \\sim Ueq, Uanis(C38) \\sim Ueq, Uanis(F1) \\sim
Ueq: with sigma of 0.01 and sigma for terminal atoms of 0.01
Uanis(Cl1) \\sim Ueq, Uanis(Cl3) \\sim Ueq, Uanis(Cl2) \\sim Ueq: with sigma of
0.01 and sigma for terminal atoms of 0.01
3.a Ternary CH refined with riding coordinates:
 C38(H38)
3.b Aromatic/amide H refined with riding coordinates:
 C2(H2), C3(H3), C4(H4), C5(H5), C8(H8), C9(H9), C10(H10), C11(H11), C13(H13),
 C14(H14), C15(H15), C16(H16), C20(H20), C21(H21), C23(H23), C27(H27), C28(H28),
  C29(H29), C30(H30), C31(H31), C33(H33), C34(H34), C35(H35), C36(H36), C37(H37)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     heavy
_atom_sites_solution_secondary   ?
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 0.57703(2) 0.50523(2) 0.68572(2) 0.03316(9) Uani 1 1 d . . . . .
P1 P 0.70613(16) 0.27244(12) 0.74594(13) 0.0385(3) Uani 1 1 d . . . . .
F1 F 0.8801(8) 0.7798(6) 0.9701(5) 0.128(2) Uani 1 1 d . U . . .
F2 F 0.7003(9) 0.7893(9) 1.0890(7) 0.202(4) Uani 1 1 d . U . . .
F3 F 0.8465(10) 0.6628(7) 1.0620(6) 0.157(3) Uani 1 1 d . U . . .
O1 O 0.5834(4) 0.3553(3) 0.7559(4) 0.0433(10) Uani 1 1 d . . . . .
N1 N 0.4200(4) 0.5104(4) 0.6679(4) 0.0333(10) Uani 1 1 d . . . . .
N2 N 0.7308(5) 0.5067(4) 0.7072(4) 0.0358(10) Uani 1 1 d . . . . .
N3 N 0.9331(5) 0.4583(4) 0.6947(4) 0.0458(12) Uani 1 1 d . . . . .
C1 C 0.5584(6) 0.6387(5) 0.6162(4) 0.0356(12) Uani 1 1 d . . . . .
C2 C 0.6367(7) 0.7056(6) 0.5880(6) 0.0494(16) Uani 1 1 d . . . . .
H2 H 0.7047 0.6903 0.6062 0.059 Uiso 1 1 calc R . . . .
C3 C 0.6141(8) 0.7937(6) 0.5336(6) 0.0611(19) Uani 1 1 d . . . . .
H3 H 0.6671 0.8371 0.5158 0.073 Uiso 1 1 calc R . . . .
C4 C 0.5141(8) 0.8190(6) 0.5049(6) 0.065(2) Uani 1 1 d . . . . .
H4 H 0.4999 0.8788 0.4682 0.077 Uiso 1 1 calc R . . . .
C5 C 0.4349(7) 0.7540(6) 0.5316(6) 0.0530(17) Uani 1 1 d . . . . .
H5 H 0.3678 0.7697 0.5122 0.064 Uiso 1 1 calc R . . . .
C6 C 0.4567(6) 0.6653(5) 0.5874(5) 0.0381(13) Uani 1 1 d . . . . .
C7 C 0.3781(5) 0.5936(5) 0.6183(4) 0.0363(13) Uani 1 1 d . . . . .
C8 C 0.2718(6) 0.6008(6) 0.6019(5) 0.0488(16) Uani 1 1 d . . . . .
H8 H 0.2431 0.6575 0.5673 0.059 Uiso 1 1 calc R . . . .
C9 C 0.2072(7) 0.5258(6) 0.6357(6) 0.0544(18) Uani 1 1 d . . . . .
H9 H 0.1365 0.5306 0.6235 0.065 Uiso 1 1 calc R . . . .
C10 C 0.2503(6) 0.4438(6) 0.6880(5) 0.0494(16) Uani 1 1 d . . . . .
H10 H 0.2079 0.3927 0.7131 0.059 Uiso 1 1 calc R . . . .
C11 C 0.3558(6) 0.4381(5) 0.7026(5) 0.0425(14) Uani 1 1 d . . . . .
H11 H 0.3844 0.3822 0.7379 0.051 Uiso 1 1 calc R . . . .
C12 C 0.8431(6) 0.2579(5) 0.6104(5) 0.0411(13) Uani 1 1 d . . . . .
C13 C 0.8943(7) 0.1637(6) 0.5342(6) 0.0563(18) Uani 1 1 d . . . . .
H13 H 0.8573 0.1087 0.5538 0.068 Uiso 1 1 calc R . . . .
C14 C 0.9971(8) 0.1530(6) 0.4326(6) 0.0603(19) Uani 1 1 d . . . . .
H14 H 1.0293 0.0914 0.3824 0.072 Uiso 1 1 calc R . . . .
C15 C 1.0540(7) 0.2342(6) 0.4039(6) 0.062(2) Uani 1 1 d . . . . .
H15 H 1.1252 0.2259 0.3347 0.074 Uiso 1 1 calc R . . . .
C16 C 1.0067(6) 0.3265(6) 0.4759(5) 0.0512(16) Uani 1 1 d . . . . .
H16 H 1.0465 0.3798 0.4550 0.061 Uiso 1 1 calc R . . . .
C17 C 0.8995(6) 0.3415(5) 0.5803(5) 0.0401(13) Uani 1 1 d . . . . .
C18 C 0.8558(6) 0.4372(5) 0.6588(5) 0.0387(13) Uani 1 1 d . . . . .
C19 C 0.7275(6) 0.5769(5) 0.7830(5) 0.0380(13) Uani 1 1 d . . . . .
C20 C 0.6250(6) 0.6607(5) 0.8622(5) 0.0450(14) Uani 1 1 d . . . . .
H20 H 0.5429 0.6818 0.8661 0.054 Uiso 1 1 calc R . . . .
C21 C 0.6508(7) 0.7107(6) 0.9345(5) 0.0481(15) Uani 1 1 d . . . . .
H21 H 0.5855 0.7673 0.9878 0.058 Uiso 1 1 calc R . . . .
C22 C 0.7747(7) 0.6767(6) 0.9280(5) 0.0517(17) Uani 1 1 d . . . . .
C23 C 0.8748(6) 0.5969(6) 0.8508(5) 0.0519(16) Uani 1 1 d . . . . .
H23 H 0.9565 0.5770 0.8478 0.062 Uiso 1 1 calc R . . . .
C24 C 0.8527(6) 0.5452(5) 0.7758(5) 0.0419(14) Uani 1 1 d . . . . .
C25 C 0.7972(9) 0.7316(8) 1.0087(6) 0.070(2) Uani 1 1 d . . . . .
C26 C 0.7509(6) 0.3033(5) 0.8488(5) 0.0426(14) Uani 1 1 d . . . . .
C27 C 0.6613(7) 0.3782(6) 0.9388(5) 0.0520(17) Uani 1 1 d . . . . .
H27 H 0.5792 0.4128 0.9452 0.062 Uiso 1 1 calc R . . . .
C28 C 0.6916(8) 0.4031(7) 1.0205(6) 0.064(2) Uani 1 1 d . . . . .
H28 H 0.6301 0.4531 1.0823 0.076 Uiso 1 1 calc R . . . .
C29 C 0.8136(10) 0.3528(8) 1.0088(7) 0.083(3) Uani 1 1 d . . . . .
H29 H 0.8356 0.3699 1.0624 0.099 Uiso 1 1 calc R . . . .
C30 C 0.9030(9) 0.2782(9) 0.9196(8) 0.092(3) Uani 1 1 d . . . . .
H30 H 0.9847 0.2438 0.9141 0.110 Uiso 1 1 calc R . . . .
C31 C 0.8752(7) 0.2529(7) 0.8384(6) 0.067(2) Uani 1 1 d . . . . .
H31 H 0.9377 0.2029 0.7770 0.080 Uiso 1 1 calc R . . . .
C32 C 0.6766(7) 0.1448(5) 0.7655(5) 0.0449(15) Uani 1 1 d . . . . .
C33 C 0.7210(9) 0.0718(6) 0.8239(7) 0.068(2) Uani 1 1 d . . . . .
H33 H 0.7734 0.0852 0.8519 0.081 Uiso 1 1 calc R . . . .
C34 C 0.6873(11) -0.0241(7) 0.8417(8) 0.086(3) Uani 1 1 d . . . . .
H34 H 0.7164 -0.0727 0.8829 0.104 Uiso 1 1 calc R . . . .
C35 C 0.6127(11) -0.0466(8) 0.7993(9) 0.093(3) Uani 1 1 d . . . . .
H35 H 0.5907 -0.1099 0.8104 0.112 Uiso 1 1 calc R . . . .
C36 C 0.5713(9) 0.0278(7) 0.7396(9) 0.076(2) Uani 1 1 d . . . . .
H36 H 0.5216 0.0135 0.7090 0.091 Uiso 1 1 calc R . . . .
C37 C 0.6004(8) 0.1222(6) 0.7235(7) 0.0612(19) Uani 1 1 d . . . . .
H37 H 0.5688 0.1713 0.6840 0.073 Uiso 1 1 calc R . . . .
Cl1 Cl 0.7691(6) 0.9535(5) 1.2690(5) 0.227(3) Uani 1 1 d . U . . .
Cl2 Cl 0.9087(7) 1.1069(6) 1.1881(6) 0.240(3) Uani 1 1 d . U . . .
Cl3 Cl 0.7306(9) 1.0803(7) 1.1146(7) 0.277(4) Uani 1 1 d . U . . .
C38 C 0.776(2) 1.0693(18) 1.2134(17) 0.191(7) Uani 1 1 d . U . . .
H38 H 0.7048 1.1245 1.2734 0.229 Uiso 1 1 calc R . . . .


_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
Pt1 O1 2.152(4) . ?
Pt1 N1 2.010(5) . ?
Pt1 N2 2.021(5) . ?
Pt1 C1 1.964(6) . ?
P1 O1 1.512(4) . ?
P1 C12 1.812(6) . ?
P1 C26 1.798(6) . ?
P1 C32 1.796(7) . ?
F1 C25 1.255(10) . ?
F2 C25 1.229(11) . ?
F3 C25 1.313(11) . ?
N1 C7 1.355(7) . ?
N1 C11 1.345(8) . ?
N2 C18 1.372(7) . ?
N2 C19 1.374(7) . ?
N3 C18 1.328(7) . ?
N3 C24 1.376(8) . ?
C1 C2 1.403(9) . ?
C1 C6 1.403(8) . ?
C2 H2 0.9300 . ?
C2 C3 1.377(9) . ?
C3 H3 0.9300 . ?
C3 C4 1.384(11) . ?
C4 H4 0.9300 . ?
C4 C5 1.392(11) . ?
C5 H5 0.9300 . ?
C5 C6 1.393(9) . ?
C6 C7 1.457(9) . ?
C7 C8 1.382(8) . ?
C8 H8 0.9300 . ?
C8 C9 1.378(10) . ?
C9 H9 0.9300 . ?
C9 C10 1.372(10) . ?
C10 H10 0.9300 . ?
C10 C11 1.363(8) . ?
C11 H11 0.9300 . ?
C12 C13 1.415(9) . ?
C12 C17 1.415(9) . ?
C13 H13 0.9300 . ?
C13 C14 1.359(10) . ?
C14 H14 0.9300 . ?
C14 C15 1.390(11) . ?
C15 H15 0.9300 . ?
C15 C16 1.372(10) . ?
C16 H16 0.9300 . ?
C16 C17 1.398(9) . ?
C17 C18 1.464(8) . ?
C19 C20 1.399(8) . ?
C19 C24 1.411(8) . ?
C20 H20 0.9300 . ?
C20 C21 1.383(9) . ?
C21 H21 0.9300 . ?
C21 C22 1.400(10) . ?
C22 C23 1.351(10) . ?
C22 C25 1.485(10) . ?
C23 H23 0.9300 . ?
C23 C24 1.396(8) . ?
C26 C27 1.368(9) . ?
C26 C31 1.401(9) . ?
C27 H27 0.9300 . ?
C27 C28 1.386(9) . ?
C28 H28 0.9300 . ?
C28 C29 1.368(12) . ?
C29 H29 0.9300 . ?
C29 C30 1.360(12) . ?
C30 H30 0.9300 . ?
C30 C31 1.360(11) . ?
C31 H31 0.9300 . ?
C32 C33 1.367(9) . ?
C32 C37 1.382(10) . ?
C33 H33 0.9300 . ?
C33 C34 1.414(13) . ?
C34 H34 0.9300 . ?
C34 C35 1.368(14) . ?
C35 H35 0.9300 . ?
C35 C36 1.375(13) . ?
C36 H36 0.9300 . ?
C36 C37 1.367(11) . ?
C37 H37 0.9300 . ?
Cl1 C38 1.68(2) . ?
Cl2 C38 1.71(2) . ?
Cl3 C38 1.65(2) . ?
C38 H38 0.9800 . ?

