# Electronic Supplementary Material (ESI) for Dalton Transactions.
# This journal is © The Royal Society of Chemistry 2015

####################################################################### 
# 
# 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_complex3_jb389new
_database_code_depnum_ccdc_archive 'CCDC 1055085'
_audit_update_record             
;
2015-03-19 deposited with the CCDC.
2015-08-06 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2013
_chemical_name_systematic        
;
 ?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         '2(C24 H34 F2 N P Pt), 0.5(C6 H6), 2(F H)'
_chemical_formula_sum            'C51 H73 F6 N2 P2 Pt2'
_chemical_formula_weight         1280.23

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'
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'
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'

_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'

_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.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   12.3525(8)
_cell_length_b                   15.2450(11)
_cell_length_c                   15.4423(11)
_cell_angle_alpha                80.643(2)
_cell_angle_beta                 68.402(2)
_cell_angle_gamma                68.157(2)
_cell_volume                     2508.6(3)
_cell_formula_units_Z            2
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    9022
_cell_measurement_theta_min      2.71
_cell_measurement_theta_max      26.12

_exptl_crystal_description       block
_exptl_crystal_colour            'light yellow'
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.695
_exptl_crystal_F_000             1266
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.010
_exptl_crystal_size_mid          0.010
_exptl_crystal_size_min          0.008
_exptl_absorpt_coefficient_mu    5.692
_shelx_estimated_absorpt_T_min   0.946
_shelx_estimated_absorpt_T_max   0.959
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.945
_exptl_absorpt_correction_T_max  0.955
_exptl_absorpt_process_details   'Bruker ALPEX2'


_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      100(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  'BRUKER D8 VENTURE'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            71097
_diffrn_reflns_av_unetI/netI     0.0161
_diffrn_reflns_av_R_equivalents  0.0276
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_theta_min         2.715
_diffrn_reflns_theta_max         26.120
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measured_fraction_theta_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.999
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.999
_diffrn_reflns_point_group_measured_fraction_full 0.999
_reflns_number_total             9993
_reflns_number_gt                9381
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_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.
;

_computing_data_collection       'Bruker APEX2'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXS-97 (Sheldrick 2008)'
_computing_structure_refinement  'SHELXL-2013 (Sheldrick 2013)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
;
 ?
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0174P)²+1.4821P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   mixed
_refine_ls_hydrogen_treatment    mixed
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         9993
_refine_ls_number_parameters     588
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0159
_refine_ls_R_factor_gt           0.0139
_refine_ls_wR_factor_ref         0.0334
_refine_ls_wR_factor_gt          0.0326
_refine_ls_goodness_of_fit_ref   1.013
_refine_ls_restrained_S_all      1.013
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000

