#------------------------------------------------------------------------------
#$Date: 2023-09-05 01:56:10 +0300 (Tue, 05 Sep 2023) $
#$Revision: 285997 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/71/38/7713897.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_7713897
loop_
_publ_author_name
'Luo, Xufeng'
'Ning, Sheng'
'He, Hang'
'Tang, Hao'
'Sheng, Liangjun'
'Shen, Yirui'
'Han, Hua-Bo'
'Xiao, Xunwen'
'Zheng, You-Xuan'
_publ_section_title
;
 Design of Carbazole-based Platinum Complexes with Steric Hindrance for
 Efficient Organic Light-emitting Diodes
;
_journal_name_full               'Dalton Transactions'
_journal_paper_doi               10.1039/D3DT02264A
_journal_year                    2023
_chemical_formula_moiety         '0.11(C41 H38.32 F3 N2 O2 Pt)'
_chemical_formula_sum            'C4.556 H4.258 F0.333 N0.222 O0.222 Pt0.111'
_chemical_formula_weight         93.69
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2yn'
_space_group_name_H-M_alt        'P 1 21/n 1'
_symmetry_Int_Tables_number      14
_audit_creation_date             2022-06-27
_audit_creation_method
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_audit_update_record
;
2023-07-10 deposited with the CCDC.	2023-08-30 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 98.192(2)
_cell_angle_gamma                90
_cell_formula_units_Z            36
_cell_length_a                   8.9905(5)
_cell_length_b                   13.0648(7)
_cell_length_c                   30.8067(16)
_cell_measurement_reflns_used    9952
_cell_measurement_temperature    193(2)
_cell_measurement_theta_max      53.93
_cell_measurement_theta_min      3.20
_cell_volume                     3581.6(3)
_computing_cell_refinement       'SAINT V8.40B (?, 2016)'
_computing_data_reduction        'SAINT V8.40B (?, 2016)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'olex2.refine (Bourhis et al., 2015)'
_diffrn_ambient_temperature      193.0
_diffrn_measured_fraction_theta_full 0.9701
_diffrn_measured_fraction_theta_max 0.9699
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           synchrotron
_diffrn_radiation_wavelength     1.34139
_diffrn_reflns_av_R_equivalents  0.0226
_diffrn_reflns_av_unetI/netI     0.0185
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -6
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       37
_diffrn_reflns_limit_l_min       -37
_diffrn_reflns_number            25460
_diffrn_reflns_theta_full        53.9397
_diffrn_reflns_theta_max         53.94
_diffrn_reflns_theta_min         3.20
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    5.486
_exptl_absorpt_correction_T_max  0.7506
_exptl_absorpt_correction_T_min  0.6022
_exptl_absorpt_correction_type   none
_exptl_absorpt_process_details
;
SADABS-2016/2 (Bruker,2016/2) was used for absorption correction.
wR2(int) was 0.1461 before and 0.0524 after correction.
The Ratio of minimum to maximum transmission is 0.8023.
The λ/2 correction factor is Not present.