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
N1 Pt1 O1 92.69(18) . . ?
N1 Pt1 N2 177.51(17) . . ?
N2 Pt1 O1 88.82(17) . . ?
C1 Pt1 O1 173.72(19) . . ?
C1 Pt1 N1 81.3(2) . . ?
C1 Pt1 N2 97.3(2) . . ?
O1 P1 C12 112.4(3) . . ?
O1 P1 C26 112.6(3) . . ?
O1 P1 C32 107.3(3) . . ?
C26 P1 C12 107.8(3) . . ?
C32 P1 C12 108.0(3) . . ?
C32 P1 C26 108.4(3) . . ?
P1 O1 Pt1 124.1(3) . . ?
C7 N1 Pt1 116.2(4) . . ?
C11 N1 Pt1 124.3(4) . . ?
C11 N1 C7 119.6(5) . . ?
C18 N2 Pt1 129.9(4) . . ?
C18 N2 C19 104.5(5) . . ?
C19 N2 Pt1 125.4(4) . . ?
C18 N3 C24 103.7(5) . . ?
C2 C1 Pt1 128.2(5) . . ?
C2 C1 C6 117.6(5) . . ?
C6 C1 Pt1 114.1(4) . . ?
C1 C2 H2 119.6 . . ?
C3 C2 C1 120.8(6) . . ?
C3 C2 H2 119.6 . . ?
C2 C3 H3 119.4 . . ?
C2 C3 C4 121.3(7) . . ?
C4 C3 H3 119.4 . . ?
C3 C4 H4 120.4 . . ?
C3 C4 C5 119.3(6) . . ?
C5 C4 H4 120.4 . . ?
C4 C5 H5 120.2 . . ?
C4 C5 C6 119.6(7) . . ?
C6 C5 H5 120.2 . . ?
C1 C6 C7 115.7(5) . . ?
C5 C6 C1 121.4(6) . . ?
C5 C6 C7 122.9(6) . . ?
N1 C7 C6 112.7(5) . . ?
N1 C7 C8 119.0(6) . . ?
C8 C7 C6 128.2(6) . . ?
C7 C8 H8 119.3 . . ?
C9 C8 C7 121.4(6) . . ?
C9 C8 H8 119.3 . . ?
C8 C9 H9 121.0 . . ?
C10 C9 C8 118.1(6) . . ?
C10 C9 H9 121.0 . . ?
C9 C10 H10 120.3 . . ?
C11 C10 C9 119.4(7) . . ?
C11 C10 H10 120.3 . . ?
N1 C11 C10 122.5(6) . . ?
N1 C11 H11 118.8 . . ?
C10 C11 H11 118.8 . . ?
C13 C12 P1 120.6(5) . . ?
C13 C12 C17 119.6(6) . . ?
C17 C12 P1 119.8(5) . . ?
C12 C13 H13 119.7 . . ?
C14 C13 C12 120.5(7) . . ?
C14 C13 H13 119.7 . . ?
C13 C14 H14 120.1 . . ?
C13 C14 C15 119.8(7) . . ?
C15 C14 H14 120.1 . . ?
C14 C15 H15 119.5 . . ?
C16 C15 C14 121.0(7) . . ?
C16 C15 H15 119.5 . . ?
C15 C16 H16 119.6 . . ?
C15 C16 C17 120.8(7) . . ?
C17 C16 H16 119.6 . . ?
C12 C17 C18 121.6(6) . . ?
C16 C17 C12 118.2(6) . . ?
C16 C17 C18 120.0(6) . . ?
N2 C18 C17 123.2(5) . . ?
N3 C18 N2 115.0(5) . . ?
N3 C18 C17 121.6(5) . . ?
N2 C19 C20 131.2(5) . . ?
N2 C19 C24 106.9(5) . . ?
C20 C19 C24 121.8(5) . . ?
C19 C20 H20 121.4 . . ?
C21 C20 C19 117.2(6) . . ?
C21 C20 H20 121.4 . . ?
C20 C21 H21 119.8 . . ?
C20 C21 C22 120.4(6) . . ?
C22 C21 H21 119.8 . . ?
C21 C22 C25 118.5(7) . . ?
C23 C22 C21 122.8(6) . . ?
C23 C22 C25 118.7(7) . . ?
C22 C23 H23 120.8 . . ?
C22 C23 C24 118.3(6) . . ?
C24 C23 H23 120.8 . . ?
N3 C24 C19 109.8(5) . . ?
N3 C24 C23 130.6(6) . . ?
C23 C24 C19 119.4(6) . . ?
F1 C25 F3 100.1(8) . . ?
F1 C25 C22 117.3(7) . . ?
F2 C25 F1 109.1(9) . . ?
F2 C25 F3 98.9(8) . . ?
F2 C25 C22 116.6(8) . . ?
F3 C25 C22 112.1(8) . . ?
C27 C26 P1 119.0(5) . . ?
C27 C26 C31 119.5(6) . . ?
C31 C26 P1 121.5(5) . . ?
C26 C27 H27 119.7 . . ?
C26 C27 C28 120.7(7) . . ?
C28 C27 H27 119.7 . . ?
C27 C28 H28 120.6 . . ?
C29 C28 C27 118.9(7) . . ?
C29 C28 H28 120.6 . . ?
C28 C29 H29 119.6 . . ?
C30 C29 C28 120.7(7) . . ?
C30 C29 H29 119.6 . . ?
C29 C30 H30 119.4 . . ?
C31 C30 C29 121.3(8) . . ?
C31 C30 H30 119.4 . . ?
C26 C31 H31 120.5 . . ?
C30 C31 C26 119.0(7) . . ?
C30 C31 H31 120.5 . . ?
C33 C32 P1 123.1(6) . . ?
C33 C32 C37 118.8(7) . . ?
C37 C32 P1 118.0(5) . . ?
C32 C33 H33 120.0 . . ?
C32 C33 C34 120.0(8) . . ?
C34 C33 H33 120.0 . . ?
C33 C34 H34 119.5 . . ?
C35 C34 C33 121.0(8) . . ?
C35 C34 H34 119.5 . . ?
C34 C35 H35 121.3 . . ?
C34 C35 C36 117.4(9) . . ?
C36 C35 H35 121.3 . . ?
C35 C36 H36 118.8 . . ?
C37 C36 C35 122.4(9) . . ?
C37 C36 H36 118.8 . . ?
C32 C37 H37 119.9 . . ?
C36 C37 C32 120.3(7) . . ?
C36 C37 H37 119.9 . . ?
Cl1 C38 Cl2 116.8(13) . . ?
Cl1 C38 H38 103.1 . . ?
Cl2 C38 H38 103.1 . . ?
Cl3 C38 Cl1 111.6(14) . . ?
Cl3 C38 Cl2 116.7(12) . . ?
Cl3 C38 H38 103.1 . . ?