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 0.24872(2) 0.66781(2) 0.17284(2) 0.00940(2) Uani 1 1 d . . . . .
Pt2 Pt 0.14933(2) 0.19582(2) 0.20670(2) 0.00925(2) Uani 1 1 d . . . . .
P1 P 0.25647(4) 0.77310(3) 0.24798(3) 0.01129(10) Uani 1 1 d . . . . .
P2 P 0.03898(4) 0.34072(3) 0.18255(3) 0.01082(10) Uani 1 1 d . . . . .
F1 F 0.24336(10) 0.57299(8) 0.09165(8) 0.0170(2) Uani 1 1 d . . . . .
F2 F 0.09163(10) 0.50566(8) 0.40236(8) 0.0179(2) Uani 1 1 d . . . . .
F3 F 0.26058(10) 0.06180(8) 0.23902(8) 0.0179(2) Uani 1 1 d . . . . .
F4 F 0.00707(10) 0.04681(8) 0.08930(8) 0.0165(2) Uani 1 1 d . . . . .
F5 F 0.18270(13) 0.03437(11) 0.40204(11) 0.0341(3) Uani 1 1 d . . . . .
F6 F 0.38520(14) 0.45307(11) -0.01561(11) 0.0407(4) Uani 1 1 d . . . . .
H6 H 0.336(3) 0.497(3) 0.026(3) 0.080(13) Uiso 1 1 d . . . . .
H5 H 0.214(3) 0.040(2) 0.342(2) 0.060(11) Uiso 1 1 d . . . . .
N1 N 0.28746(15) 0.75722(12) 0.05043(11) 0.0138(3) Uani 1 1 d . . . . .
N2 N 0.25747(15) 0.25619(12) 0.24510(11) 0.0138(3) Uani 1 1 d . . . . .
C1 C 0.28856(18) 0.86326(14) 0.15739(14) 0.0152(4) Uani 1 1 d . . . . .
H1A H 0.2102 0.9148 0.1586 0.018 Uiso 1 1 calc R U . . .
H1B H 0.3427 0.8907 0.1692 0.018 Uiso 1 1 calc R U . . .
C2 C 0.35193(18) 0.81788(14) 0.06257(14) 0.0163(4) Uani 1 1 d . . . . .
H2A H 0.3529 0.8680 0.0130 0.020 Uiso 1 1 calc R U . . .
H2B H 0.4388 0.7789 0.0559 0.020 Uiso 1 1 calc R U . . .
C3 C 0.16778(19) 0.81778(15) 0.03782(15) 0.0190(4) Uani 1 1 d . . . . .
H3A H 0.1834 0.8590 -0.0177 0.028 Uiso 1 1 calc R U . . .
H3B H 0.1153 0.8565 0.0927 0.028 Uiso 1 1 calc R U . . .
H3C H 0.1258 0.7777 0.0302 0.028 Uiso 1 1 calc R U . . .
C4 C 0.3663(2) 0.70192(16) -0.03463(14) 0.0207(4) Uani 1 1 d . . . . .
H4A H 0.3249 0.6622 -0.0437 0.031 Uiso 1 1 calc R U . . .
H4B H 0.4459 0.6618 -0.0278 0.031 Uiso 1 1 calc R U . . .
H4C H 0.3803 0.7452 -0.0886 0.031 Uiso 1 1 calc R U . . .
C5 C 0.11638(18) 0.83833(14) 0.34026(14) 0.0164(4) Uani 1 1 d . . . . .
H5A H 0.1291 0.8957 0.3522 0.020 Uiso 1 1 calc R U . . .
C6 C 0.00307(19) 0.87229(15) 0.30825(16) 0.0220(5) Uani 1 1 d . . . . .
H6A H -0.0087 0.8177 0.2921 0.033 Uiso 1 1 calc R U . . .
H6B H 0.0163 0.9148 0.2535 0.033 Uiso 1 1 calc R U . . .
H6C H -0.0707 0.9061 0.3587 0.033 Uiso 1 1 calc R U . . .
C7 C 0.0927(2) 0.78086(16) 0.43204(14) 0.0228(5) Uani 1 1 d . . . . .
H7A H 0.0218 0.8205 0.4804 0.034 Uiso 1 1 calc R U . . .
H7B H 0.1662 0.7594 0.4510 0.034 Uiso 1 1 calc R U . . .
H7C H 0.0750 0.7259 0.4236 0.034 Uiso 1 1 calc R U . . .
C8 C 0.38403(18) 0.73117(15) 0.29529(14) 0.0164(4) Uani 1 1 d . . . . .
H8 H 0.3706 0.6789 0.3417 0.020 Uiso 1 1 calc R U . . .
C9 C 0.50859(18) 0.68908(15) 0.21820(16) 0.0209(5) Uani 1 1 d . . . . .
H9A H 0.5301 0.7399 0.1758 0.031 Uiso 1 1 calc R U . . .
H9B H 0.5020 0.6441 0.1834 0.031 Uiso 1 1 calc R U . . .
H9C H 0.5731 0.6564 0.2463 0.031 Uiso 1 1 calc R U . . .
C10 C 0.3885(2) 0.80675(17) 0.34618(16) 0.0234(5) Uani 1 1 d . . . . .
H10A H 0.4537 0.7787 0.3743 0.035 Uiso 1 1 calc R U . . .
H10B H 0.3085 0.8326 0.3951 0.035 Uiso 1 1 calc R U . . .
H10C H 0.4063 0.8576 0.3019 0.035 Uiso 1 1 calc R U . . .
C11 C 0.21492(18) 0.58044(13) 0.28488(13) 0.0128(4) Uani 1 1 d . . . . .
C12 C 0.10346(18) 0.57365(13) 0.33026(13) 0.0132(4) Uani 1 1 d . . . . .
C13 C -0.01852(17) 0.62696(14) 0.32044(14) 0.0138(4) Uani 1 1 d . . . . .
C14 C -0.03158(18) 0.66636(14) 0.23500(14) 0.0145(4) Uani 1 1 d . . . . .
H14 H 0.0398 0.6569 0.1806 0.017 Uiso 1 1 calc R U . . .
C15 C -0.14706(19) 0.71893(14) 0.22859(15) 0.0183(4) Uani 1 1 d . . . . .
H15 H -0.1542 0.7467 0.1704 0.022 Uiso 1 1 calc R U . . .
C16 C -0.25185(19) 0.73111(15) 0.30645(17) 0.0227(5) Uani 1 1 d . . . . .
H16 H -0.3310 0.7672 0.3019 0.027 Uiso 1 1 calc R U . . .
C17 C -0.24136(19) 0.69067(16) 0.39115(16) 0.0250(5) Uani 1 1 d . . . . .
H17 H -0.3137 0.6987 0.4446 0.030 Uiso 1 1 calc R U . . .
C18 C -0.12593(19) 0.63846(15) 0.39869(15) 0.0199(4) Uani 1 1 d . . . . .
H18 H -0.1197 0.6104 0.4571 0.024 Uiso 1 1 calc R U . . .
C19 C 0.32357(18) 0.51814(14) 0.31273(14) 0.0139(4) Uani 1 1 d . . . . .
C20 C 0.43609(18) 0.47323(14) 0.24474(14) 0.0161(4) Uani 1 1 d . . . . .
H20 H 0.4428 0.4821 0.1809 0.019 Uiso 1 1 calc R U . . .
C21 C 0.53786(19) 0.41590(16) 0.26948(17) 0.0240(5) Uani 1 1 d . . . . .
H21 H 0.6132 0.3850 0.2225 0.029 Uiso 1 1 calc R U . . .
C22 C 0.5308(2) 0.40329(16) 0.36178(17) 0.0258(5) Uani 1 1 d . . . . .
H22 H 0.6006 0.3634 0.3785 0.031 Uiso 1 1 calc R U . . .
C23 C 0.4199(2) 0.44995(16) 0.43020(16) 0.0255(5) Uani 1 1 d . . . . .
H23 H 0.4149 0.4432 0.4937 0.031 Uiso 1 1 calc R U . . .
C24 C 0.31825(19) 0.50554(15) 0.40611(15) 0.0199(4) Uani 1 1 d . . . . .
H24 H 0.2430 0.5360 0.4534 0.024 Uiso 1 1 calc R U . . .
C25 C 0.11384(18) 0.41116(14) 0.20923(14) 0.0150(4) Uani 1 1 d . . . . .
H25A H 0.1114 0.4672 0.1664 0.018 Uiso 1 1 calc R U . . .
H25B H 0.0690 0.4335 0.2738 0.018 Uiso 1 1 calc R U . . .
C26 C 0.24725(18) 0.35160(14) 0.19865(15) 0.0168(4) Uani 1 1 d . . . . .
H26A H 0.2968 0.3440 0.1316 0.020 Uiso 1 1 calc R U . . .
H26B H 0.2817 0.3846 0.2263 0.020 Uiso 1 1 calc R U . . .
C27 C 0.39009(18) 0.19660(16) 0.21511(16) 0.0218(5) Uani 1 1 d . . . . .
H27A H 0.4204 0.1873 0.1479 0.033 Uiso 1 1 calc R U . . .
H27B H 0.3999 0.1351 0.2483 0.033 Uiso 1 1 calc R U . . .
H27C H 0.4377 0.2279 0.2293 0.033 Uiso 1 1 calc R U . . .
C28 C 0.2138(2) 0.26428(15) 0.34820(14) 0.0196(4) Uani 1 1 d . . . . .
H28A H 0.2191 0.2017 0.3782 0.029 Uiso 1 1 calc R U . . .
H28B H 0.1277 0.3070 0.3696 0.029 Uiso 1 1 calc R U . . .
H28C H 0.2659 0.2895 0.3646 0.029 Uiso 1 1 calc R U . . .
C29 C 0.03497(18) 0.38053(14) 0.06485(13) 0.0153(4) Uani 1 1 d . . . . .
H29 H -0.0012 0.4511 0.0645 0.018 Uiso 1 1 calc R U . . .
C30 C 0.1663(2) 0.35375(16) -0.00647(14) 0.0213(5) Uani 1 1 d . . . . .
H30A H 0.2078 0.2852 -0.0033 0.032 Uiso 1 1 calc R U . . .
H30B H 0.2131 0.3861 0.0074 0.032 Uiso 1 1 calc R U . . .
H30C H 0.1620 0.3728 -0.0692 0.032 Uiso 1 1 calc R U . . .
C31 C -0.0473(2) 0.34440(16) 0.03741(15) 0.0218(5) Uani 1 1 d . . . . .
H31A H -0.0528 0.3724 -0.0233 0.033 Uiso 1 1 calc R U . . .
H31B H -0.1303 0.3622 0.0844 0.033 Uiso 1 1 calc R U . . .
H31C H -0.0117 0.2754 0.0335 0.033 Uiso 1 1 calc R U . . .
C32 C -0.12246(17) 0.37974(14) 0.26102(14) 0.0143(4) Uani 1 1 d . . . . .
H32 H -0.1649 0.3418 0.2474 0.017 Uiso 1 1 calc R U . . .
C33 C -0.12885(19) 0.35847(15) 0.36259(14) 0.0197(4) Uani 1 1 d . . . . .
H33A H -0.0949 0.3990 0.3801 0.029 Uiso 1 1 calc R U . . .
H33B H -0.0805 0.2920 0.3701 0.029 Uiso 1 1 calc R U . . .
H33C H -0.2153 0.3708 0.4027 0.029 Uiso 1 1 calc R U . . .
C34 C -0.19314(19) 0.48436(15) 0.24543(16) 0.0222(5) Uani 1 1 d . . . . .
H34A H -0.2764 0.5025 0.2921 0.033 Uiso 1 1 calc R U . . .
H34B H -0.1995 0.4940 0.1829 0.033 Uiso 1 1 calc R U . . .
H34C H -0.1487 0.5233 0.2513 0.033 Uiso 1 1 calc R U . . .
C35 C 0.04768(17) 0.13619(13) 0.17553(13) 0.0125(4) Uani 1 1 d . . . . .
C36 C 0.08409(17) 0.09082(14) 0.09737(14) 0.0132(4) Uani 1 1 d . . . . .
C37 C 0.19350(17) 0.07576(13) 0.01194(14) 0.0130(4) Uani 1 1 d . . . . .
C38 C 0.30547(18) 0.07990(14) 0.01051(15) 0.0176(4) Uani 1 1 d . . . . .
H38 H 0.3123 0.0935 0.0658 0.021 Uiso 1 1 calc R U . . .
C39 C 0.40643(19) 0.06426(15) -0.07119(15) 0.0220(5) Uani 1 1 d . . . . .
H39 H 0.4817 0.0679 -0.0716 0.026 Uiso 1 1 calc R U . . .
C40 C 0.3987(2) 0.04331(15) -0.15244(15) 0.0227(5) Uani 1 1 d . . . . .
H40 H 0.4681 0.0330 -0.2082 0.027 Uiso 1 1 calc R U . . .
C41 C 0.2896(2) 0.03756(15) -0.15155(15) 0.0231(5) Uani 1 1 d . . . . .
H41 H 0.2841 0.0225 -0.2068 0.028 Uiso 1 1 calc R U . . .
C42 C 0.18762(19) 0.05359(14) -0.07026(14) 0.0181(4) Uani 1 1 d . . . . .
H42 H 0.1129 0.0495 -0.0705 0.022 Uiso 1 1 calc R U . . .
C43 C -0.07294(17) 0.13798(13) 0.24853(13) 0.0125(4) Uani 1 1 d . . . . .
C44 C -0.07894(19) 0.10926(14) 0.34000(14) 0.0162(4) Uani 1 1 d . . . . .
H44 H -0.0063 0.0907 0.3563 0.019 Uiso 1 1 calc R U . . .
C45 C -0.1896(2) 0.10739(15) 0.40779(15) 0.0222(5) Uani 1 1 d . . . . .
H45 H -0.1915 0.0854 0.4694 0.027 Uiso 1 1 calc R U . . .
C46 C -0.2974(2) 0.13748(16) 0.38581(16) 0.0255(5) Uani 1 1 d . . . . .
H46 H -0.3732 0.1367 0.4322 0.031 Uiso 1 1 calc R U . . .
C47 C -0.29359(19) 0.16849(16) 0.29598(16) 0.0234(5) Uani 1 1 d . . . . .
H47 H -0.3673 0.1900 0.2807 0.028 Uiso 1 1 calc R U . . .
C48 C -0.18226(18) 0.16838(15) 0.22766(15) 0.0177(4) Uani 1 1 d . . . . .
H48 H -0.1806 0.1893 0.1659 0.021 Uiso 1 1 calc R U . . .
C49 C 0.3814(2) 0.06203(19) 0.5145(2) 0.0383(7) Uani 1 1 d . . . . .
H49 H 0.2996 0.1053 0.5246 0.046 Uiso 1 1 calc R U . . .
C50 C 0.4448(3) 0.01197(19) 0.43413(19) 0.0357(6) Uani 1 1 d . . . . .
H50 H 0.4067 0.0198 0.3886 0.043 Uiso 1 1 calc R U . . .
C51 C 0.4370(3) 0.04917(17) 0.58002(17) 0.0374(7) Uani 1 1 d . . . . .
H51 H 0.3927 0.0832 0.6360 0.045 Uiso 1 1 calc R U . . .