;
_exptl_crystal_colour            ORANGE
_exptl_crystal_density_diffrn    1.5636
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       BLOCK
_exptl_crystal_F_000             1659.8038
_refine_diff_density_max         0.7452
_refine_diff_density_min         -0.6609
_refine_diff_density_rms         0.0662
_refine_ls_d_res_high            0.8297
_refine_ls_d_res_low             12.0089
_refine_ls_goodness_of_fit_ref   1.0663
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_constraints    75
_refine_ls_number_parameters     479
_refine_ls_number_reflns         6357
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.0663
_refine_ls_R_factor_all          0.0211
_refine_ls_R_factor_gt           0.0202
_refine_ls_shift/su_max          0.0008
_refine_ls_shift/su_mean         0.0000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0196P)²+4.5498P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0501
_refine_ls_wR_factor_ref         0.0506
_reflns_Friedel_coverage         0.0
_reflns_limit_h_max              9
_reflns_limit_h_min              -10
_reflns_limit_k_max              15
_reflns_limit_k_min              0
_reflns_limit_l_max              37
_reflns_limit_l_min              -8
_reflns_number_gt                6127
_reflns_number_total             6357
_reflns_threshold_expression     I>=2u(I)
_cod_data_source_file            d3dt02264a2.cif
_cod_data_source_block           1111_b
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_database_code               7713897
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2. Others
 Sof(C2a)=Sof(C3a)=Sof(C1a)=Sof(H2aa)=Sof(H2ab)=Sof(H2ac)=Sof(H3aa)=Sof(H3ab)=
 Sof(H3ac)=Sof(H1aa)=Sof(H1ab)=Sof(H1ac)=1-FVAR(1)
 Sof(C2)=Sof(C3)=Sof(C1)=Sof(H1a)=Sof(H1b)=Sof(H1c)=Sof(H2a)=Sof(H2b)=Sof(H2c)=
 FVAR(1)
3.a Aromatic/amide H refined with riding coordinates:
 C007(H007), C00J(H00J), C00K(H00K), C00M(H00M), C00O(H00O), C00P(H00P),
 C00Q(H00Q), C00R(H00R), C00S(H00S), C00T(H00T), C00V(H00V), C00W(H00W),
 C00X(H00X), C00Y(H00Y), C010(H010), C011(H011), C012(H012), C013(H013),
 C014(H014)
3.b Idealised Me refined as rotating group:
 C018(H01a,H01b,H01c), C019(H01d,H01e,H01f), C01A(H01g,H01h,H01i), C3(H3a,H3b,
 H3c), C1(H1a,H1b,H1c), C2(H2a,H2b,H2c), C2a(H2aa,H2ab,H2ac), C3a(H3aa,H3ab,
 H3ac), C1a(H1aa,H1ab,H1ac)
;
_olex2_submission_special_instructions 'No special instructions were received'
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 x,y,z
2 -x+1/2,y+1/2,-z+1/2
3 -x,-y,-z
4 x-1/2,-y-1/2,z-1/2
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_refinement_flags_posn
_atom_site_disorder_group
Pt01 Pt 0.458598(11) 0.683115(7) 0.268887(3) 0.02273(5) Uani 1.000000 . .
O002 O 0.6221(2) 0.59340(14) 0.25268(5) 0.0308(4) Uani 1.000000 . .
O003 O 0.4338(2) 0.75050(14) 0.20725(6) 0.0326(4) Uani 1.000000 . .
N004 N 0.3129(2) 0.77572(16) 0.29191(7) 0.0267(4) Uani 1.000000 . .
N005 N 0.2282(2) 0.63136(15) 0.42002(6) 0.0250(4) Uani 1.000000 . .
C006 C 0.3626(3) 0.66852(17) 0.35346(8) 0.0234(5) Uani 1.000000 . .
C007 C 0.6193(3) 0.6509(2) 0.17906(9) 0.0371(6) Uani 1.000000 . .
H007 H 0.6641(3) 0.6393(2) 0.15337(9) 0.0445(8) Uiso 1.000000 R .
C008 C 0.4597(3) 0.62085(18) 0.32682(8) 0.0250(5) Uani 1.000000 . .
C009 C 0.3041(3) 0.76785(18) 0.33614(8) 0.0244(5) Uani 1.000000 . .
C00A C 0.5057(3) 0.7257(2) 0.17622(9) 0.0350(6) Uani 1.000000 . .
C00B C 0.3655(3) 0.48982(19) 0.44435(8) 0.0260(5) Uani 1.000000 . .
C00C C 0.3323(3) 0.61358(18) 0.39077(8) 0.0230(5) Uani 1.000000 . .
C00D C 0.4167(3) 0.52565(18) 0.40466(8) 0.0252(5) Uani 1.000000 . .