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
Pt1 N1 C7 C6 -0.4(6) . . . . ?
Pt1 N1 C7 C8 179.0(4) . . . . ?
Pt1 N1 C11 C10 -179.3(5) . . . . ?
Pt1 N2 C18 N3 -177.3(4) . . . . ?
Pt1 N2 C18 C17 -2.2(8) . . . . ?
Pt1 N2 C19 C20 0.8(9) . . . . ?
Pt1 N2 C19 C24 175.9(4) . . . . ?
Pt1 C1 C2 C3 176.3(5) . . . . ?
Pt1 C1 C6 C5 -176.2(5) . . . . ?
Pt1 C1 C6 C7 2.8(6) . . . . ?
P1 C12 C13 C14 -179.9(5) . . . . ?
P1 C12 C17 C16 178.7(4) . . . . ?
P1 C12 C17 C18 4.2(8) . . . . ?
P1 C26 C27 C28 179.1(6) . . . . ?
P1 C26 C31 C30 -179.0(8) . . . . ?
P1 C32 C33 C34 176.1(7) . . . . ?
P1 C32 C37 C36 -177.7(7) . . . . ?
O1 P1 C12 C13 -108.8(5) . . . . ?
O1 P1 C12 C17 71.2(5) . . . . ?
O1 P1 C26 C27 15.2(6) . . . . ?
O1 P1 C26 C31 -164.5(6) . . . . ?
O1 P1 C32 C33 -140.6(6) . . . . ?
O1 P1 C32 C37 36.4(6) . . . . ?
N1 C7 C8 C9 0.5(9) . . . . ?
N2 C19 C20 C21 173.8(6) . . . . ?
N2 C19 C24 N3 1.5(7) . . . . ?
N2 C19 C24 C23 -174.4(6) . . . . ?
C1 C2 C3 C4 -0.1(11) . . . . ?
C1 C6 C7 N1 -1.6(7) . . . . ?
C1 C6 C7 C8 179.1(6) . . . . ?
C2 C1 C6 C5 0.9(9) . . . . ?
C2 C1 C6 C7 179.9(5) . . . . ?
C2 C3 C4 C5 0.0(12) . . . . ?
C3 C4 C5 C6 0.6(11) . . . . ?
C4 C5 C6 C1 -1.0(10) . . . . ?
C4 C5 C6 C7 180.0(6) . . . . ?
C5 C6 C7 N1 177.5(5) . . . . ?
C5 C6 C7 C8 -1.8(10) . . . . ?
C6 C1 C2 C3 -0.3(10) . . . . ?
C6 C7 C8 C9 179.8(6) . . . . ?
C7 N1 C11 C10 1.3(9) . . . . ?
C7 C8 C9 C10 0.9(10) . . . . ?
C8 C9 C10 C11 -1.3(10) . . . . ?
C9 C10 C11 N1 0.2(10) . . . . ?
C11 N1 C7 C6 179.0(5) . . . . ?
C11 N1 C7 C8 -1.6(8) . . . . ?
C12 P1 O1 Pt1 -38.7(4) . . . . ?
C12 P1 C26 C27 139.9(6) . . . . ?
C12 P1 C26 C31 -39.8(7) . . . . ?
C12 P1 C32 C33 97.9(7) . . . . ?
C12 P1 C32 C37 -85.0(6) . . . . ?
C12 C13 C14 C15 1.1(11) . . . . ?
C12 C17 C18 N2 -59.7(8) . . . . ?
C12 C17 C18 N3 115.1(7) . . . . ?
C13 C12 C17 C16 -1.3(9) . . . . ?
C13 C12 C17 C18 -175.8(6) . . . . ?
C13 C14 C15 C16 -1.1(12) . . . . ?
C14 C15 C16 C17 -0.2(11) . . . . ?
C15 C16 C17 C12 1.4(10) . . . . ?
C15 C16 C17 C18 176.0(6) . . . . ?
C16 C17 C18 N2 125.9(6) . . . . ?
C16 C17 C18 N3 -59.3(8) . . . . ?
C17 C12 C13 C14 0.1(10) . . . . ?
C18 N2 C19 C20 -175.2(6) . . . . ?
C18 N2 C19 C24 0.0(6) . . . . ?
C18 N3 C24 C19 -2.3(7) . . . . ?
C18 N3 C24 C23 173.0(7) . . . . ?
C19 N2 C18 N3 -1.6(7) . . . . ?
C19 N2 C18 C17 173.5(5) . . . . ?
C19 C20 C21 C22 -0.8(10) . . . . ?
C20 C19 C24 N3 177.2(6) . . . . ?
C20 C19 C24 C23 1.3(9) . . . . ?
C20 C21 C22 C23 1.8(11) . . . . ?
C20 C21 C22 C25 -178.9(7) . . . . ?
C21 C22 C23 C24 -1.1(11) . . . . ?
C21 C22 C25 F1 -118.8(10) . . . . ?
C21 C22 C25 F2 13.3(13) . . . . ?
C21 C22 C25 F3 126.2(9) . . . . ?
C22 C23 C24 N3 -175.3(7) . . . . ?
C22 C23 C24 C19 -0.4(10) . . . . ?
C23 C22 C25 F1 60.5(12) . . . . ?
C23 C22 C25 F2 -167.4(10) . . . . ?
C23 C22 C25 F3 -54.5(11) . . . . ?
C24 N3 C18 N2 2.5(7) . . . . ?
C24 N3 C18 C17 -172.7(6) . . . . ?
C24 C19 C20 C21 -0.7(9) . . . . ?
C25 C22 C23 C24 179.5(7) . . . . ?
C26 P1 O1 Pt1 83.4(4) . . . . ?
C26 P1 C12 C13 126.5(5) . . . . ?
C26 P1 C12 C17 -53.5(5) . . . . ?
C26 P1 C32 C33 -18.7(7) . . . . ?
C26 P1 C32 C37 158.4(6) . . . . ?
C26 C27 C28 C29 1.1(12) . . . . ?
C27 C26 C31 C30 1.3(13) . . . . ?
C27 C28 C29 C30 -1.3(15) . . . . ?
C28 C29 C30 C31 1.5(17) . . . . ?
C29 C30 C31 C26 -1.5(16) . . . . ?
C31 C26 C27 C28 -1.2(11) . . . . ?
C32 P1 O1 Pt1 -157.4(3) . . . . ?
C32 P1 C12 C13 9.5(6) . . . . ?
C32 P1 C12 C17 -170.6(5) . . . . ?
C32 P1 C26 C27 -103.4(6) . . . . ?
C32 P1 C26 C31 76.9(7) . . . . ?
C32 C33 C34 C35 1.4(15) . . . . ?
C33 C32 C37 C36 -0.5(12) . . . . ?
C33 C34 C35 C36 -0.4(16) . . . . ?
C34 C35 C36 C37 -1.0(16) . . . . ?
C35 C36 C37 C32 1.5(14) . . . . ?
C37 C32 C33 C34 -0.9(12) . . . . ?

_olex2_date_sample_data_collection 2016-11-18
_olex2_submission_special_instructions 'No special instructions were received'
_oxdiff_exptl_absorpt_empirical_details 
;
Empirical correction (ABSPACK) includes:
- Absorption correction using spherical harmonics
- Frame scaling
;
_oxdiff_exptl_absorpt_empirical_full_max 1.744
_oxdiff_exptl_absorpt_empirical_full_min 0.750
####################################################################### 
# 
# 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_gq201
_database_code_depnum_ccdc_archive 'CCDC 2032297'
loop_
_audit_author_name
_audit_author_address
'Bin Zhang'
;Zhengzhou University
China
;
_audit_update_record             
;
2020-09-16 deposited with the CCDC.	2021-06-21 downloaded from the CCDC.
;
_audit_creation_date             2020-09-07
_audit_creation_method           
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_shelx_SHELXL_version_number     2014/7
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C37 H28 N3 O2 P Pt, C4 H8 O2'
_chemical_formula_sum            'C41 H36 N3 O4 P Pt'
_chemical_formula_weight         860.79
_chemical_melting_point          ?
_chemical_oxdiff_formula         C30H30O2N2P2Pt
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'
N N 0.0061 0.0033 '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'
Pt Pt -1.7033 8.3905 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_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.
;
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 1 21/n 1'
_space_group_name_Hall           '-P 2yn'
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                   10.2624(3)
_cell_length_b                   17.1500(5)
_cell_length_c                   20.1248(4)
_cell_angle_alpha                90
_cell_angle_beta                 95.063(2)
_cell_angle_gamma                90
_cell_volume                     3528.16(16)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    6934
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      28.4380
_cell_measurement_theta_min      2.3060
_shelx_estimated_absorpt_T_max   0.580
_shelx_estimated_absorpt_T_min   0.497
_exptl_absorpt_coefficient_mu    4.069
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.48892
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro 1.171.40.53 (Rigaku Oxford Diffraction, 2019)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.621
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       prism
_exptl_crystal_F_000             1712
_exptl_crystal_size_max          0.2
_exptl_crystal_size_mid          0.2
_exptl_crystal_size_min          0.15
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0587
_diffrn_reflns_av_unetI/netI     0.0778
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.966
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_l_max       26
_diffrn_reflns_limit_l_min       -26
_diffrn_reflns_number            18629
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.966
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         27.477
_diffrn_reflns_theta_min         2.315
_diffrn_ambient_temperature      293(2)
_diffrn_detector                 'CCD plate'
_diffrn_detector_area_resol_mean 16.2312
_diffrn_detector_type            Eos
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.966
_diffrn_measurement_details      
;
List of Runs (angles in degrees, time in seconds):