_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 C11 2.0185(19) . ?
Pt1 F1 2.0948(11) . ?
Pt1 N1 2.1545(16) . ?
Pt1 P1 2.1756(5) . ?
Pt2 C35 2.018(2) . ?
Pt2 F3 2.0967(11) . ?
Pt2 N2 2.1583(16) . ?
Pt2 P2 2.1777(5) . ?
P1 C1 1.837(2) . ?
P1 C8 1.836(2) . ?
P1 C5 1.838(2) . ?
P2 C25 1.828(2) . ?
P2 C29 1.833(2) . ?
P2 C32 1.8362(19) . ?
F1 H6 1.49(4) . ?
F2 C12 1.398(2) . ?
F3 H5 1.51(4) . ?
F4 C36 1.400(2) . ?
F5 H5 0.87(4) . ?
F6 H6 0.88(4) . ?
N1 C4 1.480(3) . ?
N1 C2 1.496(3) . ?
N1 C3 1.488(2) . ?
N2 C27 1.481(2) . ?
N2 C28 1.491(3) . ?
N2 C26 1.496(3) . ?
C1 C2 1.522(3) . ?
C1 H1A 0.9900 . ?
C1 H1B 0.9900 . ?
C2 H2A 0.9900 . ?
C2 H2B 0.9900 . ?
C3 H3A 0.9800 . ?
C3 H3B 0.9800 . ?
C3 H3C 0.9800 . ?
C4 H4A 0.9800 . ?
C4 H4B 0.9800 . ?
C4 H4C 0.9800 . ?
C5 C7 1.531(3) . ?
C5 C6 1.536(3) . ?
C5 H5A 1.0000 . ?
C6 H6A 0.9800 . ?
C6 H6B 0.9800 . ?
C6 H6C 0.9800 . ?
C7 H7A 0.9800 . ?
C7 H7B 0.9800 . ?
C7 H7C 0.9800 . ?
C8 C10 1.524(3) . ?
C8 C9 1.537(3) . ?
C8 H8 1.0000 . ?
C9 H9A 0.9800 . ?
C9 H9B 0.9800 . ?
C9 H9C 0.9800 . ?
C10 H10A 0.9800 . ?
C10 H10B 0.9800 . ?
C10 H10C 0.9800 . ?
C11 C12 1.330(3) . ?
C11 C19 1.494(3) . ?
C12 C13 1.473(3) . ?
C13 C18 1.402(3) . ?
C13 C14 1.398(3) . ?
C14 C15 1.384(3) . ?
C14 H14 0.9500 . ?
C15 C16 1.380(3) . ?
C15 H15 0.9500 . ?
C16 C17 1.382(3) . ?
C16 H16 0.9500 . ?
C17 C18 1.388(3) . ?
C17 H17 0.9500 . ?
C18 H18 0.9500 . ?
C19 C20 1.398(3) . ?
C19 C24 1.404(3) . ?
C20 C21 1.385(3) . ?
C20 H20 0.9500 . ?
C21 C22 1.381(3) . ?
C21 H21 0.9500 . ?
C22 C23 1.397(3) . ?
C22 H22 0.9500 . ?
C23 C24 1.373(3) . ?
C23 H23 0.9500 . ?
C24 H24 0.9500 . ?
C25 C26 1.518(3) . ?
C25 H25A 0.9900 . ?
C25 H25B 0.9900 . ?
C26 H26A 0.9900 . ?
C26 H26B 0.9900 . ?
C27 H27A 0.9800 . ?
C27 H27B 0.9800 . ?
C27 H27C 0.9800 . ?
C28 H28A 0.9800 . ?
C28 H28B 0.9800 . ?
C28 H28C 0.9800 . ?
C29 C31 1.525(3) . ?
C29 C30 1.533(3) . ?
C29 H29 1.0000 . ?
C30 H30A 0.9800 . ?
C30 H30B 0.9800 . ?
C30 H30C 0.9800 . ?
C31 H31A 0.9800 . ?
C31 H31B 0.9800 . ?
C31 H31C 0.9800 . ?
C32 C33 1.528(3) . ?
C32 C34 1.536(3) . ?
C32 H32 1.0000 . ?
C33 H33A 0.9800 . ?
C33 H33B 0.9800 . ?
C33 H33C 0.9800 . ?
C34 H34A 0.9800 . ?
C34 H34B 0.9800 . ?
C34 H34C 0.9800 . ?
C35 C36 1.333(3) . ?
C35 C43 1.495(3) . ?
C36 C37 1.475(3) . ?
C37 C42 1.399(3) . ?
C37 C38 1.400(3) . ?
C38 C39 1.386(3) . ?
C38 H38 0.9500 . ?
C39 C40 1.388(3) . ?
C39 H39 0.9500 . ?
C40 C41 1.378(3) . ?
C40 H40 0.9500 . ?
C41 C42 1.389(3) . ?
C41 H41 0.9500 . ?
C42 H42 0.9500 . ?
C43 C44 1.392(3) . ?
C43 C48 1.396(3) . ?
C44 C45 1.390(3) . ?
C44 H44 0.9500 . ?
C45 C46 1.387(3) . ?
C45 H45 0.9500 . ?
C46 C47 1.380(3) . ?
C46 H46 0.9500 . ?
C47 C48 1.391(3) . ?
C47 H47 0.9500 . ?
C48 H48 0.9500 . ?
C49 C51 1.372(4) . ?
C49 C50 1.372(4) . ?
C49 H49 0.9500 . ?
C50 C51 1.366(4) 2_656 ?
C50 H50 0.9500 . ?
C51 C50 1.366(4) 2_656 ?
C51 H51 0.9500 . ?