C00E C 0.6724(3) 0.5925(2) 0.21548(8) 0.0335(6) Uani 1.000000 . .
F00F F 0.4951(3) 0.9218(2) 0.56355(7) 0.0887(8) Uani 1.000000 . .
C00G C 0.2511(3) 0.55527(19) 0.45291(8) 0.0255(5) Uani 1.000000 . .
C00H C 0.0826(3) 0.67538(17) 0.40767(9) 0.0268(5) Uani 1.000000 . .
C00I C 0.2547(3) 0.85418(19) 0.35777(9) 0.0282(5) Uani 1.000000 . .
C00J C -0.1293(3) 0.7692(2) 0.42634(12) 0.0454(8) Uani 1.000000 . .
H00J H -0.1759(3) 0.8070(2) 0.44705(12) 0.0545(9) Uiso 1.000000 R .
C00K C 0.2508(3) 0.8544(2) 0.26805(9) 0.0351(6) Uani 1.000000 . .
H00K H 0.2540(3) 0.8555(2) 0.23736(9) 0.0421(7) Uiso 1.000000 R .
F00L F 0.2934(4) 1.0001(3) 0.55876(8) 0.1253(13) Uani 1.000000 . .
C00M C 0.2217(3) 0.4591(2) 0.51657(9) 0.0363(6) Uani 1.000000 . .
H00M H 0.1742(3) 0.4480(2) 0.54179(9) 0.0436(7) Uiso 1.000000 R .
C00N C 0.2800(3) 0.86947(19) 0.40619(9) 0.0308(6) Uani 1.000000 . .
C00O C -0.2052(3) 0.7529(2) 0.38500(12) 0.0494(8) Uani 1.000000 . .
H00O H -0.3040(3) 0.7790(2) 0.37728(12) 0.0592(10) Uiso 1.000000 R .
C00P C 0.1765(3) 0.5407(2) 0.48939(8) 0.0323(6) Uani 1.000000 . .
H00P H 0.0980(3) 0.5851(2) 0.49517(8) 0.0387(7) Uiso 1.000000 R .
C00Q C 0.0152(3) 0.7310(2) 0.43816(10) 0.0350(6) Uani 1.000000 . .
H00Q H 0.0674(3) 0.7427(2) 0.46677(10) 0.0420(7) Uiso 1.000000 R .
C00R C 0.0052(3) 0.6596(2) 0.36596(9) 0.0320(6) Uani 1.000000 . .
H00R H 0.0507(3) 0.6218(2) 0.34502(9) 0.0384(7) Uiso 1.000000 R .
C00S C 0.4052(3) 0.82964(19) 0.43238(9) 0.0336(6) Uani 1.000000 . .
H00S H 0.4753(3) 0.78982(19) 0.41930(9) 0.0403(7) Uiso 1.000000 R .
C00T C 0.5388(3) 0.53192(19) 0.34091(8) 0.0291(5) Uani 1.000000 . .
H00T H 0.6051(3) 0.50230(19) 0.32303(8) 0.0349(6) Uiso 1.000000 R .
F00U F 0.3018(5) 0.8371(2) 0.56482(8) 0.1294(15) Uani 1.000000 . .
C00V C 0.3352(3) 0.3927(2) 0.50800(9) 0.0345(6) Uani 1.000000 . .
H00V H 0.3630(3) 0.3369(2) 0.52723(9) 0.0414(7) Uiso 1.000000 R .
C00W C 0.4078(3) 0.4070(2) 0.47187(8) 0.0306(5) Uani 1.000000 . .
H00W H 0.4848(3) 0.3615(2) 0.46591(8) 0.0367(7) Uiso 1.000000 R .
C00X C 0.1912(3) 0.9349(2) 0.33169(10) 0.0385(7) Uani 1.000000 . .
H00X H 0.1529(3) 0.9924(2) 0.34539(10) 0.0462(8) Uiso 1.000000 R .