  # Type    Start    End  Width  tₑₓₚ   ω     θ     κ     φ   Frames
#--------------------------------------------------------------------------
  1  ω    -15.00  24.00   0.50   35.00    --  -15.18 -99.00 150.00   78
  2  ω    -25.00  21.00   0.50   35.00    --   18.07 -37.00 -30.00   92
  3  ω     35.00  90.00   0.50   35.00    --   18.07 178.00 -90.00  110
  4  ω     -1.00  25.00   0.50   35.00    --   18.07  37.00 120.00   52
  5  ω      2.00  82.00   0.50   35.00    --   18.07  57.00 120.00  160
;
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'Xcalibur, Eos, Gemini'
_diffrn_measurement_method       'ω scans'
_diffrn_orient_matrix_type       
'CrysAlisPro convention (1999,Acta A55,543-557)'
_diffrn_orient_matrix_UB_11      -0.0077592000
_diffrn_orient_matrix_UB_12      -0.0201247000
_diffrn_orient_matrix_UB_13      -0.0308634000
_diffrn_orient_matrix_UB_21      -0.0077091000
_diffrn_orient_matrix_UB_22      0.0360846000
_diffrn_orient_matrix_UB_23      -0.0171371000
_diffrn_orient_matrix_UB_31      0.0685430000
_diffrn_orient_matrix_UB_32      0.0017746000
_diffrn_orient_matrix_UB_33      -0.0022595000
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   'fine-focus sealed X-ray tube'
_diffrn_source_type              'Enhance (Mo) X-ray Source'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                5839
_reflns_number_total             7808
_reflns_odcompleteness_completeness 99.93
_reflns_odcompleteness_iscentric 1
_reflns_odcompleteness_theta     26.32
_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.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'CrysAlisPro 1.171.40.53 (Rigaku OD, 2019)'
_computing_data_collection       'CrysAlisPro 1.171.40.53 (Rigaku OD, 2019)'
_computing_data_reduction        'CrysAlisPro 1.171.40.53 (Rigaku OD, 2019)'
_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    'ShelXS (Sheldrick, 2008)'
_refine_diff_density_max         1.764
_refine_diff_density_min         -0.829
_refine_diff_density_rms         0.152
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.022
_refine_ls_hydrogen_treatment    noref
_refine_ls_matrix_type           full
_refine_ls_number_parameters     424
_refine_ls_number_reflns         7808
_refine_ls_number_restraints     1
_refine_ls_R_factor_all          0.0696
_refine_ls_R_factor_gt           0.0447
_refine_ls_restrained_S_all      1.024
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0411P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0913
_refine_ls_wR_factor_ref         0.1027
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2. Restrained distances
 C40-C41
 1.505 with sigma of 0.01
3.a Secondary CH2 refined with riding coordinates:
 C40(H40A,H40B)
3.b Aromatic/amide H refined with riding coordinates:
 C2(H2), C3(H3), C4(H4), C5(H5), C8(H8), C9(H9), C10(H10), C11(H11), C13(H13),
 C14(H14), C16(H16), C20(H20), C21(H21), C22(H22), C23(H23), C27(H27), C28(H28),
  C29(H29), C30(H30), C31(H31), C33(H33), C34(H34), C35(H35), C36(H36), C37(H37)
3.c Idealised Me refined as rotating group:
 C25(H25A,H25B,H25C), C39(H39A,H39B,H39C), C41(H41A,H41B,H41C)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   ?
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 0.14643(2) 0.35401(2) 0.51446(2) 0.03262(9) Uani 1 1 d . . . . .
P1 P 0.12001(14) 0.24363(9) 0.64294(7) 0.0376(4) Uani 1 1 d . . . . .
O1 O 0.0533(3) 0.2727(2) 0.57818(17) 0.0441(10) Uani 1 1 d . . . . .
O2 O 0.7132(5) 0.1423(3) 0.4527(3) 0.0762(16) Uani 1 1 d . . . . .
N1 N -0.0272(4) 0.3898(3) 0.4691(2) 0.0340(10) Uani 1 1 d . . . . .
N2 N 0.3242(4) 0.3163(3) 0.5528(2) 0.0338(11) Uani 1 1 d . . . . .
N3 N 0.5046(4) 0.2905(3) 0.6241(2) 0.0380(11) Uani 1 1 d . . . . .
C1 C 0.2132(5) 0.4341(3) 0.4549(2) 0.0317(12) Uani 1 1 d . . . . .
C2 C 0.3401(5) 0.4593(4) 0.4524(3) 0.0403(14) Uani 1 1 d . . . . .
H2 H 0.4071 0.4350 0.4788 0.048 Uiso 1 1 calc R . . . .
C3 C 0.3696(5) 0.5204(4) 0.4111(3) 0.0414(14) Uani 1 1 d . . . . .
H3 H 0.4559 0.5368 0.4105 0.050 Uiso 1 1 calc R . . . .
C4 C 0.2729(5) 0.5571(4) 0.3711(3) 0.0455(15) Uani 1 1 d . . . . .
H4 H 0.2935 0.5982 0.3438 0.055 Uiso 1 1 calc R . . . .
C5 C 0.1452(6) 0.5326(4) 0.3716(3) 0.0437(14) Uani 1 1 d . . . . .
H5 H 0.0796 0.5564 0.3439 0.052 Uiso 1 1 calc R . . . .
C6 C 0.1143(5) 0.4715(3) 0.4138(3) 0.0347(13) Uani 1 1 d . . . . .
C7 C -0.0197(5) 0.4450(3) 0.4209(2) 0.0352(13) Uani 1 1 d . . . . .
C8 C -0.1331(5) 0.4701(4) 0.3845(3) 0.0463(15) Uani 1 1 d . . . . .
H8 H -0.1289 0.5077 0.3515 0.056 Uiso 1 1 calc R . . . .
C9 C -0.2529(6) 0.4386(4) 0.3977(3) 0.0506(17) Uani 1 1 d . . . . .
H9 H -0.3293 0.4550 0.3734 0.061 Uiso 1 1 calc R . . . .
C10 C -0.2582(6) 0.3831(4) 0.4467(3) 0.0469(16) Uani 1 1 d . . . . .
H10 H -0.3377 0.3614 0.4560 0.056 Uiso 1 1 calc R . . . .
C11 C -0.1430(5) 0.3605(3) 0.4819(3) 0.0404(14) Uani 1 1 d . . . . .
H11 H -0.1461 0.3236 0.5156 0.049 Uiso 1 1 calc R . . . .
C12 C 0.4133(5) 0.2763(3) 0.5183(3) 0.0369(13) Uani 1 1 d . . . . .
C13 C 0.4074(6) 0.2507(4) 0.4519(3) 0.0508(17) Uani 1 1 d . . . . .
H13 H 0.3366 0.2628 0.4215 0.061 Uiso 1 1 calc R . . . .
C14 C 0.5100(6) 0.2072(4) 0.4336(3) 0.0552(18) Uani 1 1 d . . . . .
H14 H 0.5081 0.1894 0.3898 0.066 Uiso 1 1 calc R . . . .
C15 C 0.6180(6) 0.1886(4) 0.4784(3) 0.0484(16) Uani 1 1 d . . . . .
C16 C 0.6264(5) 0.2147(4) 0.5426(3) 0.0444(15) Uani 1 1 d . . . . .
H16 H 0.6984 0.2030 0.5722 0.053 Uiso 1 1 calc R . . . .
C17 C 0.5226(5) 0.2600(3) 0.5627(3) 0.0374(13) Uani 1 1 d . . . . .
C18 C 0.3836(5) 0.3219(3) 0.6164(3) 0.0335(12) Uani 1 1 d . . . . .
C19 C 0.3214(5) 0.3522(3) 0.6733(3) 0.0345(13) Uani 1 1 d . . . . .
C20 C 0.3847(6) 0.4097(4) 0.7144(3) 0.0429(15) Uani 1 1 d . . . . .
H20 H 0.4645 0.4299 0.7040 0.051 Uiso 1 1 calc R . . . .
C21 C 0.3285(7) 0.4364(4) 0.7702(3) 0.0572(18) Uani 1 1 d . . . . .
H21 H 0.3696 0.4757 0.7962 0.069 Uiso 1 1 calc R . . . .
C22 C 0.2121(7) 0.4054(4) 0.7877(3) 0.0571(18) Uani 1 1 d . . . . .
H22 H 0.1761 0.4234 0.8256 0.069 Uiso 1 1 calc R . . . .
C23 C 0.1486(6) 0.3475(4) 0.7490(3) 0.0483(16) Uani 1 1 d . . . . .
H23 H 0.0699 0.3271 0.7608 0.058 Uiso 1 1 calc R . . . .
C24 C 0.2033(5) 0.3197(4) 0.6917(3) 0.0380(13) Uani 1 1 d . . . . .
C25 C 0.8183(8) 0.1184(6) 0.4967(4) 0.094(3) Uani 1 1 d . . . . .
H25A H 0.8697 0.0810 0.4750 0.141 Uiso 1 1 calc GR . . . .
H25B H 0.7858 0.0950 0.5353 0.141 Uiso 1 1 calc GR . . . .
H25C H 0.8715 0.1627 0.5100 0.141 Uiso 1 1 calc GR . . . .
C26 C 0.2358(6) 0.1678(4) 0.6304(3) 0.0424(14) Uani 1 1 d . . . . .
C27 C 0.2253(8) 0.1286(4) 0.5685(4) 0.0616(19) Uani 1 1 d . . . . .
H27 H 0.1593 0.1417 0.5357 0.074 Uiso 1 1 calc R . . . .
C28 C 0.3122(9) 0.0719(5) 0.5573(4) 0.081(2) Uani 1 1 d . . . . .
H28 H 0.3032 0.0449 0.5171 0.097 Uiso 1 1 calc R . . . .
C29 C 0.4123(9) 0.0533(5) 0.6032(5) 0.085(3) Uani 1 1 d . . . . .
H29 H 0.4725 0.0155 0.5931 0.103 Uiso 1 1 calc R . . . .
C30 C 0.4259(7) 0.0896(5) 0.6643(5) 0.081(3) Uani 1 1 d . . . . .
H30 H 0.4935 0.0759 0.6961 0.097 Uiso 1 1 calc R . . . .
C31 C 0.3364(7) 0.1474(4) 0.6777(4) 0.0561(18) Uani 1 1 d . . . . .
H31 H 0.3442 0.1725 0.7189 0.067 Uiso 1 1 calc R . . . .
C32 C -0.0023(5) 0.2060(4) 0.6930(3) 0.0431(15) Uani 1 1 d . . . . .
C33 C -0.1282(6) 0.2346(4) 0.6844(3) 0.0518(17) Uani 1 1 d . . . . .
H33 H -0.1489 0.2726 0.6522 0.062 Uiso 1 1 calc R . . . .
C34 C -0.2236(6) 0.2078(5) 0.7225(3) 0.067(2) Uani 1 1 d . . . . .
H34 H -0.3091 0.2258 0.7146 0.081 Uiso 1 1 calc R . . . .
C35 C -0.1927(7) 0.1547(5) 0.7718(4) 0.076(2) Uani 1 1 d . . . . .
H35 H -0.2564 0.1380 0.7987 0.091 Uiso 1 1 calc R . . . .
C36 C -0.0682(8) 0.1259(5) 0.7817(4) 0.083(3) Uani 1 1 d . . . . .
H36 H -0.0479 0.0890 0.8148 0.099 Uiso 1 1 calc R . . . .
C37 C 0.0270(7) 0.1513(5) 0.7430(4) 0.067(2) Uani 1 1 d . . . . .
H37 H 0.1116 0.1317 0.7503 0.081 Uiso 1 1 calc R . . . .
O3 O 0.6074(11) 0.4426(7) 0.9051(6) 0.213(5) Uiso 1 1 d . . . . .
O4 O 0.6323(7) 0.3424(5) 0.8451(4) 0.117(2) Uiso 1 1 d . . . . .
C38 C 0.6676(15) 0.4108(10) 0.8632(8) 0.151(5) Uiso 1 1 d . . . . .
C39 C 0.7617(14) 0.4431(9) 0.8249(7) 0.177(6) Uiso 1 1 d . . . . .
H39A H 0.8398 0.4120 0.8298 0.265 Uiso 1 1 calc GR . . . .
H39B H 0.7814 0.4953 0.8397 0.265 Uiso 1 1 calc GR . . . .
H39C H 0.7282 0.4439 0.7788 0.265 Uiso 1 1 calc GR . . . .
C40 C 0.5322(10) 0.3069(6) 0.8791(5) 0.115(3) Uiso 1 1 d D . . . .
H40A H 0.4638 0.3441 0.8865 0.139 Uiso 1 1 calc R . . . .
H40B H 0.5675 0.2863 0.9219 0.139 Uiso 1 1 calc R . . . .
C41 C 0.4820(9) 0.2447(5) 0.8355(5) 0.106(3) Uiso 1 1 d D . . . .
H41A H 0.4558 0.2655 0.7921 0.159 Uiso 1 1 calc GR . . . .
H41B H 0.4081 0.2210 0.8535 0.159 Uiso 1 1 calc GR . . . .
H41C H 0.5490 0.2062 0.8319 0.159 Uiso 1 1 calc GR . . . .


_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
Pt1 O1 2.172(4) . ?
Pt1 N1 2.024(4) . ?
Pt1 N2 2.023(4) . ?
Pt1 C1 1.984(5) . ?
P1 O1 1.503(4) . ?
P1 C24 1.802(6) . ?
P1 C26 1.795(6) . ?
P1 C32 1.798(6) . ?
O2 C15 1.392(7) . ?
O2 C25 1.395(8) . ?
N1 C7 1.363(7) . ?
N1 C11 1.336(7) . ?
N2 C12 1.379(7) . ?
N2 C18 1.371(6) . ?
N3 C17 1.371(7) . ?
N3 C18 1.350(6) . ?
C1 C2 1.378(7) . ?
C1 C6 1.406(7) . ?
C2 H2 0.9300 . ?
C2 C3 1.387(8) . ?
C3 H3 0.9300 . ?
C3 C4 1.374(8) . ?
C4 H4 0.9300 . ?
C4 C5 1.377(8) . ?
C5 H5 0.9300 . ?
C5 C6 1.403(8) . ?
C6 C7 1.467(7) . ?
C7 C8 1.387(7) . ?
C8 H8 0.9300 . ?
C8 C9 1.390(8) . ?
C9 H9 0.9300 . ?
C9 C10 1.376(8) . ?
C10 H10 0.9300 . ?
C10 C11 1.378(7) . ?
C11 H11 0.9300 . ?
C12 C13 1.404(7) . ?
C12 C17 1.400(7) . ?
C13 H13 0.9300 . ?
C13 C14 1.366(8) . ?
C14 H14 0.9300 . ?
C14 C15 1.403(8) . ?
C15 C16 1.364(8) . ?
C16 H16 0.9300 . ?
C16 C17 1.405(8) . ?
C18 C19 1.455(8) . ?
C19 C20 1.409(8) . ?
C19 C24 1.414(8) . ?
C20 H20 0.9300 . ?
C20 C21 1.385(8) . ?
C21 H21 0.9300 . ?
C21 C22 1.382(9) . ?
C22 H22 0.9300 . ?
C22 C23 1.389(9) . ?
C23 H23 0.9300 . ?
C23 C24 1.408(8) . ?
C25 H25A 0.9600 . ?
C25 H25B 0.9600 . ?
C25 H25C 0.9600 . ?
C26 C27 1.411(9) . ?
C26 C31 1.387(8) . ?
C27 H27 0.9300 . ?
C27 C28 1.352(10) . ?
C28 H28 0.9300 . ?
C28 C29 1.357(11) . ?
C29 H29 0.9300 . ?
C29 C30 1.376(11) . ?
C30 H30 0.9300 . ?
C30 C31 1.394(10) . ?
C31 H31 0.9300 . ?
C32 C33 1.378(8) . ?
C32 C37 1.389(8) . ?
C33 H33 0.9300 . ?
C33 C34 1.375(9) . ?
C34 H34 0.9300 . ?
C34 C35 1.363(9) . ?
C35 H35 0.9300 . ?
C35 C36 1.369(10) . ?
C36 H36 0.9300 . ?
C36 C37 1.373(10) . ?
C37 H37 0.9300 . ?
O3 C38 1.217(16) . ?
O4 C38 1.272(15) . ?
O4 C40 1.421(11) . ?
C38 C39 1.402(16) . ?
C39 H39A 0.9600 . ?
C39 H39B 0.9600 . ?
C39 H39C 0.9600 . ?
C40 H40A 0.9700 . ?
C40 H40B 0.9700 . ?
C40 C41 1.447(8) . ?
C41 H41A 0.9600 . ?
C41 H41B 0.9600 . ?
C41 H41C 0.9600 . ?