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
C11 Pt1 F1 89.23(6) . . ?
C11 Pt1 N1 178.16(7) . . ?
F1 Pt1 N1 89.12(5) . . ?
C11 Pt1 P1 95.02(6) . . ?
F1 Pt1 P1 175.74(3) . . ?
N1 Pt1 P1 86.62(5) . . ?
C35 Pt2 F3 90.09(6) . . ?
C35 Pt2 N2 177.72(7) . . ?
F3 Pt2 N2 88.36(5) . . ?
C35 Pt2 P2 95.12(5) . . ?
F3 Pt2 P2 174.24(3) . . ?
N2 Pt2 P2 86.36(5) . . ?
C1 P1 C8 106.55(9) . . ?
C1 P1 C5 104.75(9) . . ?
C8 P1 C5 107.16(9) . . ?
C1 P1 Pt1 103.32(7) . . ?
C8 P1 Pt1 114.54(7) . . ?
C5 P1 Pt1 119.29(7) . . ?
C25 P2 C29 104.82(9) . . ?
C25 P2 C32 106.20(9) . . ?
C29 P2 C32 106.36(9) . . ?
C25 P2 Pt2 103.40(6) . . ?
C29 P2 Pt2 119.52(7) . . ?
C32 P2 Pt2 115.23(6) . . ?
Pt1 F1 H6 136.2(14) . . ?
Pt2 F3 H5 110.3(13) . . ?
C4 N1 C2 108.59(15) . . ?
C4 N1 C3 108.25(16) . . ?
C2 N1 C3 109.83(16) . . ?
C4 N1 Pt1 112.15(12) . . ?
C2 N1 Pt1 109.79(12) . . ?
C3 N1 Pt1 108.20(12) . . ?
C27 N2 C28 107.61(16) . . ?
C27 N2 C26 107.91(16) . . ?
C28 N2 C26 109.97(16) . . ?
C27 N2 Pt2 111.28(13) . . ?
C28 N2 Pt2 110.53(12) . . ?
C26 N2 Pt2 109.49(11) . . ?
C2 C1 P1 109.19(14) . . ?
C2 C1 H1A 109.8 . . ?
P1 C1 H1A 109.8 . . ?
C2 C1 H1B 109.8 . . ?
P1 C1 H1B 109.8 . . ?
H1A C1 H1B 108.3 . . ?
N1 C2 C1 111.72(16) . . ?
N1 C2 H2A 109.3 . . ?
C1 C2 H2A 109.3 . . ?
N1 C2 H2B 109.3 . . ?
C1 C2 H2B 109.3 . . ?
H2A C2 H2B 107.9 . . ?
N1 C3 H3A 109.5 . . ?
N1 C3 H3B 109.5 . . ?
H3A C3 H3B 109.5 . . ?
N1 C3 H3C 109.5 . . ?
H3A C3 H3C 109.5 . . ?
H3B C3 H3C 109.5 . . ?
N1 C4 H4A 109.5 . . ?
N1 C4 H4B 109.5 . . ?
H4A C4 H4B 109.5 . . ?
N1 C4 H4C 109.5 . . ?
H4A C4 H4C 109.5 . . ?
H4B C4 H4C 109.5 . . ?
C7 C5 C6 110.74(17) . . ?
C7 C5 P1 112.58(14) . . ?
C6 C5 P1 110.80(14) . . ?
C7 C5 H5A 107.5 . . ?
C6 C5 H5A 107.5 . . ?
P1 C5 H5A 107.5 . . ?
C5 C6 H6A 109.5 . . ?
C5 C6 H6B 109.5 . . ?
H6A C6 H6B 109.5 . . ?
C5 C6 H6C 109.5 . . ?
H6A C6 H6C 109.5 . . ?
H6B C6 H6C 109.5 . . ?
C5 C7 H7A 109.5 . . ?
C5 C7 H7B 109.5 . . ?
H7A C7 H7B 109.5 . . ?
C5 C7 H7C 109.5 . . ?
H7A C7 H7C 109.5 . . ?
H7B C7 H7C 109.5 . . ?
C10 C8 C9 110.69(17) . . ?
C10 C8 P1 113.44(14) . . ?
C9 C8 P1 110.62(14) . . ?
C10 C8 H8 107.3 . . ?
C9 C8 H8 107.3 . . ?
P1 C8 H8 107.3 . . ?
C8 C9 H9A 109.5 . . ?
C8 C9 H9B 109.5 . . ?
H9A C9 H9B 109.5 . . ?
C8 C9 H9C 109.5 . . ?
H9A C9 H9C 109.5 . . ?
H9B C9 H9C 109.5 . . ?
C8 C10 H10A 109.5 . . ?
C8 C10 H10B 109.5 . . ?
H10A C10 H10B 109.5 . . ?
C8 C10 H10C 109.5 . . ?
H10A C10 H10C 109.5 . . ?
H10B C10 H10C 109.5 . . ?
C12 C11 C19 120.23(18) . . ?
C12 C11 Pt1 122.89(14) . . ?
C19 C11 Pt1 116.80(13) . . ?
C11 C12 F2 118.48(17) . . ?
C11 C12 C13 131.91(18) . . ?
F2 C12 C13 109.60(15) . . ?
C18 C13 C14 118.29(18) . . ?
C18 C13 C12 119.52(18) . . ?
C14 C13 C12 122.19(17) . . ?
C15 C14 C13 120.86(19) . . ?
C15 C14 H14 119.6 . . ?
C13 C14 H14 119.6 . . ?
C16 C15 C14 120.2(2) . . ?
C16 C15 H15 119.9 . . ?
C14 C15 H15 119.9 . . ?
C15 C16 C17 119.85(19) . . ?
C15 C16 H16 120.1 . . ?
C17 C16 H16 120.1 . . ?
C18 C17 C16 120.5(2) . . ?
C18 C17 H17 119.8 . . ?
C16 C17 H17 119.8 . . ?
C17 C18 C13 120.2(2) . . ?
C17 C18 H18 119.9 . . ?
C13 C18 H18 119.9 . . ?
C20 C19 C24 118.00(18) . . ?
C20 C19 C11 120.07(18) . . ?
C24 C19 C11 121.88(18) . . ?
C19 C20 C21 120.71(19) . . ?
C19 C20 H20 119.6 . . ?
C21 C20 H20 119.6 . . ?
C22 C21 C20 120.6(2) . . ?
C22 C21 H21 119.7 . . ?
C20 C21 H21 119.7 . . ?
C21 C22 C23 119.21(19) . . ?
C21 C22 H22 120.4 . . ?
C23 C22 H22 120.4 . . ?
C24 C23 C22 120.3(2) . . ?
C24 C23 H23 119.8 . . ?
C22 C23 H23 119.8 . . ?
C23 C24 C19 121.1(2) . . ?
C23 C24 H24 119.5 . . ?
C19 C24 H24 119.5 . . ?
C26 C25 P2 109.64(14) . . ?
C26 C25 H25A 109.7 . . ?
P2 C25 H25A 109.7 . . ?
C26 C25 H25B 109.7 . . ?
P2 C25 H25B 109.7 . . ?
H25A C25 H25B 108.2 . . ?
N2 C26 C25 111.64(16) . . ?
N2 C26 H26A 109.3 . . ?
C25 C26 H26A 109.3 . . ?
N2 C26 H26B 109.3 . . ?
C25 C26 H26B 109.3 . . ?
H26A C26 H26B 108.0 . . ?
N2 C27 H27A 109.5 . . ?
N2 C27 H27B 109.5 . . ?
H27A C27 H27B 109.5 . . ?
N2 C27 H27C 109.5 . . ?
H27A C27 H27C 109.5 . . ?
H27B C27 H27C 109.5 . . ?
N2 C28 H28A 109.5 . . ?
N2 C28 H28B 109.5 . . ?
H28A C28 H28B 109.5 . . ?
N2 C28 H28C 109.5 . . ?
H28A C28 H28C 109.5 . . ?
H28B C28 H28C 109.5 . . ?
C31 C29 C30 111.31(17) . . ?
C31 C29 P2 112.63(14) . . ?
C30 C29 P2 110.73(14) . . ?
C31 C29 H29 107.3 . . ?
C30 C29 H29 107.3 . . ?
P2 C29 H29 107.3 . . ?
C29 C30 H30A 109.5 . . ?
C29 C30 H30B 109.5 . . ?
H30A C30 H30B 109.5 . . ?
C29 C30 H30C 109.5 . . ?
H30A C30 H30C 109.5 . . ?
H30B C30 H30C 109.5 . . ?
C29 C31 H31A 109.5 . . ?
C29 C31 H31B 109.5 . . ?
H31A C31 H31B 109.5 . . ?
C29 C31 H31C 109.5 . . ?
H31A C31 H31C 109.5 . . ?
H31B C31 H31C 109.5 . . ?
C33 C32 C34 111.11(17) . . ?
C33 C32 P2 110.65(13) . . ?
C34 C32 P2 112.96(14) . . ?
C33 C32 H32 107.3 . . ?
C34 C32 H32 107.3 . . ?
P2 C32 H32 107.3 . . ?
C32 C33 H33A 109.5 . . ?
C32 C33 H33B 109.5 . . ?
H33A C33 H33B 109.5 . . ?
C32 C33 H33C 109.5 . . ?
H33A C33 H33C 109.5 . . ?
H33B C33 H33C 109.5 . . ?
C32 C34 H34A 109.5 . . ?
C32 C34 H34B 109.5 . . ?
H34A C34 H34B 109.5 . . ?
C32 C34 H34C 109.5 . . ?
H34A C34 H34C 109.5 . . ?
H34B C34 H34C 109.5 . . ?
C36 C35 C43 118.30(18) . . ?
C36 C35 Pt2 124.58(15) . . ?
C43 C35 Pt2 116.99(14) . . ?
C35 C36 F4 117.67(17) . . ?
C35 C36 C37 133.25(18) . . ?
F4 C36 C37 109.07(16) . . ?
C42 C37 C38 118.26(18) . . ?
C42 C37 C36 119.45(18) . . ?
C38 C37 C36 122.27(18) . . ?
C39 C38 C37 120.3(2) . . ?
C39 C38 H38 119.8 . . ?
C37 C38 H38 119.8 . . ?
C38 C39 C40 120.7(2) . . ?
C38 C39 H39 119.6 . . ?
C40 C39 H39 119.6 . . ?
C41 C40 C39 119.49(19) . . ?
C41 C40 H40 120.3 . . ?
C39 C40 H40 120.3 . . ?
C40 C41 C42 120.3(2) . . ?
C40 C41 H41 119.8 . . ?
C42 C41 H41 119.8 . . ?
C41 C42 C37 120.9(2) . . ?
C41 C42 H42 119.6 . . ?
C37 C42 H42 119.6 . . ?
C44 C43 C48 118.08(18) . . ?
C44 C43 C35 120.40(17) . . ?
C48 C43 C35 121.52(17) . . ?
C43 C44 C45 120.96(19) . . ?
C43 C44 H44 119.5 . . ?
C45 C44 H44 119.5 . . ?
C46 C45 C44 120.2(2) . . ?
C46 C45 H45 119.9 . . ?
C44 C45 H45 119.9 . . ?
C47 C46 C45 119.52(19) . . ?
C47 C46 H46 120.2 . . ?
C45 C46 H46 120.2 . . ?
C46 C47 C48 120.3(2) . . ?
C46 C47 H47 119.9 . . ?
C48 C47 H47 119.9 . . ?
C47 C48 C43 120.93(19) . . ?
C47 C48 H48 119.5 . . ?
C43 C48 H48 119.5 . . ?
C51 C49 C50 119.6(2) . . ?
C51 C49 H49 120.2 . . ?
C50 C49 H49 120.2 . . ?
C51 C50 C49 119.6(2) 2_656 . ?
C51 C50 H50 120.2 2_656 . ?
C49 C50 H50 120.2 . . ?
C50 C51 C49 120.9(2) 2_656 . ?
C50 C51 H51 119.6 2_656 . ?
C49 C51 H51 119.6 . . ?