C00Y C 0.5221(3) 0.48659(19) 0.38027(8) 0.0291(5) Uani 1.000000 . .
H00Y H 0.5820(3) 0.42930(19) 0.39060(8) 0.0350(6) Uiso 1.000000 R .
C00Z C 0.3296(4) 0.9055(2) 0.49654(10) 0.0449(8) Uani 1.000000 . .
C010 C 0.4298(4) 0.8468(2) 0.47712(10) 0.0408(7) Uani 1.000000 . .
H010 H 0.5156(4) 0.8183(2) 0.49451(10) 0.0490(8) Uiso 1.000000 R .
C011 C -0.1381(3) 0.6988(2) 0.35479(12) 0.0450(7) Uani 1.000000 . .
H011 H -0.1904(3) 0.6883(2) 0.32610(12) 0.0540(9) Uiso 1.000000 R .
C012 C 0.1827(3) 0.9336(2) 0.28679(10) 0.0418(7) Uani 1.000000 . .
H012 H 0.1311(3) 0.9859(2) 0.26928(10) 0.0502(8) Uiso 1.000000 R .
C013 C 0.1821(3) 0.9312(2) 0.42623(10) 0.0391(7) Uani 1.000000 . .
H013 H 0.0973(3) 0.9611(2) 0.40891(10) 0.0470(8) Uiso 1.000000 R .
C014 C 0.2074(4) 0.9492(2) 0.47086(11) 0.0485(8) Uani 1.000000 . .
H014 H 0.1405(4) 0.9917(2) 0.48396(11) 0.0582(10) Uiso 1.000000 R .
C015 C 0.3510(5) 0.9158(3) 0.54573(12) 0.0639(11) Uani 1.000000 . .
C016 C 0.4627(5) 0.7852(3) 0.13386(10) 0.0645(11) Uani 1.000000 . .
C017 C 0.8035(4) 0.5177(3) 0.21553(9) 0.0540(9) Uani 1.000000 . .
C018 C 0.8570(5) 0.5055(3) 0.17127(11) 0.0685(12) Uani 1.000000 . .
H01a H 0.7730(10) 0.483(2) 0.1495(2) 0.1028(18) Uiso 1.000000 GR .
H01b H 0.895(3) 0.5711(7) 0.1622(5) 0.1028(18) Uiso 1.000000 GR .
H01c H 0.937(2) 0.4543(17) 0.1735(3) 0.1028(18) Uiso 1.000000 GR .
C019 C 0.9283(5) 0.5498(6) 0.24982(16) 0.120(3) Uani 1.000000 . .
H01d H 0.966(4) 0.6170(18) 0.2423(9) 0.179(4) Uiso 1.000000 GR .
H01e H 0.8916(16) 0.554(4) 0.2782(3) 0.179(4) Uiso 1.000000 GR .
H01f H 1.010(2) 0.500(2) 0.2515(12) 0.179(4) Uiso 1.000000 GR .
C01A C 0.7472(6) 0.4094(4) 0.22775(17) 0.0966(18) Uani 1.000000 . .
H01g H 0.711(4) 0.4129(8) 0.2562(6) 0.145(3) Uiso 1.000000 GR .
H01h H 0.665(3) 0.3873(14) 0.2053(7) 0.145(3) Uiso 1.000000 GR .
H01i H 0.8302(13) 0.3604(7) 0.2294(13) 0.145(3) Uiso 1.000000 GR .
C1 C 0.3668(11) 0.8727(8) 0.1405(3) 0.057(3) Uani 0.559(8) . 1
C2 C 0.4191(11) 0.7198(7) 0.0975(3) 0.055(2) Uani 0.559(8) . 1
C3 C 0.6255(7) 0.8411(5) 0.1247(2) 0.0529(19) Uani 0.559(8) . 1
H3a H 0.6663(16) 0.8821(16) 0.1503(4) 0.079(3) Uiso 1.000000 GR .