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
N1 Pt1 O1 92.58(16) . . ?
N2 Pt1 O1 89.91(16) . . ?
N2 Pt1 N1 175.65(17) . . ?
C1 Pt1 O1 173.86(17) . . ?
C1 Pt1 N1 81.66(19) . . ?
C1 Pt1 N2 95.97(19) . . ?
O1 P1 C24 113.0(3) . . ?
O1 P1 C26 112.0(3) . . ?
O1 P1 C32 108.5(2) . . ?
C26 P1 C24 108.3(3) . . ?
C26 P1 C32 108.8(3) . . ?
C32 P1 C24 106.0(3) . . ?
P1 O1 Pt1 122.3(2) . . ?
C15 O2 C25 117.4(6) . . ?
C7 N1 Pt1 115.4(3) . . ?
C11 N1 Pt1 124.2(4) . . ?
C11 N1 C7 120.3(4) . . ?
C12 N2 Pt1 125.6(3) . . ?
C18 N2 Pt1 130.2(4) . . ?
C18 N2 C12 104.2(4) . . ?
C18 N3 C17 104.1(4) . . ?
C2 C1 Pt1 128.2(4) . . ?
C2 C1 C6 118.1(5) . . ?
C6 C1 Pt1 113.7(4) . . ?
C1 C2 H2 119.5 . . ?
C1 C2 C3 121.1(5) . . ?
C3 C2 H2 119.5 . . ?
C2 C3 H3 119.6 . . ?
C4 C3 C2 120.8(5) . . ?
C4 C3 H3 119.6 . . ?
C3 C4 H4 120.2 . . ?
C3 C4 C5 119.7(6) . . ?
C5 C4 H4 120.2 . . ?
C4 C5 H5 120.0 . . ?
C4 C5 C6 119.9(5) . . ?
C6 C5 H5 120.0 . . ?
C1 C6 C7 115.8(5) . . ?
C5 C6 C1 120.5(5) . . ?
C5 C6 C7 123.6(5) . . ?
N1 C7 C6 113.3(4) . . ?
N1 C7 C8 119.6(5) . . ?
C8 C7 C6 127.0(5) . . ?
C7 C8 H8 120.2 . . ?
C7 C8 C9 119.6(6) . . ?
C9 C8 H8 120.2 . . ?
C8 C9 H9 120.1 . . ?
C10 C9 C8 119.8(5) . . ?
C10 C9 H9 120.1 . . ?
C9 C10 H10 120.8 . . ?
C9 C10 C11 118.5(6) . . ?
C11 C10 H10 120.8 . . ?
N1 C11 C10 122.2(6) . . ?
N1 C11 H11 118.9 . . ?
C10 C11 H11 118.9 . . ?
N2 C12 C13 131.4(5) . . ?
N2 C12 C17 107.9(5) . . ?
C17 C12 C13 120.6(5) . . ?
C12 C13 H13 121.4 . . ?
C14 C13 C12 117.3(5) . . ?
C14 C13 H13 121.4 . . ?
C13 C14 H14 118.8 . . ?
C13 C14 C15 122.4(6) . . ?
C15 C14 H14 118.8 . . ?
O2 C15 C14 115.6(6) . . ?
C16 C15 O2 123.5(6) . . ?
C16 C15 C14 120.9(6) . . ?
C15 C16 H16 121.0 . . ?
C15 C16 C17 117.9(5) . . ?
C17 C16 H16 121.0 . . ?
N3 C17 C12 109.6(5) . . ?
N3 C17 C16 129.5(5) . . ?
C12 C17 C16 120.8(5) . . ?
N2 C18 C19 124.7(4) . . ?
N3 C18 N2 114.1(5) . . ?
N3 C18 C19 121.0(4) . . ?
C20 C19 C18 120.1(5) . . ?
C20 C19 C24 118.9(5) . . ?
C24 C19 C18 120.8(5) . . ?
C19 C20 H20 119.8 . . ?
C21 C20 C19 120.3(6) . . ?
C21 C20 H20 119.8 . . ?
C20 C21 H21 119.7 . . ?
C22 C21 C20 120.6(6) . . ?
C22 C21 H21 119.7 . . ?
C21 C22 H22 119.8 . . ?
C21 C22 C23 120.4(6) . . ?
C23 C22 H22 119.8 . . ?
C22 C23 H23 120.0 . . ?
C22 C23 C24 120.0(6) . . ?
C24 C23 H23 120.0 . . ?
C19 C24 P1 121.2(4) . . ?
C23 C24 P1 119.1(5) . . ?
C23 C24 C19 119.6(5) . . ?
O2 C25 H25A 109.5 . . ?
O2 C25 H25B 109.5 . . ?
O2 C25 H25C 109.5 . . ?
H25A C25 H25B 109.5 . . ?
H25A C25 H25C 109.5 . . ?
H25B C25 H25C 109.5 . . ?
C27 C26 P1 118.0(5) . . ?
C31 C26 P1 123.2(5) . . ?
C31 C26 C27 118.7(6) . . ?
C26 C27 H27 120.4 . . ?
C28 C27 C26 119.3(7) . . ?
C28 C27 H27 120.4 . . ?
C27 C28 H28 119.1 . . ?
C27 C28 C29 121.8(8) . . ?
C29 C28 H28 119.1 . . ?
C28 C29 H29 119.6 . . ?
C28 C29 C30 120.9(8) . . ?
C30 C29 H29 119.6 . . ?
C29 C30 H30 120.7 . . ?
C29 C30 C31 118.6(8) . . ?
C31 C30 H30 120.7 . . ?
C26 C31 C30 120.7(7) . . ?
C26 C31 H31 119.7 . . ?
C30 C31 H31 119.7 . . ?
C33 C32 P1 119.7(5) . . ?
C33 C32 C37 118.2(6) . . ?
C37 C32 P1 122.1(5) . . ?
C32 C33 H33 119.5 . . ?
C34 C33 C32 121.1(6) . . ?
C34 C33 H33 119.5 . . ?
C33 C34 H34 120.1 . . ?
C35 C34 C33 119.8(7) . . ?
C35 C34 H34 120.1 . . ?
C34 C35 H35 119.9 . . ?
C34 C35 C36 120.1(7) . . ?
C36 C35 H35 119.9 . . ?
C35 C36 H36 119.8 . . ?
C35 C36 C37 120.3(7) . . ?
C37 C36 H36 119.8 . . ?
C32 C37 H37 119.8 . . ?
C36 C37 C32 120.3(7) . . ?
C36 C37 H37 119.8 . . ?
C38 O4 C40 117.2(11) . . ?
O3 C38 O4 117.6(16) . . ?
O3 C38 C39 128.4(17) . . ?
O4 C38 C39 113.5(15) . . ?
C38 C39 H39A 109.5 . . ?
C38 C39 H39B 109.5 . . ?
C38 C39 H39C 109.5 . . ?
H39A C39 H39B 109.5 . . ?
H39A C39 H39C 109.5 . . ?
H39B C39 H39C 109.5 . . ?
O4 C40 H40A 110.8 . . ?
O4 C40 H40B 110.8 . . ?
O4 C40 C41 104.9(9) . . ?
H40A C40 H40B 108.8 . . ?
C41 C40 H40A 110.8 . . ?
C41 C40 H40B 110.8 . . ?
C40 C41 H41A 109.5 . . ?
C40 C41 H41B 109.5 . . ?
C40 C41 H41C 109.5 . . ?
H41A C41 H41B 109.5 . . ?
H41A C41 H41C 109.5 . . ?
H41B C41 H41C 109.5 . . ?

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
Pt1 N1 C7 C6 -3.4(6) . . . . ?
Pt1 N1 C7 C8 176.5(4) . . . . ?
Pt1 N1 C11 C10 -175.7(4) . . . . ?
Pt1 N2 C12 C13 -1.0(9) . . . . ?
Pt1 N2 C12 C17 -179.2(4) . . . . ?
Pt1 N2 C18 N3 -179.4(4) . . . . ?
Pt1 N2 C18 C19 5.7(8) . . . . ?
Pt1 C1 C2 C3 -175.0(4) . . . . ?
Pt1 C1 C6 C5 176.4(4) . . . . ?
Pt1 C1 C6 C7 -0.7(6) . . . . ?
P1 C26 C27 C28 179.2(6) . . . . ?
P1 C26 C31 C30 -178.0(6) . . . . ?
P1 C32 C33 C34 -179.1(6) . . . . ?
P1 C32 C37 C36 177.8(7) . . . . ?
O1 P1 C24 C19 -73.3(5) . . . . ?
O1 P1 C24 C23 106.1(5) . . . . ?
O1 P1 C26 C27 -18.3(6) . . . . ?
O1 P1 C26 C31 160.1(5) . . . . ?
O1 P1 C32 C33 -26.9(6) . . . . ?
O1 P1 C32 C37 156.4(6) . . . . ?
O2 C15 C16 C17 -179.0(6) . . . . ?
N1 C7 C8 C9 0.1(9) . . . . ?
N2 C12 C13 C14 -175.7(6) . . . . ?
N2 C12 C17 N3 -1.2(6) . . . . ?
N2 C12 C17 C16 175.6(5) . . . . ?
N2 C18 C19 C20 -129.8(6) . . . . ?
N2 C18 C19 C24 56.1(8) . . . . ?
N3 C18 C19 C20 55.7(7) . . . . ?
N3 C18 C19 C24 -118.5(6) . . . . ?
C1 C2 C3 C4 -0.6(9) . . . . ?
C1 C6 C7 N1 2.7(7) . . . . ?
C1 C6 C7 C8 -177.1(6) . . . . ?
C2 C1 C6 C5 0.1(8) . . . . ?
C2 C1 C6 C7 -177.1(5) . . . . ?
C2 C3 C4 C5 -0.5(9) . . . . ?
C3 C4 C5 C6 1.3(9) . . . . ?
C4 C5 C6 C1 -1.1(9) . . . . ?
C4 C5 C6 C7 175.8(5) . . . . ?
C5 C6 C7 N1 -174.4(5) . . . . ?
C5 C6 C7 C8 5.8(9) . . . . ?
C6 C1 C2 C3 0.7(8) . . . . ?
C6 C7 C8 C9 179.9(6) . . . . ?
C7 N1 C11 C10 1.2(8) . . . . ?
C7 C8 C9 C10 0.2(9) . . . . ?
C8 C9 C10 C11 0.3(9) . . . . ?
C9 C10 C11 N1 -1.0(9) . . . . ?
C11 N1 C7 C6 179.4(5) . . . . ?
C11 N1 C7 C8 -0.7(8) . . . . ?
C12 N2 C18 N3 1.9(6) . . . . ?
C12 N2 C18 C19 -173.0(5) . . . . ?
C12 C13 C14 C15 -0.3(10) . . . . ?
C13 C12 C17 N3 -179.6(5) . . . . ?
C13 C12 C17 C16 -2.8(9) . . . . ?
C13 C14 C15 O2 178.5(6) . . . . ?
C13 C14 C15 C16 -1.3(11) . . . . ?
C14 C15 C16 C17 0.8(9) . . . . ?
C15 C16 C17 N3 177.3(6) . . . . ?
C15 C16 C17 C12 1.2(9) . . . . ?
C17 N3 C18 N2 -2.6(6) . . . . ?
C17 N3 C18 C19 172.5(5) . . . . ?
C17 C12 C13 C14 2.3(9) . . . . ?
C18 N2 C12 C13 177.8(6) . . . . ?
C18 N2 C12 C17 -0.3(6) . . . . ?
C18 N3 C17 C12 2.2(6) . . . . ?
C18 N3 C17 C16 -174.2(6) . . . . ?
C18 C19 C20 C21 -177.2(5) . . . . ?
C18 C19 C24 P1 -3.7(7) . . . . ?
C18 C19 C24 C23 176.8(5) . . . . ?
C19 C20 C21 C22 2.1(9) . . . . ?
C20 C19 C24 P1 -177.9(4) . . . . ?
C20 C19 C24 C23 2.6(8) . . . . ?
C20 C21 C22 C23 -0.8(10) . . . . ?
C21 C22 C23 C24 0.4(9) . . . . ?
C22 C23 C24 P1 179.2(5) . . . . ?
C22 C23 C24 C19 -1.3(9) . . . . ?
C24 P1 O1 Pt1 43.6(4) . . . . ?
C24 P1 C26 C27 -143.5(5) . . . . ?
C24 P1 C26 C31 34.9(6) . . . . ?
C24 P1 C32 C33 94.7(5) . . . . ?
C24 P1 C32 C37 -82.0(6) . . . . ?
C24 C19 C20 C21 -3.0(8) . . . . ?
C25 O2 C15 C14 -176.1(7) . . . . ?
C25 O2 C15 C16 3.7(10) . . . . ?
C26 P1 O1 Pt1 -79.0(3) . . . . ?
C26 P1 C24 C19 51.3(5) . . . . ?
C26 P1 C24 C23 -129.2(5) . . . . ?
C26 P1 C32 C33 -149.0(5) . . . . ?
C26 P1 C32 C37 34.3(7) . . . . ?
C26 C27 C28 C29 -2.3(12) . . . . ?
C27 C26 C31 C30 0.4(10) . . . . ?
C27 C28 C29 C30 2.7(13) . . . . ?
C28 C29 C30 C31 -1.5(13) . . . . ?
C29 C30 C31 C26 -0.1(11) . . . . ?
C31 C26 C27 C28 0.7(10) . . . . ?
C32 P1 O1 Pt1 160.8(3) . . . . ?
C32 P1 C24 C19 167.9(4) . . . . ?
C32 P1 C24 C23 -12.6(5) . . . . ?
C32 P1 C26 C27 101.7(5) . . . . ?
C32 P1 C26 C31 -79.9(6) . . . . ?
C32 C33 C34 C35 3.1(12) . . . . ?
C33 C32 C37 C36 1.0(12) . . . . ?
C33 C34 C35 C36 -2.5(13) . . . . ?
C34 C35 C36 C37 1.2(14) . . . . ?
C35 C36 C37 C32 -0.5(14) . . . . ?
C37 C32 C33 C34 -2.3(10) . . . . ?
C38 O4 C40 C41 161.2(10) . . . . ?
C40 O4 C38 O3 -4.7(19) . . . . ?
C40 O4 C38 C39 -176.9(11) . . . . ?