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
C8 P1 C1 C2 96.64(15) . . . . ?
C5 P1 C1 C2 -150.00(14) . . . . ?
Pt1 P1 C1 C2 -24.40(14) . . . . ?
C4 N1 C2 C1 -169.55(16) . . . . ?
C3 N1 C2 C1 72.3(2) . . . . ?
Pt1 N1 C2 C1 -46.60(18) . . . . ?
P1 C1 C2 N1 46.79(19) . . . . ?
C1 P1 C5 C7 -165.67(15) . . . . ?
C8 P1 C5 C7 -52.74(17) . . . . ?
Pt1 P1 C5 C7 79.45(15) . . . . ?
C1 P1 C5 C6 69.72(16) . . . . ?
C8 P1 C5 C6 -177.36(14) . . . . ?
Pt1 P1 C5 C6 -45.17(17) . . . . ?
C1 P1 C8 C10 65.49(17) . . . . ?
C5 P1 C8 C10 -46.20(18) . . . . ?
Pt1 P1 C8 C10 179.06(13) . . . . ?
C1 P1 C8 C9 -59.58(17) . . . . ?
C5 P1 C8 C9 -171.27(14) . . . . ?
Pt1 P1 C8 C9 53.99(16) . . . . ?
C19 C11 C12 F2 -1.6(3) . . . . ?
Pt1 C11 C12 F2 174.96(12) . . . . ?
C19 C11 C12 C13 177.63(19) . . . . ?
Pt1 C11 C12 C13 -5.8(3) . . . . ?
C11 C12 C13 C18 -150.1(2) . . . . ?
F2 C12 C13 C18 29.2(2) . . . . ?
C11 C12 C13 C14 30.4(3) . . . . ?
F2 C12 C13 C14 -150.34(18) . . . . ?
C18 C13 C14 C15 2.8(3) . . . . ?
C12 C13 C14 C15 -177.67(19) . . . . ?
C13 C14 C15 C16 -1.8(3) . . . . ?
C14 C15 C16 C17 0.0(3) . . . . ?
C15 C16 C17 C18 0.5(3) . . . . ?
C16 C17 C18 C13 0.6(3) . . . . ?
C14 C13 C18 C17 -2.2(3) . . . . ?
C12 C13 C18 C17 178.2(2) . . . . ?
C12 C11 C19 C20 134.9(2) . . . . ?
Pt1 C11 C19 C20 -41.9(2) . . . . ?
C12 C11 C19 C24 -47.6(3) . . . . ?
Pt1 C11 C19 C24 135.67(17) . . . . ?
C24 C19 C20 C21 1.8(3) . . . . ?
C11 C19 C20 C21 179.46(19) . . . . ?
C19 C20 C21 C22 -1.2(3) . . . . ?
C20 C21 C22 C23 -0.7(3) . . . . ?
C21 C22 C23 C24 1.8(4) . . . . ?
C22 C23 C24 C19 -1.1(3) . . . . ?
C20 C19 C24 C23 -0.7(3) . . . . ?
C11 C19 C24 C23 -178.3(2) . . . . ?
C29 P2 C25 C26 -102.66(15) . . . . ?
C32 P2 C25 C26 144.99(14) . . . . ?
Pt2 P2 C25 C26 23.28(15) . . . . ?
C27 N2 C26 C25 168.40(17) . . . . ?
C28 N2 C26 C25 -74.5(2) . . . . ?
Pt2 N2 C26 C25 47.14(19) . . . . ?
P2 C25 C26 N2 -46.5(2) . . . . ?
C25 P2 C29 C31 -168.39(15) . . . . ?
C32 P2 C29 C31 -56.15(17) . . . . ?
Pt2 P2 C29 C31 76.44(16) . . . . ?
C25 P2 C29 C30 66.24(16) . . . . ?
C32 P2 C29 C30 178.48(14) . . . . ?
Pt2 P2 C29 C30 -48.93(16) . . . . ?
C25 P2 C32 C33 -63.21(16) . . . . ?
C29 P2 C32 C33 -174.49(14) . . . . ?
Pt2 P2 C32 C33 50.60(16) . . . . ?
C25 P2 C32 C34 62.08(17) . . . . ?
C29 P2 C32 C34 -49.20(17) . . . . ?
Pt2 P2 C32 C34 175.89(13) . . . . ?
C43 C35 C36 F4 -0.7(3) . . . . ?
Pt2 C35 C36 F4 175.04(12) . . . . ?
C43 C35 C36 C37 179.01(19) . . . . ?
Pt2 C35 C36 C37 -5.3(3) . . . . ?
C35 C36 C37 C42 -158.2(2) . . . . ?
F4 C36 C37 C42 21.5(2) . . . . ?
C35 C36 C37 C38 23.9(3) . . . . ?
F4 C36 C37 C38 -156.45(17) . . . . ?
C42 C37 C38 C39 1.3(3) . . . . ?
C36 C37 C38 C39 179.29(19) . . . . ?
C37 C38 C39 C40 -0.7(3) . . . . ?
C38 C39 C40 C41 -0.3(3) . . . . ?
C39 C40 C41 C42 0.7(3) . . . . ?
C40 C41 C42 C37 0.0(3) . . . . ?
C38 C37 C42 C41 -1.0(3) . . . . ?
C36 C37 C42 C41 -179.01(18) . . . . ?
C36 C35 C43 C44 127.1(2) . . . . ?
Pt2 C35 C43 C44 -48.9(2) . . . . ?
C36 C35 C43 C48 -53.1(3) . . . . ?
Pt2 C35 C43 C48 130.91(17) . . . . ?
C48 C43 C44 C45 2.5(3) . . . . ?
C35 C43 C44 C45 -177.69(19) . . . . ?
C43 C44 C45 C46 -2.3(3) . . . . ?
C44 C45 C46 C47 0.6(3) . . . . ?
C45 C46 C47 C48 0.9(3) . . . . ?
C46 C47 C48 C43 -0.6(3) . . . . ?
C44 C43 C48 C47 -1.0(3) . . . . ?
C35 C43 C48 C47 179.12(19) . . . . ?
C51 C49 C50 C51 -0.8(4) . . . 2_656 ?
C50 C49 C51 C50 0.8(4) . . . 2_656 ?

_refine_diff_density_max         0.887
_refine_diff_density_min         -0.368
_refine_diff_density_rms         0.070

_shelxl_version_number           2013-4

####################################################################### 
# 
# 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_complex9_fz27_2
_database_code_depnum_ccdc_archive 'CCDC 1055086'
_audit_update_record             
;
2015-03-19 deposited with the CCDC.
2015-08-06 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2013
_chemical_name_systematic        
;
 ?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C26 H34 F4 N O2 P Pt'
_chemical_formula_sum            'C26 H34 F4 N O2 P Pt'
_chemical_formula_weight         694.60

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'
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'

_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 21/c'
_space_group_name_Hall           '-P 2ybc'

_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.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'

_cell_length_a                   11.8067(11)
_cell_length_b                   16.0871(16)
_cell_length_c                   16.4945(16)
_cell_angle_alpha                90
_cell_angle_beta                 122.476(6)
_cell_angle_gamma                90
_cell_volume                     2643.0(5)
_cell_formula_units_Z            4
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    8733
_cell_measurement_theta_min      2.37
_cell_measurement_theta_max      29.65

_exptl_crystal_description       block
_exptl_crystal_colour            'pale yellow'
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.746
_exptl_crystal_F_000             1368
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.420
_exptl_crystal_size_mid          0.360
_exptl_crystal_size_min          0.240
_exptl_absorpt_coefficient_mu    5.421
_shelx_estimated_absorpt_T_min   0.209
_shelx_estimated_absorpt_T_max   0.356
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.118
_exptl_absorpt_correction_T_max  0.272
_exptl_absorpt_process_details   'PLATON, Spek 2003'

_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      100(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  'Stoe IPDS2theta'
_diffrn_measurement_method       'rotation method'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            33481
_diffrn_reflns_av_unetI/netI     0.0362
_diffrn_reflns_av_R_equivalents  0.0543
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_k_max       22
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_theta_min         2.171
_diffrn_reflns_theta_max         29.426
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.996
_diffrn_measured_fraction_theta_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.996
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.996
_diffrn_reflns_point_group_measured_fraction_full 0.999
_reflns_number_total             7288
_reflns_number_gt                5391
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_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.
;

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    ?
_computing_structure_refinement  'SHELXL-2013 (Sheldrick, 2013)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
;
 ?
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0357P)²] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         7288
_refine_ls_number_parameters     322
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0428
_refine_ls_R_factor_gt           0.0265
_refine_ls_wR_factor_ref         0.0596
_refine_ls_wR_factor_gt          0.0551
_refine_ls_goodness_of_fit_ref   0.920
_refine_ls_restrained_S_all      0.920
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000