H3b H 0.6982(12) 0.7881(5) 0.1196(8) 0.079(3) Uiso 1.000000 GR .
H3c H 0.6063(9) 0.8855(16) 0.0989(5) 0.079(3) Uiso 1.000000 GR .
C2a C 0.500(2) 0.7428(13) 0.0929(4) 0.091(5) Uani 0.441(8) . 2
C3a C 0.4395(15) 0.8910(10) 0.1390(4) 0.058(3) Uani 0.441(8) . 2
C1a C 0.2586(10) 0.7478(7) 0.1222(3) 0.068(3) Uani 0.441(8) . 2
H1a H 0.413(3) 0.913(2) 0.1657(10) 0.085(4) Uiso 0.559(8) GR 1
H1b H 0.355(5) 0.916(2) 0.1142(7) 0.085(4) Uiso 0.559(8) GR 1
H1c H 0.268(2) 0.8482(8) 0.1459(17) 0.085(4) Uiso 0.559(8) GR 1
H2a H 0.328(3) 0.682(3) 0.1020(8) 0.083(3) Uiso 0.559(8) GR 1
H2b H 0.399(5) 0.7608(7) 0.0707(4) 0.083(3) Uiso 0.559(8) GR 1
H2c H 0.500(2) 0.671(2) 0.0947(10) 0.083(3) Uiso 0.559(8) GR 1
H2aa H 0.446(8) 0.780(5) 0.0681(4) 0.136(8) Uiso 0.441(8) GR 2
H2ab H 0.608(3) 0.749(6) 0.0924(13) 0.136(8) Uiso 0.441(8) GR 2
H2ac H 0.471(9) 0.670(2) 0.0908(14) 0.136(8) Uiso 0.441(8) GR 2
H3aa H 0.398(7) 0.9208(13) 0.1107(6) 0.087(5) Uiso 0.441(8) GR 2
H3ab H 0.369(5) 0.9017(10) 0.1601(16) 0.087(5) Uiso 0.441(8) GR 2
H3ac H 0.5355(19) 0.9241(12) 0.150(2) 0.087(5) Uiso 0.441(8) GR 2
H1aa H 0.207(2) 0.769(5) 0.1468(10) 0.102(5) Uiso 0.441(8) GR 2
H1ab H 0.212(2) 0.782(4) 0.0954(13) 0.102(5) Uiso 0.441(8) GR 2
H1ac H 0.2506(11) 0.6735(10) 0.118(2) 0.102(5) Uiso 0.441(8) GR 2
loop_
_atom_type_symbol
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_Cromer_Mann_a1
_atom_type_scat_Cromer_Mann_a2
_atom_type_scat_Cromer_Mann_a3
_atom_type_scat_Cromer_Mann_a4
_atom_type_scat_Cromer_Mann_b1
_atom_type_scat_Cromer_Mann_b2
_atom_type_scat_Cromer_Mann_b3
_atom_type_scat_Cromer_Mann_b4
_atom_type_scat_Cromer_Mann_c
_atom_type_scat_source
_atom_type_scat_dispersion_source
C 0.01480 0.00700 2.31000 1.02000 1.58860 0.86500 20.84390 10.20750 0.56870
51.65120 0.215599998832
'International Tables Volume C Table 6.1.1.4 (pp. 500-502)' custom
Pt -5.24590 5.82200 27.00590 17.76390 15.71310 5.78370 1.51293 8.81174 0.42459
38.61030 11.6883001328
'International Tables Volume C Table 6.1.1.4 (pp. 500-502)' custom
F 0.05990 0.04110 3.53920 2.64120 1.51700 1.02430 10.28250 4.29440 0.26150
26.14760 0.277599990368
'International Tables Volume C Table 6.1.1.4 (pp. 500-502)' custom
H -0.00000 0.00000 0.49300 0.32291 0.14019 0.04081 10.51090 26.12570 3.14236
57.79970 0.0030380000826
'International Tables Volume C Table 6.1.1.4 (pp. 500-502)' custom
O 0.04120 0.02500 3.04850 2.28680 1.54630 0.86700 13.27710 5.70110 0.32390
32.90890 0.250800013542
'International Tables Volume C Table 6.1.1.4 (pp. 500-502)' custom
N 0.02530 0.01360 12.21260 3.13220 2.01250 1.16630 0.00570 9.89330 28.99750
0.58260 -11.5290002823
'International Tables Volume C Table 6.1.1.4 (pp. 500-502)' custom
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
O003 Pt01 O002 90.41(7) . . ?