_olex2_date_sample_data_collection 2016-12-03
_olex2_submission_special_instructions 'No special instructions were received'
_oxdiff_exptl_absorpt_empirical_details 
;
Empirical correction (ABSPACK) includes:
- Absorption correction using spherical harmonics
- Frame scaling
;
_oxdiff_exptl_absorpt_empirical_full_max 1.381
_oxdiff_exptl_absorpt_empirical_full_min 0.755
####################################################################### 
# 
# 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_gq-f
_database_code_depnum_ccdc_archive 'CCDC 2032299'
loop_
_audit_author_name
_audit_author_address
'Bin Zhang'
;Zhengzhou University
China
;
_audit_update_record             
;
2020-09-16 deposited with the CCDC.	2021-06-21 downloaded from the CCDC.
;
_audit_creation_date             2020-09-07
_audit_creation_method           
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_shelx_SHELXL_version_number     2014/7
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C36 H25 F N3 O P Pt, C H2 Cl2'
_chemical_formula_sum            'C37 H27 Cl2 F N3 O P Pt'
_chemical_formula_weight         845.57
_chemical_melting_point          ?
_chemical_oxdiff_formula         C20H20N4O2S2Pt1
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'
N N 0.0061 0.0033 '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'
Pt Pt -1.7033 8.3905 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_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.
;
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   11.8502(5)
_cell_length_b                   11.9267(5)
_cell_length_c                   13.1295(5)
_cell_angle_alpha                77.794(3)
_cell_angle_beta                 75.159(4)
_cell_angle_gamma                68.373(4)
_cell_volume                     1653.27(13)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    5398
_cell_measurement_temperature    291(2)
_cell_measurement_theta_max      27.0680
_cell_measurement_theta_min      1.7580
_shelx_estimated_absorpt_T_max   0.593
_shelx_estimated_absorpt_T_min   0.467
_exptl_absorpt_coefficient_mu    4.494
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.45686
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.28 (release 01-02-2013 CrysAlis171 .NET)
(compiled Feb  1 2013,16:14:44)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.699
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       prism
_exptl_crystal_F_000             828
_exptl_crystal_size_max          0.2
_exptl_crystal_size_mid          0.16
_exptl_crystal_size_min          0.13
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0656
_diffrn_reflns_av_unetI/netI     0.0711
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 0.994
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_number            14538
_diffrn_reflns_point_group_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 0.994
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         26.733
_diffrn_reflns_theta_min         1.618
_diffrn_ambient_temperature      291.15
_diffrn_detector_area_resol_mean 16.2312
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 0.994
_diffrn_measurement_details      
;
#__ type_ start__ end____ width___ exp.time_
  1 omega  -25.00   24.00   1.0000    2.0000
omega____ theta____ kappa____ phi______ frames
    -      -15.3317  -99.0000 -180.0000 49

#__ type_ start__ end____ width___ exp.time_
  2 omega  -25.00   20.00   1.0000    2.0000
omega____ theta____ kappa____ phi______ frames
    -      -15.3317  -99.0000   30.0000 45

#__ type_ start__ end____ width___ exp.time_
  3 omega  -25.00    0.00   1.0000    2.0000
omega____ theta____ kappa____ phi______ frames
    -      -15.3317  -57.0000    0.0000 25

#__ type_ start__ end____ width___ exp.time_
  4 omega  -49.00  -20.00   1.0000    2.0000
omega____ theta____ kappa____ phi______ frames
    -       18.0661  -57.0000 -120.0000 29

#__ type_ start__ end____ width___ exp.time_
  5 omega   -1.00   87.00   1.0000    2.0000
omega____ theta____ kappa____ phi______ frames
    -       18.0661   37.0000   60.0000 88

#__ type_ start__ end____ width___ exp.time_
  6 omega   -9.00   86.00   1.0000    2.0000
omega____ theta____ kappa____ phi______ frames
    -       18.0661   77.0000  150.0000 95