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 0.18833(2) 0.24841(2) 0.37133(2) 0.01474(4) Uani 1 1 d . . . . .
P1 P 0.06228(8) 0.31888(4) 0.23800(5) 0.01542(13) Uani 1 1 d . . . . .
F1 F 0.5405(4) 0.1081(2) 0.6391(3) 0.0957(15) Uani 1 1 d . . . . .
F2 F 0.4523(3) -0.01071(15) 0.60261(19) 0.0494(7) Uani 1 1 d . . . . .
F3 F 0.3871(4) 0.0754(2) 0.6647(2) 0.0846(13) Uani 1 1 d . . . . .
F4 F 0.0281(2) 0.36561(11) 0.52025(13) 0.0219(4) Uani 1 1 d . . . . .
O1 O 0.3193(2) 0.18002(13) 0.49831(15) 0.0203(4) Uani 1 1 d . . . . .
O2 O 0.2379(3) 0.05088(15) 0.44519(18) 0.0324(6) Uani 1 1 d . . . . .
N1 N 0.3068(3) 0.21376(15) 0.31182(18) 0.0162(5) Uani 1 1 d . . . . .
C1 C 0.1394(3) 0.29665(18) 0.1688(2) 0.0201(6) Uani 1 1 d . . . . .
H1A H 0.0930 0.2492 0.1250 0.024 Uiso 1 1 calc R U . . .
H1B H 0.1307 0.3457 0.1296 0.024 Uiso 1 1 calc R U . . .
C2 C 0.2873(3) 0.27578(19) 0.2382(2) 0.0202(6) Uani 1 1 d . . . . .
H2A H 0.3248 0.2533 0.2015 0.024 Uiso 1 1 calc R U . . .
H2B H 0.3371 0.3272 0.2708 0.024 Uiso 1 1 calc R U . . .
C3 C 0.2679(4) 0.12958(18) 0.2675(2) 0.0217(6) Uani 1 1 d . . . . .
H3A H 0.3252 0.1139 0.2437 0.033 Uiso 1 1 calc R U . . .
H3B H 0.1739 0.1303 0.2139 0.033 Uiso 1 1 calc R U . . .
H3C H 0.2791 0.0892 0.3158 0.033 Uiso 1 1 calc R U . . .
C4 C 0.4518(3) 0.2126(2) 0.3875(3) 0.0250(6) Uani 1 1 d . . . . .
H4A H 0.5039 0.2023 0.3582 0.038 Uiso 1 1 calc R U . . .
H4B H 0.4697 0.1685 0.4339 0.038 Uiso 1 1 calc R U . . .
H4C H 0.4778 0.2664 0.4206 0.038 Uiso 1 1 calc R U . . .
C5 C -0.1133(3) 0.28588(18) 0.1628(2) 0.0184(6) Uani 1 1 d . . . . .
H5 H -0.1593 0.3036 0.1962 0.022 Uiso 1 1 calc R U . . .
C6 C -0.1243(4) 0.19089(19) 0.1538(2) 0.0235(6) Uani 1 1 d . . . . .
H6A H -0.2186 0.1744 0.1229 0.035 Uiso 1 1 calc R U . . .
H6B H -0.0718 0.1658 0.2179 0.035 Uiso 1 1 calc R U . . .
H6C H -0.0895 0.1718 0.1148 0.035 Uiso 1 1 calc R U . . .
C7 C -0.1873(3) 0.3272(2) 0.0639(2) 0.0246(6) Uani 1 1 d . . . . .
H7A H -0.1440 0.3117 0.0293 0.037 Uiso 1 1 calc R U . . .
H7B H -0.1843 0.3877 0.0716 0.037 Uiso 1 1 calc R U . . .
H7C H -0.2810 0.3086 0.0274 0.037 Uiso 1 1 calc R U . . .
C8 C 0.0565(3) 0.43300(17) 0.2418(2) 0.0189(5) Uani 1 1 d . . . . .
H8 H 0.0186 0.4534 0.1747 0.023 Uiso 1 1 calc R U . . .
C9 C 0.1989(3) 0.46827(18) 0.3035(2) 0.0212(6) Uani 1 1 d . . . . .
H9A H 0.1945 0.5290 0.3057 0.032 Uiso 1 1 calc R U . . .
H9B H 0.2510 0.4525 0.2755 0.032 Uiso 1 1 calc R U . . .
H9C H 0.2422 0.4459 0.3688 0.032 Uiso 1 1 calc R U . . .
C10 C -0.0355(3) 0.46476(18) 0.2739(2) 0.0222(6) Uani 1 1 d . . . . .
H10A H -0.0037 0.4438 0.3385 0.033 Uiso 1 1 calc R U . . .
H10B H -0.1273 0.4451 0.2290 0.033 Uiso 1 1 calc R U . . .
H10C H -0.0344 0.5257 0.2748 0.033 Uiso 1 1 calc R U . . .
C11 C 0.3155(4) 0.10166(19) 0.5038(2) 0.0222(6) Uani 1 1 d . . . . .
C12 C 0.4263(4) 0.0685(2) 0.6033(3) 0.0317(8) Uani 1 1 d . . . . .
C13 C 0.0775(3) 0.28182(18) 0.4270(2) 0.0167(5) Uani 1 1 d . . . . .
C14 C 0.1137(3) 0.34464(17) 0.4887(2) 0.0182(5) Uani 1 1 d . . . . .
C15 C 0.2274(3) 0.40309(17) 0.5286(2) 0.0182(5) Uani 1 1 d . . . . .
C16 C 0.2065(4) 0.48707(19) 0.5390(2) 0.0229(6) Uani 1 1 d . . . . .
H16 H 0.1212 0.5048 0.5252 0.027 Uiso 1 1 calc R U . . .
C17 C 0.3090(4) 0.5447(2) 0.5691(2) 0.0271(7) Uani 1 1 d . . . . .
H17 H 0.2934 0.6016 0.5752 0.033 Uiso 1 1 calc R U . . .
C18 C 0.4340(4) 0.5190(2) 0.5903(2) 0.0279(7) Uani 1 1 d . . . . .
H18 H 0.5035 0.5586 0.6088 0.033 Uiso 1 1 calc R U . . .
C19 C 0.4576(3) 0.4355(2) 0.5842(2) 0.0247(6) Uani 1 1 d . . . . .
H19 H 0.5443 0.4178 0.6009 0.030 Uiso 1 1 calc R U . . .
C20 C 0.3557(3) 0.37752(19) 0.5541(2) 0.0210(6) Uani 1 1 d . . . . .
H20 H 0.3730 0.3204 0.5508 0.025 Uiso 1 1 calc R U . . .
C21 C -0.0469(3) 0.23410(17) 0.3940(2) 0.0208(6) Uani 1 1 d . . . . .
C22 C -0.0438(4) 0.14786(19) 0.4048(2) 0.0222(6) Uani 1 1 d . . . . .
H22 H 0.0398 0.1195 0.4358 0.027 Uiso 1 1 calc R U . . .
C23 C -0.1618(4) 0.1029(2) 0.3707(2) 0.0273(7) Uani 1 1 d . . . . .
H23 H -0.1577 0.0445 0.3807 0.033 Uiso 1 1 calc R U . . .
C24 C -0.2852(4) 0.1427(2) 0.3224(2) 0.0303(7) Uani 1 1 d . . . . .
H24 H -0.3656 0.1116 0.2974 0.036 Uiso 1 1 calc R U . . .
C25 C -0.2903(4) 0.2281(2) 0.3106(2) 0.0284(7) Uani 1 1 d . . . . .
H25 H -0.3746 0.2557 0.2770 0.034 Uiso 1 1 calc R U . . .
C26 C -0.1718(4) 0.2739(2) 0.3481(2) 0.0242(6) Uani 1 1 d . . . . .
H26 H -0.1761 0.3327 0.3424 0.029 Uiso 1 1 calc R U . . .


_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 C13 2.034(3) . ?
Pt1 O1 2.124(2) . ?
Pt1 N1 2.169(2) . ?
Pt1 P1 2.1959(8) . ?
P1 C5 1.832(3) . ?
P1 C1 1.836(3) . ?
P1 C8 1.839(3) . ?
F1 C12 1.311(5) . ?
F2 C12 1.311(4) . ?
F3 C12 1.325(5) . ?
F4 C14 1.405(3) . ?
O1 C11 1.266(4) . ?
O2 C11 1.221(4) . ?
N1 C4 1.482(4) . ?
N1 C3 1.489(4) . ?
N1 C2 1.491(4) . ?
C1 C2 1.526(5) . ?
C1 H1A 0.9900 . ?
C1 H1B 0.9900 . ?
C2 H2A 0.9900 . ?
C2 H2B 0.9900 . ?
C3 H3A 0.9800 . ?
C3 H3B 0.9800 . ?
C3 H3C 0.9800 . ?
C4 H4A 0.9800 . ?
C4 H4B 0.9800 . ?
C4 H4C 0.9800 . ?
C5 C7 1.529(4) . ?
C5 C6 1.534(4) . ?
C5 H5 1.0000 . ?
C6 H6A 0.9800 . ?
C6 H6B 0.9800 . ?
C6 H6C 0.9800 . ?
C7 H7A 0.9800 . ?
C7 H7B 0.9800 . ?
C7 H7C 0.9800 . ?
C8 C10 1.529(4) . ?
C8 C9 1.532(4) . ?
C8 H8 1.0000 . ?
C9 H9A 0.9800 . ?
C9 H9B 0.9800 . ?
C9 H9C 0.9800 . ?
C10 H10A 0.9800 . ?
C10 H10B 0.9800 . ?
C10 H10C 0.9800 . ?
C11 C12 1.543(5) . ?
C13 C14 1.331(4) . ?
C13 C21 1.478(4) . ?
C14 C15 1.473(4) . ?
C15 C20 1.398(4) . ?
C15 C16 1.400(4) . ?
C16 C17 1.387(5) . ?
C16 H16 0.9500 . ?
C17 C18 1.385(5) . ?
C17 H17 0.9500 . ?
C18 C19 1.387(5) . ?
C18 H18 0.9500 . ?
C19 C20 1.386(5) . ?
C19 H19 0.9500 . ?
C20 H20 0.9500 . ?
C21 C22 1.397(4) . ?
C21 C26 1.400(5) . ?
C22 C23 1.392(5) . ?
C22 H22 0.9500 . ?
C23 C24 1.386(5) . ?
C23 H23 0.9500 . ?
C24 C25 1.384(5) . ?
C24 H24 0.9500 . ?
C25 C26 1.397(5) . ?
C25 H25 0.9500 . ?
C26 H26 0.9500 . ?