N004 Pt01 O002 172.87(8) . . ?
N004 Pt01 O003 94.48(8) . . ?
C008 Pt01 O002 94.33(8) . . ?
C008 Pt01 O003 174.15(8) . . ?
C008 Pt01 N004 81.13(9) . . ?
C00E O002 Pt01 126.18(17) . . ?
C00A O003 Pt01 125.49(17) . . ?
C009 N004 Pt01 116.13(16) . . ?
C00K N004 Pt01 121.08(17) . . ?
C00K N004 C009 121.4(2) . . ?
C00G N005 C00C 107.46(19) . . ?
C00H N005 C00C 124.2(2) . . ?
C00H N005 C00G 120.53(19) . . ?
C009 C006 C008 113.2(2) . . ?
C00C C006 C008 116.8(2) . . ?
C00C C006 C009 129.9(2) . . ?
C00E C007 C00A 126.6(2) . . ?
C006 C008 Pt01 114.79(17) . . ?
C00T C008 Pt01 124.33(17) . . ?
C00T C008 C006 120.7(2) . . ?
C006 C009 N004 110.9(2) . . ?
C00I C009 N004 118.2(2) . . ?
C00I C009 C006 130.7(2) . . ?
C007 C00A O003 125.0(2) . . ?
C016 C00A O003 114.9(3) . . ?
C016 C00A C007 120.1(2) . . ?
C00G C00B C00D 107.1(2) . . ?
C00W C00B C00D 132.4(2) . . ?
C00W C00B C00G 120.5(2) . . ?
C006 C00C N005 131.2(2) . . ?
C00D C00C N005 108.6(2) . . ?
C00D C00C C006 120.2(2) . . ?
C00C C00D C00B 107.4(2) . . ?
C00Y C00D C00B 131.6(2) . . ?
C00Y C00D C00C 121.0(2) . . ?
C007 C00E O002 126.2(2) . . ?
C017 C00E O002 111.8(2) . . ?
C017 C00E C007 121.9(2) . . ?
C00B C00G N005 109.4(2) . . ?
C00P C00G N005 129.2(2) . . ?
C00P C00G C00B 121.3(2) . . ?
C00Q C00H N005 120.0(2) . . ?
C00R C00H N005 120.4(2) . . ?
C00R C00H C00Q 119.6(3) . . ?
C00N C00I C009 124.4(2) . . ?
C00X C00I C009 117.5(2) . . ?
C00X C00I C00N 117.8(2) . . ?
C00Q C00J C00O 120.6(3) . . ?
C012 C00K N004 121.6(3) . . ?
C00V C00M C00P 121.8(2) . . ?
C00S C00N C00I 121.8(2) . . ?
C013 C00N C00I 120.2(3) . . ?
C013 C00N C00S 117.9(3) . . ?
C011 C00O C00J 120.0(3) . . ?
C00M C00P C00G 117.3(2) . . ?
C00J C00Q C00H 119.4(3) . . ?
C011 C00R C00H 120.1(3) . . ?
C010 C00S C00N 121.3(3) . . ?
C00Y C00T C008 121.1(2) . . ?
C00W C00V C00M 120.7(2) . . ?
C00V C00W C00B 118.5(2) . . ?
C012 C00X C00I 121.9(2) . . ?
C00T C00Y C00D 119.2(2) . . ?