#__ type_ start__ end____ width___ exp.time_
  7 omega  -47.00   34.00   1.0000    2.0000
omega____ theta____ kappa____ phi______ frames
    -       18.0661  -57.0000  -90.0000 81
;
_diffrn_measurement_device_type  'Xcalibur, Eos, Gemini'
_diffrn_measurement_method       'ω scans'
_diffrn_orient_matrix_UB_11      0.0000148000
_diffrn_orient_matrix_UB_12      0.0536207000
_diffrn_orient_matrix_UB_13      -0.0358288000
_diffrn_orient_matrix_UB_21      0.0524726000
_diffrn_orient_matrix_UB_22      0.0001166000
_diffrn_orient_matrix_UB_23      0.0164748000
_diffrn_orient_matrix_UB_31      0.0394761000
_diffrn_orient_matrix_UB_32      -0.0358915000
_diffrn_orient_matrix_UB_33      -0.0402768000
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   'Enhance (Mo) X-ray Source'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                6001
_reflns_number_total             6972
_reflns_odcompleteness_completeness 99.99
_reflns_odcompleteness_iscentric 1
_reflns_odcompleteness_theta     26.32
_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.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.28 (release 01-02-2013 CrysAlis171 .NET)
(compiled Feb  1 2013,16:14:44)
;
_computing_data_collection       
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.28 (release 01-02-2013 CrysAlis171 .NET)
(compiled Feb  1 2013,16:14:44)
;
_computing_data_reduction        
;
CrysAlisPro, Agilent Technologies,
Version 1.171.36.28 (release 01-02-2013 CrysAlis171 .NET)
(compiled Feb  1 2013,16:14:44)
;
_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    ?
_refine_diff_density_max         1.427
_refine_diff_density_min         -1.343
_refine_diff_density_rms         0.234
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.037
_refine_ls_hydrogen_treatment    noref
_refine_ls_matrix_type           full
_refine_ls_number_parameters     415
_refine_ls_number_reflns         6972
_refine_ls_number_restraints     6
_refine_ls_R_factor_all          0.0517
_refine_ls_R_factor_gt           0.0370
_refine_ls_restrained_S_all      1.040
_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)+(0.0337P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0735
_refine_ls_wR_factor_ref         0.0796
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
2. Uiso/Uaniso restraints and constraints
Uanis(C37) \\sim Ueq: with sigma of 0.01 and sigma for terminal atoms of 0.01
3.a Secondary CH2 refined with riding coordinates:
 C37(H37B,H37A)
3.b Aromatic/amide H refined with riding coordinates:
 C2(H2), C3(H3), C4(H4), C5(H5), C8(H8), C9(H9), C10(H10), C11(H11), C13(H13),
 C14(H14), C15(H15), C16(H16), C20(H20), C21(H21), C23(H23), C26(H26), C27(H27),
  C28(H28), C29(H29), C30(H30), C32(H32), C33(H33), C34(H34), C35(H35), C36(H36)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
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 0.91316(2) 0.79205(2) 0.55115(2) 0.02945(7) Uani 1 1 d . . . . .
P1 P 0.78352(11) 0.72131(11) 0.78932(10) 0.0334(3) Uani 1 1 d . . . . .
F1 F 0.6536(3) 0.4677(3) 0.3496(3) 0.0675(10) Uani 1 1 d . . . . .
O1 O 0.9050(3) 0.7229(3) 0.7170(3) 0.0411(8) Uani 1 1 d . . . . .
N1 N 1.0712(3) 0.8260(3) 0.5372(3) 0.0312(9) Uani 1 1 d . . . . .
N2 N 0.7583(3) 0.7548(3) 0.5574(3) 0.0312(9) Uani 1 1 d . . . . .
N3 N 0.5548(3) 0.7799(4) 0.5741(3) 0.0376(10) Uani 1 1 d . . . . .
C1 C 0.9322(4) 0.8621(4) 0.4007(4) 0.0333(11) Uani 1 1 d . . . . .
C2 C 0.8541(5) 0.8827(4) 0.3304(4) 0.0416(12) Uani 1 1 d . . . . .
H2 H 0.7832 0.8607 0.3535 0.050 Uiso 1 1 calc R . . . .
C3 C 0.8812(5) 0.9359(5) 0.2257(5) 0.0546(15) Uani 1 1 d . . . . .
H3 H 0.8274 0.9496 0.1802 0.066 Uiso 1 1 calc R . . . .
C4 C 0.9853(6) 0.9681(5) 0.1888(5) 0.0559(15) Uani 1 1 d . . . . .
H4 H 1.0022 1.0034 0.1189 0.067 Uiso 1 1 calc R . . . .
C5 C 1.0660(5) 0.9475(5) 0.2568(4) 0.0462(13) Uani 1 1 d . . . . .
H5 H 1.1373 0.9686 0.2322 0.055 Uiso 1 1 calc R . . . .
C6 C 1.0400(4) 0.8955(4) 0.3615(4) 0.0332(11) Uani 1 1 d . . . . .
C7 C 1.1175(4) 0.8734(4) 0.4384(4) 0.0307(10) Uani 1 1 d . . . . .
C8 C 1.2289(4) 0.8941(4) 0.4204(5) 0.0429(13) Uani 1 1 d . . . . .
H8 H 1.2613 0.9259 0.3530 0.051 Uiso 1 1 calc R . . . .
C9 C 1.2921(5) 0.8675(5) 0.5026(5) 0.0471(14) Uani 1 1 d . . . . .
H9 H 1.3667 0.8818 0.4909 0.056 Uiso 1 1 calc R . . . .
C10 C 1.2438(5) 0.8201(5) 0.6010(5) 0.0460(13) Uani 1 1 d . . . . .
H10 H 1.2857 0.8011 0.6566 0.055 Uiso 1 1 calc R . . . .
C11 C 1.1334(4) 0.8009(4) 0.6170(4) 0.0371(11) Uani 1 1 d . . . . .
H11 H 1.1002 0.7698 0.6843 0.045 Uiso 1 1 calc R . . . .
C12 C 0.6584(4) 0.8617(4) 0.7705(4) 0.0340(11) Uani 1 1 d . . . . .
C13 C 0.6167(5) 0.9421(5) 0.8470(4) 0.0438(13) Uani 1 1 d . . . . .
H13 H 0.6532 0.9223 0.9062 0.053 Uiso 1 1 calc R . . . .
C14 C 0.5200(5) 1.0524(5) 0.8338(5) 0.0552(16) Uani 1 1 d . . . . .
H14 H 0.4953 1.1077 0.8822 0.066 Uiso 1 1 calc R . . . .
C15 C 0.4620(5) 1.0784(5) 0.7502(5) 0.0515(15) Uani 1 1 d . . . . .
H15 H 0.3956 1.1501 0.7436 0.062 Uiso 1 1 calc R . . . .
C16 C 0.5006(4) 1.0002(4) 0.6757(4) 0.0436(13) Uani 1 1 d . . . . .
H16 H 0.4592 1.0192 0.6198 0.052 Uiso 1 1 calc R . . . .
C17 C 0.6003(4) 0.8933(4) 0.6822(4) 0.0317(10) Uani 1 1 d . . . . .
C18 C 0.6377(4) 0.8115(4) 0.6018(4) 0.0330(11) Uani 1 1 d . . . . .
C19 C 0.7518(4) 0.6739(4) 0.4987(4) 0.0315(10) Uani 1 1 d . . . . .
C20 C 0.8443(5) 0.5880(4) 0.4408(4) 0.0386(12) Uani 1 1 d . . . . .
H20 H 0.9273 0.5782 0.4340 0.046 Uiso 1 1 calc R . . . .
C21 C 0.8082(5) 0.5172(5) 0.3936(4) 0.0432(13) Uani 1 1 d . . . . .
H21 H 0.8673 0.4563 0.3557 0.052 Uiso 1 1 calc R . . . .
C22 C 0.6831(5) 0.5378(4) 0.4030(4) 0.0400(12) Uani 1 1 d . . . . .
C23 C 0.5903(5) 0.6201(4) 0.4587(4) 0.0420(12) Uani 1 1 d . . . . .
H23 H 0.5076 0.6297 0.4634 0.050 Uiso 1 1 calc R . . . .
C24 C 0.6258(4) 0.6910(4) 0.5092(4) 0.0348(11) Uani 1 1 d . . . . .
C25 C 0.8043(5) 0.6982(4) 0.9235(4) 0.0380(11) Uani 1 1 d . . . . .
C26 C 0.7271(6) 0.6554(5) 1.0089(4) 0.0583(16) Uani 1 1 d . . . . .
H26 H 0.6629 0.6360 0.9969 0.070 Uiso 1 1 calc R . . . .
C27 C 0.7449(8) 0.6414(6) 1.1109(5) 0.077(2) Uani 1 1 d . . . . .
H27 H 0.6924 0.6132 1.1676 0.092 Uiso 1 1 calc R . . . .
C28 C 0.8389(8) 0.6687(7) 1.1287(6) 0.087(2) Uani 1 1 d . . . . .
H28 H 0.8507 0.6590 1.1978 0.105 Uiso 1 1 calc R . . . .
C29 C 0.9153(8) 0.7095(10) 1.0476(6) 0.107(3) Uani 1 1 d . . . . .
H29 H 0.9796 0.7278 1.0607 0.129 Uiso 1 1 calc R . . . .
C30 C 0.8987(6) 0.7244(8) 0.9450(5) 0.082(2) Uani 1 1 d . . . . .
H30 H 0.9522 0.7526 0.8894 0.098 Uiso 1 1 calc R . . . .
C31 C 0.7403(4) 0.5968(4) 0.7732(4) 0.0363(11) Uani 1 1 d . . . . .
C32 C 0.8349(6) 0.4948(5) 0.7407(5) 0.0609(17) Uani 1 1 d . . . . .
H32 H 0.9166 0.4912 0.7315 0.073 Uiso 1 1 calc R . . . .
C33 C 0.8102(8) 0.3995(6) 0.7220(7) 0.089(3) Uani 1 1 d . . . . .
H33 H 0.8751 0.3312 0.6997 0.106 Uiso 1 1 calc R . . . .
C34 C 0.6896(9) 0.4029(7) 0.7359(6) 0.091(3) Uani 1 1 d . . . . .
H34 H 0.6733 0.3371 0.7231 0.109 Uiso 1 1 calc R . . . .
C35 C 0.5941(7) 0.5035(7) 0.7687(6) 0.082(2) Uani 1 1 d . . . . .
H35 H 0.5127 0.5062 0.7781 0.098 Uiso 1 1 calc R . . . .
C36 C 0.6191(5) 0.6021(5) 0.7879(5) 0.0529(15) Uani 1 1 d . . . . .
H36 H 0.5546 0.6705 0.8104 0.063 Uiso 1 1 calc R . . . .
Cl1 Cl 0.3439(3) 0.8369(4) 0.9801(3) 0.1863(15) Uani 1 1 d . . . . .
Cl2 Cl 0.2537(3) 0.6864(4) 0.9023(3) 0.1754(14) Uani 1 1 d . . . . .
C37 C 0.2651(14) 0.7417(14) 1.0024(12) 0.212(6) Uani 1 1 d . U . . .
H37B H 0.3017 0.6733 1.0522 0.254 Uiso 1 1 calc R . . . .
H37A H 0.1816 0.7829 1.0381 0.254 Uiso 1 1 calc R . . . .


_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
Pt1 O1 2.150(3) . ?
Pt1 N1 2.015(4) . ?
Pt1 N2 2.020(4) . ?
Pt1 C1 1.965(5) . ?
P1 O1 1.513(3) . ?
P1 C12 1.801(5) . ?
P1 C25 1.791(5) . ?
P1 C31 1.806(5) . ?
F1 C22 1.379(5) . ?
N1 C7 1.363(6) . ?
N1 C11 1.352(6) . ?
N2 C18 1.366(5) . ?
N2 C19 1.391(5) . ?
N3 C18 1.324(6) . ?
N3 C24 1.384(6) . ?
C1 C2 1.394(7) . ?
C1 C6 1.416(6) . ?
C2 H2 0.9300 . ?
C2 C3 1.397(7) . ?
C3 H3 0.9300 . ?
C3 C4 1.367(8) . ?
C4 H4 0.9300 . ?
C4 C5 1.394(8) . ?
C5 H5 0.9300 . ?
C5 C6 1.389(7) . ?
C6 C7 1.455(6) . ?
C7 C8 1.384(6) . ?
C8 H8 0.9300 . ?
C8 C9 1.386(7) . ?
C9 H9 0.9300 . ?
C9 C10 1.367(7) . ?
C10 H10 0.9300 . ?
C10 C11 1.367(7) . ?
C11 H11 0.9300 . ?
C12 C13 1.407(6) . ?
C12 C17 1.412(6) . ?
C13 H13 0.9300 . ?
C13 C14 1.403(7) . ?
C14 H14 0.9300 . ?
C14 C15 1.363(8) . ?
C15 H15 0.9300 . ?
C15 C16 1.370(7) . ?
C16 H16 0.9300 . ?
C16 C17 1.387(6) . ?
C17 C18 1.463(6) . ?
C19 C20 1.379(6) . ?
C19 C24 1.404(6) . ?
C20 H20 0.9300 . ?
C20 C21 1.379(7) . ?
C21 H21 0.9300 . ?
C21 C22 1.387(7) . ?
C22 C23 1.343(7) . ?
C23 H23 0.9300 . ?
C23 C24 1.405(6) . ?
C25 C26 1.389(7) . ?
C25 C30 1.373(8) . ?
C26 H26 0.9300 . ?
C26 C27 1.374(8) . ?
C27 H27 0.9300 . ?
C27 C28 1.355(10) . ?
C28 H28 0.9300 . ?
C28 C29 1.342(10) . ?
C29 H29 0.9300 . ?
C29 C30 1.375(10) . ?
C30 H30 0.9300 . ?
C31 C32 1.374(7) . ?
C31 C36 1.378(7) . ?
C32 H32 0.9300 . ?
C32 C33 1.357(9) . ?
C33 H33 0.9300 . ?
C33 C34 1.379(11) . ?
C34 H34 0.9300 . ?
C34 C35 1.369(10) . ?
C35 H35 0.9300 . ?
C35 C36 1.398(8) . ?
C36 H36 0.9300 . ?
Cl1 C37 1.658(14) . ?
Cl2 C37 1.644(15) . ?
C37 H37B 0.9700 . ?
C37 H37A 0.9700 . ?