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
C13 Pt1 O1 89.74(10) . . ?
C13 Pt1 N1 179.57(10) . . ?
O1 Pt1 N1 90.48(9) . . ?
C13 Pt1 P1 93.54(9) . . ?
O1 Pt1 P1 176.57(6) . . ?
N1 Pt1 P1 86.24(7) . . ?
C5 P1 C1 106.34(14) . . ?
C5 P1 C8 105.25(14) . . ?
C1 P1 C8 104.79(14) . . ?
C5 P1 Pt1 116.12(10) . . ?
C1 P1 Pt1 103.07(10) . . ?
C8 P1 Pt1 119.92(10) . . ?
C11 O1 Pt1 123.5(2) . . ?
C4 N1 C3 108.3(2) . . ?
C4 N1 C2 107.3(2) . . ?
C3 N1 C2 109.7(2) . . ?
C4 N1 Pt1 110.84(18) . . ?
C3 N1 Pt1 110.60(18) . . ?
C2 N1 Pt1 109.98(17) . . ?
C2 C1 P1 109.1(2) . . ?
C2 C1 H1A 109.9 . . ?
P1 C1 H1A 109.9 . . ?
C2 C1 H1B 109.9 . . ?
P1 C1 H1B 109.9 . . ?
H1A C1 H1B 108.3 . . ?
N1 C2 C1 111.8(2) . . ?
N1 C2 H2A 109.3 . . ?
C1 C2 H2A 109.3 . . ?
N1 C2 H2B 109.3 . . ?
C1 C2 H2B 109.3 . . ?
H2A C2 H2B 107.9 . . ?
N1 C3 H3A 109.5 . . ?
N1 C3 H3B 109.5 . . ?
H3A C3 H3B 109.5 . . ?
N1 C3 H3C 109.5 . . ?
H3A C3 H3C 109.5 . . ?
H3B C3 H3C 109.5 . . ?
N1 C4 H4A 109.5 . . ?
N1 C4 H4B 109.5 . . ?
H4A C4 H4B 109.5 . . ?
N1 C4 H4C 109.5 . . ?
H4A C4 H4C 109.5 . . ?
H4B C4 H4C 109.5 . . ?
C7 C5 C6 111.0(3) . . ?
C7 C5 P1 112.8(2) . . ?
C6 C5 P1 111.1(2) . . ?
C7 C5 H5 107.2 . . ?
C6 C5 H5 107.2 . . ?
P1 C5 H5 107.2 . . ?
C5 C6 H6A 109.5 . . ?
C5 C6 H6B 109.5 . . ?
H6A C6 H6B 109.5 . . ?
C5 C6 H6C 109.5 . . ?
H6A C6 H6C 109.5 . . ?
H6B C6 H6C 109.5 . . ?
C5 C7 H7A 109.5 . . ?
C5 C7 H7B 109.5 . . ?
H7A C7 H7B 109.5 . . ?
C5 C7 H7C 109.5 . . ?
H7A C7 H7C 109.5 . . ?
H7B C7 H7C 109.5 . . ?
C10 C8 C9 112.1(2) . . ?
C10 C8 P1 113.0(2) . . ?
C9 C8 P1 110.2(2) . . ?
C10 C8 H8 107.1 . . ?
C9 C8 H8 107.1 . . ?
P1 C8 H8 107.1 . . ?
C8 C9 H9A 109.5 . . ?
C8 C9 H9B 109.5 . . ?
H9A C9 H9B 109.5 . . ?
C8 C9 H9C 109.5 . . ?
H9A C9 H9C 109.5 . . ?
H9B C9 H9C 109.5 . . ?
C8 C10 H10A 109.5 . . ?
C8 C10 H10B 109.5 . . ?
H10A C10 H10B 109.5 . . ?
C8 C10 H10C 109.5 . . ?
H10A C10 H10C 109.5 . . ?
H10B C10 H10C 109.5 . . ?
O2 C11 O1 130.5(3) . . ?
O2 C11 C12 117.2(3) . . ?
O1 C11 C12 112.2(3) . . ?
F1 C12 F2 106.8(4) . . ?
F1 C12 F3 108.1(4) . . ?
F2 C12 F3 105.5(3) . . ?
F1 C12 C11 113.0(3) . . ?
F2 C12 C11 113.3(3) . . ?
F3 C12 C11 109.8(3) . . ?
C14 C13 C21 121.6(3) . . ?
C14 C13 Pt1 121.7(2) . . ?
C21 C13 Pt1 116.7(2) . . ?
C13 C14 F4 117.8(3) . . ?
C13 C14 C15 131.9(3) . . ?
F4 C14 C15 110.2(2) . . ?
C20 C15 C16 118.7(3) . . ?
C20 C15 C14 121.8(3) . . ?
C16 C15 C14 119.5(3) . . ?
C17 C16 C15 120.8(3) . . ?
C17 C16 H16 119.6 . . ?
C15 C16 H16 119.6 . . ?
C18 C17 C16 119.8(3) . . ?
C18 C17 H17 120.1 . . ?
C16 C17 H17 120.1 . . ?
C17 C18 C19 119.9(3) . . ?
C17 C18 H18 120.1 . . ?
C19 C18 H18 120.1 . . ?
C20 C19 C18 120.6(3) . . ?
C20 C19 H19 119.7 . . ?
C18 C19 H19 119.7 . . ?
C19 C20 C15 120.1(3) . . ?
C19 C20 H20 120.0 . . ?
C15 C20 H20 120.0 . . ?
C22 C21 C26 118.1(3) . . ?
C22 C21 C13 121.1(3) . . ?
C26 C21 C13 120.8(3) . . ?
C23 C22 C21 120.9(3) . . ?
C23 C22 H22 119.6 . . ?
C21 C22 H22 119.6 . . ?
C24 C23 C22 120.4(3) . . ?
C24 C23 H23 119.8 . . ?
C22 C23 H23 119.8 . . ?
C25 C24 C23 119.5(3) . . ?
C25 C24 H24 120.2 . . ?
C23 C24 H24 120.2 . . ?
C24 C25 C26 120.2(4) . . ?
C24 C25 H25 119.9 . . ?
C26 C25 H25 119.9 . . ?
C25 C26 C21 120.8(3) . . ?
C25 C26 H26 119.6 . . ?
C21 C26 H26 119.6 . . ?