C014 C00Z C010 119.7(3) . . ?
C015 C00Z C010 119.2(3) . . ?
C015 C00Z C014 121.1(3) . . ?
C00Z C010 C00S 120.0(3) . . ?
C00R C011 C00O 120.3(3) . . ?
C00X C012 C00K 118.0(3) . . ?
C014 C013 C00N 120.8(3) . . ?
C013 C014 C00Z 120.2(3) . . ?
F00L C015 F00F 103.2(3) . . ?
F00U C015 F00F 103.6(4) . . ?
F00U C015 F00L 110.8(3) . . ?
C00Z C015 F00F 113.3(3) . . ?
C00Z C015 F00L 112.7(4) . . ?
C00Z C015 F00U 112.6(3) . . ?
C2 C016 C1 118.6(7) . . ?
C3 C016 C1 103.1(5) . . ?
C3 C016 C2 106.0(5) . . ?
C3a C016 C2a 121.7(9) . . ?
C1a C016 C2a 94.2(9) . . ?
C1a C016 C3a 96.9(7) . . ?
C018 C017 C00E 114.2(3) . . ?
C019 C017 C00E 108.9(3) . . ?
C019 C017 C018 111.3(3) . . ?
C01A C017 C00E 107.6(3) . . ?
C01A C017 C018 106.0(3) . . ?
C01A C017 C019 108.7(4) . . ?
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
Pt01 O002 1.9983(17) . ?
Pt01 O003 2.0761(17) . ?
Pt01 N004 1.987(2) . ?
Pt01 C008 1.960(2) . ?
O002 C00E 1.291(3) . ?
O003 C00A 1.270(3) . ?
N004 C009 1.380(3) . ?
N004 C00K 1.339(3) . ?
N005 C00C 1.408(3) . ?
N005 C00G 1.414(3) . ?
N005 C00H 1.431(3) . ?
C006 C008 1.424(3) . ?
C006 C009 1.472(3) . ?
C006 C00C 1.414(3) . ?
C007 C00A 1.407(4) . ?
C007 C00E 1.384(4) . ?
C008 C00T 1.398(3) . ?
C009 C00I 1.414(3) . ?
C00A C016 1.521(4) . ?
C00B C00D 1.444(3) . ?
C00B C00G 1.391(4) . ?
C00B C00W 1.394(4) . ?
C00C C00D 1.409(3) . ?
C00D C00Y 1.388(3) . ?
C00E C017 1.531(4) . ?
F00F C015 1.335(5) . ?
C00G C00P 1.401(3) . ?
C00H C00Q 1.393(4) . ?
C00H C00R 1.386(4) . ?
C00I C00N 1.490(4) . ?
C00I C00X 1.398(4) . ?
C00J C00O 1.373(5) . ?
C00J C00Q 1.391(4) . ?
C00K C012 1.370(4) . ?
F00L C015 1.305(5) . ?
C00M C00P 1.380(4) . ?
C00M C00V 1.394(4) . ?
C00N C00S 1.389(4) . ?
C00N C013 1.401(4) . ?
C00O C011 1.374(5) . ?
C00R C011 1.384(4) . ?
C00S C010 1.383(4) . ?
C00T C00Y 1.377(3) . ?
F00U C015 1.294(4) . ?
C00V C00W 1.381(4) . ?
C00X C012 1.374(4) . ?
C00Z C010 1.382(4) . ?
C00Z C014 1.383(5) . ?
C00Z C015 1.506(5) . ?
C013 C014 1.381(4) . ?
C016 C1 1.464(10) . ?
C016 C2 1.419(9) . ?
C016 C3 1.695(7) . ?
C016 C2a 1.460(12) . ?
C016 C3a 1.410(14) . ?
C016 C1a 1.883(10) . ?
C017 C018 1.518(4) . ?
C017 C019 1.488(6) . ?
C017 C01A 1.567(6) . ?