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
N1 Pt1 O1 93.02(14) . . ?
N1 Pt1 N2 176.93(14) . . ?
N2 Pt1 O1 89.32(14) . . ?
C1 Pt1 O1 174.48(15) . . ?
C1 Pt1 N1 81.68(18) . . ?
C1 Pt1 N2 96.04(18) . . ?
O1 P1 C12 112.9(2) . . ?
O1 P1 C25 107.5(2) . . ?
O1 P1 C31 111.8(2) . . ?
C12 P1 C31 109.1(2) . . ?
C25 P1 C12 108.2(2) . . ?
C25 P1 C31 107.2(2) . . ?
P1 O1 Pt1 120.68(19) . . ?
C7 N1 Pt1 115.5(3) . . ?
C11 N1 Pt1 124.4(3) . . ?
C11 N1 C7 120.0(4) . . ?
C18 N2 Pt1 130.7(3) . . ?
C18 N2 C19 104.0(4) . . ?
C19 N2 Pt1 124.4(3) . . ?
C18 N3 C24 103.8(4) . . ?
C2 C1 Pt1 128.4(4) . . ?
C2 C1 C6 117.5(5) . . ?
C6 C1 Pt1 114.0(4) . . ?
C1 C2 H2 119.6 . . ?
C1 C2 C3 120.8(5) . . ?
C3 C2 H2 119.6 . . ?
C2 C3 H3 119.4 . . ?
C4 C3 C2 121.2(5) . . ?
C4 C3 H3 119.4 . . ?
C3 C4 H4 120.3 . . ?
C3 C4 C5 119.5(6) . . ?
C5 C4 H4 120.3 . . ?
C4 C5 H5 119.9 . . ?
C6 C5 C4 120.1(5) . . ?
C6 C5 H5 119.9 . . ?
C1 C6 C7 115.3(4) . . ?
C5 C6 C1 121.0(5) . . ?
C5 C6 C7 123.7(4) . . ?
N1 C7 C6 113.4(4) . . ?
N1 C7 C8 119.5(4) . . ?
C8 C7 C6 127.1(5) . . ?
C7 C8 H8 120.0 . . ?
C7 C8 C9 120.1(5) . . ?
C9 C8 H8 120.0 . . ?
C8 C9 H9 120.3 . . ?
C10 C9 C8 119.4(5) . . ?
C10 C9 H9 120.3 . . ?
C9 C10 H10 120.2 . . ?
C11 C10 C9 119.5(5) . . ?
C11 C10 H10 120.2 . . ?
N1 C11 C10 121.6(5) . . ?
N1 C11 H11 119.2 . . ?
C10 C11 H11 119.2 . . ?
C13 C12 P1 118.7(4) . . ?
C13 C12 C17 118.9(4) . . ?
C17 C12 P1 122.4(3) . . ?
C12 C13 H13 120.1 . . ?
C14 C13 C12 119.8(5) . . ?
C14 C13 H13 120.1 . . ?
C13 C14 H14 120.0 . . ?
C15 C14 C13 120.1(5) . . ?
C15 C14 H14 120.0 . . ?
C14 C15 H15 119.7 . . ?
C14 C15 C16 120.7(5) . . ?
C16 C15 H15 119.7 . . ?
C15 C16 H16 119.3 . . ?
C15 C16 C17 121.3(5) . . ?
C17 C16 H16 119.3 . . ?
C12 C17 C18 121.2(4) . . ?
C16 C17 C12 119.0(4) . . ?
C16 C17 C18 119.6(4) . . ?
N2 C18 C17 123.5(4) . . ?
N3 C18 N2 115.5(4) . . ?
N3 C18 C17 120.8(4) . . ?
N2 C19 C24 106.9(4) . . ?
C20 C19 N2 130.7(4) . . ?
C20 C19 C24 122.4(4) . . ?
C19 C20 H20 121.5 . . ?
C19 C20 C21 117.1(5) . . ?
C21 C20 H20 121.5 . . ?
C20 C21 H21 120.3 . . ?
C20 C21 C22 119.4(4) . . ?
C22 C21 H21 120.3 . . ?
F1 C22 C21 116.3(4) . . ?
C23 C22 F1 118.3(5) . . ?
C23 C22 C21 125.3(5) . . ?
C22 C23 H23 122.1 . . ?
C22 C23 C24 115.8(4) . . ?
C24 C23 H23 122.1 . . ?
N3 C24 C19 109.7(4) . . ?
N3 C24 C23 130.4(4) . . ?
C19 C24 C23 119.9(4) . . ?
C26 C25 P1 122.6(4) . . ?
C30 C25 P1 119.8(4) . . ?
C30 C25 C26 117.6(5) . . ?
C25 C26 H26 119.7 . . ?
C27 C26 C25 120.7(6) . . ?
C27 C26 H26 119.7 . . ?
C26 C27 H27 120.1 . . ?
C28 C27 C26 119.9(7) . . ?
C28 C27 H27 120.1 . . ?
C27 C28 H28 119.7 . . ?
C29 C28 C27 120.7(7) . . ?
C29 C28 H28 119.7 . . ?
C28 C29 H29 119.9 . . ?
C28 C29 C30 120.2(8) . . ?
C30 C29 H29 119.9 . . ?
C25 C30 C29 121.0(7) . . ?
C25 C30 H30 119.5 . . ?
C29 C30 H30 119.5 . . ?
C32 C31 P1 116.8(4) . . ?
C32 C31 C36 119.8(5) . . ?
C36 C31 P1 123.3(4) . . ?
C31 C32 H32 119.7 . . ?
C33 C32 C31 120.5(6) . . ?
C33 C32 H32 119.7 . . ?
C32 C33 H33 119.7 . . ?
C32 C33 C34 120.6(7) . . ?
C34 C33 H33 119.7 . . ?
C33 C34 H34 120.1 . . ?
C35 C34 C33 119.7(6) . . ?
C35 C34 H34 120.1 . . ?
C34 C35 H35 120.0 . . ?
C34 C35 C36 119.9(7) . . ?
C36 C35 H35 120.0 . . ?
C31 C36 C35 119.4(6) . . ?
C31 C36 H36 120.3 . . ?
C35 C36 H36 120.3 . . ?
Cl1 C37 H37B 107.4 . . ?
Cl1 C37 H37A 107.4 . . ?
Cl2 C37 Cl1 119.8(9) . . ?
Cl2 C37 H37B 107.4 . . ?
Cl2 C37 H37A 107.4 . . ?
H37B C37 H37A 106.9 . . ?

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
Pt1 N1 C7 C6 2.3(4) . . . . ?
Pt1 N1 C7 C8 -176.9(3) . . . . ?
Pt1 N1 C11 C10 176.5(3) . . . . ?
Pt1 N2 C18 N3 167.0(3) . . . . ?
Pt1 N2 C18 C17 -18.6(7) . . . . ?
Pt1 N2 C19 C20 12.8(7) . . . . ?
Pt1 N2 C19 C24 -168.8(3) . . . . ?
Pt1 C1 C2 C3 178.8(4) . . . . ?
Pt1 C1 C6 C5 -179.3(3) . . . . ?
Pt1 C1 C6 C7 -0.4(5) . . . . ?
P1 C12 C13 C14 179.6(4) . . . . ?
P1 C12 C17 C16 176.9(4) . . . . ?
P1 C12 C17 C18 1.3(6) . . . . ?
P1 C25 C26 C27 -178.6(5) . . . . ?
P1 C25 C30 C29 178.8(7) . . . . ?
P1 C31 C32 C33 -177.0(6) . . . . ?
P1 C31 C36 C35 176.9(5) . . . . ?
F1 C22 C23 C24 -178.5(4) . . . . ?
O1 P1 C12 C13 -104.9(4) . . . . ?
O1 P1 C12 C17 75.5(4) . . . . ?
O1 P1 C25 C26 -159.7(4) . . . . ?
O1 P1 C25 C30 20.9(5) . . . . ?
O1 P1 C31 C32 28.0(5) . . . . ?
O1 P1 C31 C36 -149.4(4) . . . . ?
N1 C7 C8 C9 -0.5(7) . . . . ?
N2 C19 C20 C21 177.7(5) . . . . ?
N2 C19 C24 N3 -0.6(5) . . . . ?
N2 C19 C24 C23 -179.4(4) . . . . ?
C1 C2 C3 C4 0.7(8) . . . . ?
C1 C6 C7 N1 -1.3(5) . . . . ?
C1 C6 C7 C8 177.9(4) . . . . ?
C2 C1 C6 C5 0.4(6) . . . . ?
C2 C1 C6 C7 179.3(4) . . . . ?
C2 C3 C4 C5 0.0(8) . . . . ?
C3 C4 C5 C6 -0.5(8) . . . . ?
C4 C5 C6 C1 0.3(7) . . . . ?
C4 C5 C6 C7 -178.5(5) . . . . ?
C5 C6 C7 N1 177.6(4) . . . . ?
C5 C6 C7 C8 -3.2(7) . . . . ?
C6 C1 C2 C3 -0.9(7) . . . . ?
C6 C7 C8 C9 -179.7(4) . . . . ?
C7 N1 C11 C10 -1.1(6) . . . . ?
C7 C8 C9 C10 0.4(7) . . . . ?
C8 C9 C10 C11 -0.7(7) . . . . ?
C9 C10 C11 N1 1.0(7) . . . . ?
C11 N1 C7 C6 -179.9(4) . . . . ?
C11 N1 C7 C8 0.8(6) . . . . ?
C12 P1 O1 Pt1 -45.3(3) . . . . ?
C12 P1 C25 C26 78.1(5) . . . . ?
C12 P1 C25 C30 -101.2(5) . . . . ?
C12 P1 C31 C32 153.5(4) . . . . ?
C12 P1 C31 C36 -23.9(5) . . . . ?
C12 C13 C14 C15 3.5(9) . . . . ?
C12 C17 C18 N2 -46.5(7) . . . . ?
C12 C17 C18 N3 127.6(5) . . . . ?
C13 C12 C17 C16 -2.7(7) . . . . ?
C13 C12 C17 C18 -178.4(4) . . . . ?
C13 C14 C15 C16 -2.8(9) . . . . ?
C14 C15 C16 C17 -0.8(9) . . . . ?
C15 C16 C17 C12 3.6(7) . . . . ?
C15 C16 C17 C18 179.3(5) . . . . ?
C16 C17 C18 N2 137.8(5) . . . . ?
C16 C17 C18 N3 -48.1(7) . . . . ?
C17 C12 C13 C14 -0.8(7) . . . . ?
C18 N2 C19 C20 -176.5(5) . . . . ?
C18 N2 C19 C24 2.0(5) . . . . ?
C18 N3 C24 C19 -1.1(5) . . . . ?
C18 N3 C24 C23 177.6(5) . . . . ?
C19 N2 C18 N3 -2.9(6) . . . . ?
C19 N2 C18 C17 171.5(4) . . . . ?
C19 C20 C21 C22 2.1(8) . . . . ?
C20 C19 C24 N3 178.0(4) . . . . ?
C20 C19 C24 C23 -0.8(7) . . . . ?
C20 C21 C22 F1 177.0(5) . . . . ?
C20 C21 C22 C23 -2.4(9) . . . . ?
C21 C22 C23 C24 1.0(8) . . . . ?
C22 C23 C24 N3 -177.9(5) . . . . ?
C22 C23 C24 C19 0.7(7) . . . . ?
C24 N3 C18 N2 2.5(6) . . . . ?
C24 N3 C18 C17 -172.0(4) . . . . ?
C24 C19 C20 C21 -0.6(7) . . . . ?
C25 P1 O1 Pt1 -164.5(2) . . . . ?
C25 P1 C12 C13 14.0(5) . . . . ?
C25 P1 C12 C17 -165.7(4) . . . . ?
C25 P1 C31 C32 -89.6(5) . . . . ?
C25 P1 C31 C36 93.0(5) . . . . ?
C25 C26 C27 C28 -0.5(10) . . . . ?
C26 C25 C30 C29 -0.5(11) . . . . ?
C26 C27 C28 C29 0.1(12) . . . . ?
C27 C28 C29 C30 0.1(14) . . . . ?
C28 C29 C30 C25 0.1(14) . . . . ?
C30 C25 C26 C27 0.7(9) . . . . ?
C31 P1 O1 Pt1 78.1(3) . . . . ?
C31 P1 C12 C13 130.3(4) . . . . ?
C31 P1 C12 C17 -49.4(5) . . . . ?
C31 P1 C25 C26 -39.4(5) . . . . ?
C31 P1 C25 C30 141.3(5) . . . . ?
C31 C32 C33 C34 -0.4(12) . . . . ?
C32 C31 C36 C35 -0.5(9) . . . . ?
C32 C33 C34 C35 0.1(13) . . . . ?
C33 C34 C35 C36 0.0(12) . . . . ?
C34 C35 C36 C31 0.2(10) . . . . ?
C36 C31 C32 C33 0.6(9) . . . . ?

_olex2_submission_special_instructions 'No special instructions were received'