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
C5 P1 C1 C2 -148.8(2) . . . . ?
C8 P1 C1 C2 100.0(2) . . . . ?
Pt1 P1 C1 C2 -26.2(2) . . . . ?
C4 N1 C2 C1 -167.1(2) . . . . ?
C3 N1 C2 C1 75.4(3) . . . . ?
Pt1 N1 C2 C1 -46.4(3) . . . . ?
P1 C1 C2 N1 48.1(3) . . . . ?
C1 P1 C5 C7 -55.8(2) . . . . ?
C8 P1 C5 C7 55.1(2) . . . . ?
Pt1 P1 C5 C7 -169.76(18) . . . . ?
C1 P1 C5 C6 69.6(2) . . . . ?
C8 P1 C5 C6 -179.6(2) . . . . ?
Pt1 P1 C5 C6 -44.4(2) . . . . ?
C5 P1 C8 C10 53.5(2) . . . . ?
C1 P1 C8 C10 165.5(2) . . . . ?
Pt1 P1 C8 C10 -79.6(2) . . . . ?
C5 P1 C8 C9 179.8(2) . . . . ?
C1 P1 C8 C9 -68.3(2) . . . . ?
Pt1 P1 C8 C9 46.7(2) . . . . ?
Pt1 O1 C11 O2 -4.8(5) . . . . ?
Pt1 O1 C11 C12 177.4(2) . . . . ?
O2 C11 C12 F1 143.4(4) . . . . ?
O1 C11 C12 F1 -38.5(5) . . . . ?
O2 C11 C12 F2 21.8(5) . . . . ?
O1 C11 C12 F2 -160.1(3) . . . . ?
O2 C11 C12 F3 -95.8(4) . . . . ?
O1 C11 C12 F3 82.3(4) . . . . ?
C21 C13 C14 F4 -1.2(4) . . . . ?
Pt1 C13 C14 F4 177.31(18) . . . . ?
C21 C13 C14 C15 -177.0(3) . . . . ?
Pt1 C13 C14 C15 1.6(5) . . . . ?
C13 C14 C15 C20 -38.7(5) . . . . ?
F4 C14 C15 C20 145.3(3) . . . . ?
C13 C14 C15 C16 139.4(3) . . . . ?
F4 C14 C15 C16 -36.6(3) . . . . ?
C20 C15 C16 C17 3.4(4) . . . . ?
C14 C15 C16 C17 -174.8(3) . . . . ?
C15 C16 C17 C18 -0.7(5) . . . . ?
C16 C17 C18 C19 -2.1(5) . . . . ?
C17 C18 C19 C20 2.2(5) . . . . ?
C18 C19 C20 C15 0.6(5) . . . . ?
C16 C15 C20 C19 -3.3(4) . . . . ?
C14 C15 C20 C19 174.8(3) . . . . ?
C14 C13 C21 C22 -124.3(3) . . . . ?
Pt1 C13 C21 C22 57.1(3) . . . . ?
C14 C13 C21 C26 57.7(4) . . . . ?
Pt1 C13 C21 C26 -120.9(3) . . . . ?
C26 C21 C22 C23 0.1(4) . . . . ?
C13 C21 C22 C23 -177.9(3) . . . . ?
C21 C22 C23 C24 2.3(5) . . . . ?
C22 C23 C24 C25 -2.0(5) . . . . ?
C23 C24 C25 C26 -0.6(5) . . . . ?
C24 C25 C26 C21 3.0(5) . . . . ?
C22 C21 C26 C25 -2.8(4) . . . . ?
C13 C21 C26 C25 175.3(3) . . . . ?

_refine_diff_density_max         0.780
_refine_diff_density_min         -2.377
_refine_diff_density_rms         0.138

_shelxl_version_number           2013-4

####################################################################### 
# 
# 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_complex10_jb_alkin
_database_code_depnum_ccdc_archive 'CCDC 1055087'
_audit_update_record             
;
2015-03-19 deposited with the CCDC.
2015-08-06 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         '2(C25 H36 N P Pt), C4 H8 O'
_chemical_formula_sum            'C54 H80 N2 O P2 Pt2'
_chemical_formula_weight         1225.32

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'
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'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_symmetry_cell_setting           Monoclinic'
_symmetry_space_group_name_H-M   C2/c
_symmetry_space_group_name_Hall  '-C 2yc'

loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -y+1/2, z-1/2'

_cell_length_a                   28.877(4)
_cell_length_b                   11.9293(16)
_cell_length_c                   15.0065(19)
_cell_angle_alpha                90.00
_cell_angle_beta                 97.409(3)
_cell_angle_gamma                90.00
_cell_volume                     5126.3(12)
_cell_formula_units_Z            4
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    9898
_cell_measurement_theta_min      2.35
_cell_measurement_theta_max      28.35

_exptl_crystal_description       block
_exptl_crystal_colour            brown
_exptl_crystal_size_min          0.08
_exptl_crystal_size_mid          0.16
_exptl_crystal_size_max          0.17
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.588
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             2448
_exptl_absorpt_coefficient_mu    5.553
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.5718
_exptl_absorpt_correction_T_max  0.7457
_exptl_absorpt_process_details   SADABS

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      100(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            48669
_diffrn_reflns_av_R_equivalents  0.0333
_diffrn_reflns_av_sigmaI/netI    0.0196
_diffrn_reflns_limit_h_min       -38
_diffrn_reflns_limit_h_max       38
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_limit_l_max       20
_diffrn_reflns_theta_min         2.35
_diffrn_reflns_theta_max         28.35
_reflns_number_total             6381
_reflns_number_gt                5220
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       'Bruker APEX2'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXS-97 (Sheldrick 2008)'
_computing_structure_refinement  'SHELXL-2013 (Sheldrick 2013)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_refine_special_details          
; 
 Refinement of F² against ALL reflections.  The weighted R-factor wR and 
 goodness of fit S are based on F², conventional R-factors R are based 
 on F, with F set to zero for negative F². The threshold expression of 
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement.  R-factors based 
 on F² are statistically about twice as large as those based on F, and R- 
 factors based on ALL data will be even larger. 
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0266P)²+33.8851P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         6381
_refine_ls_number_parameters     404
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0307
_refine_ls_R_factor_gt           0.0201
_refine_ls_wR_factor_ref         0.0519
_refine_ls_wR_factor_gt          0.0462
_refine_ls_goodness_of_fit_ref   0.901
_refine_ls_restrained_S_all      0.901
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C 0.2745(2) 0.4215(6) 0.0068(4) 0.0203(13) Uani 0.499(4) 1 d P A 1
H1A H 0.2610 0.4093 0.0627 0.031 Uiso 0.499(4) 1 calc PR A 1
H1B H 0.3051 0.3851 0.0110 0.031 Uiso 0.499(4) 1 calc PR A 1
H1C H 0.2538 0.3895 -0.0436 0.031 Uiso 0.499(4) 1 calc PR A 1
C2 C 0.2271(2) 0.5859(6) -0.0088(4) 0.0196(13) Uani 0.499(4) 1 d P A 1
H2A H 0.2266 0.6674 -0.0170 0.029 Uiso 0.499(4) 1 calc PR A 1
H2B H 0.2158 0.5672 0.0482 0.029 Uiso 0.499(4) 1 calc PR A 1
H2C H 0.2069 0.5505 -0.0584 0.029 Uiso 0.499(4) 1 calc PR A 1
C3 C 0.2888(2) 0.5700(5) -0.0984(4) 0.0187(12) Uani 0.499(4) 1 d P A 1
H3A H 0.2834 0.6513 -0.1083 0.022 Uiso 0.499(4) 1 calc PR A 1
H3B H 0.2667 0.5289 -0.1427 0.022 Uiso 0.499(4) 1 calc PR A 1
C5 C 0.3940(2) 0.5542(6) -0.0527(4) 0.0180(12) Uani 0.499(4) 1 d P A 1
H5A H 0.4152 0.5952 -0.0881 0.022 Uiso 0.499(4) 1 calc PR A 1
H5B H 0.4077 0.4795 -0.0375 0.022 Uiso 0.499(4) 1 calc PR A 1
C6 C 0.4110(5) 0.7694(14) 0.0274(7) 0.021(2) Uani 0.499(4) 1 d P A 1
H6B H 0.4415 0.7621 0.0031 0.025 Uiso 0.499(4) 1 calc PR A 1
C7 C 0.3748(3) 0.8254(6) -0.0441(5) 0.0297(16) Uani 0.499(4) 1 d P A 1
H7B1 H 0.3448 0.8319 -0.0206 0.045 Uiso 0.499(4) 1 calc PR A 1
H7B2 H 0.3709 0.7795 -0.0988 0.045 Uiso 0.499(4) 1 calc PR A 1
H7B3 H 0.3858 0.9002 -0.0583 0.045 Uiso 0.499(4) 1 calc PR A 1
C8 C 0.4172(3) 0.8453(6) 0.1117(5) 0.0342(18) Uani 0.499(4) 1 d P A 1
H8B1 H 0.4243 0.9220 0.0941 0.051 Uiso 0.499(4) 1 calc PR A 1
H8B2 H 0.4430 0.8169 0.1545 0.051 Uiso 0.499(4) 1 calc PR A 1
H8B3 H 0.3884 0.8452 0.1397 0.051 Uiso 0.499(4) 1 calc PR A 1
C9 C 0.4437(2) 0.5692(6) 0.1238(5) 0.0187(13) Uani 0.499(4) 1 d P A 1
H9 H 0.4515 0.6231 0.1746 0.022 Uiso 0.499(4) 1 calc PR A 1
C10 C 0.4871(2) 0.5596(7) 0.0762(5) 0.0304(16) Uani 0.499(4) 1 d P A 1
H10A H 0.5133 0.5317 0.1185 0.046 Uiso 0.499(4) 1 calc PR A 1
H10B H 0.4950 0.6336 0.0539 0.046 Uiso 0.499(4) 1 calc PR A 1
H10C H 0.4810 0.5075 0.0256 0.046 Uiso 0.499(4) 1 calc PR A 1
C11 C 0.4317(2) 0.4580(7) 0.1652(5) 0.0291(16) Uani 0.499(4) 1 d P A 1
H11A H 0.4254 0.4016 0.1177 0.044 Uiso 0.499(4) 1 calc PR A 1
H11B H 0.4041 0.4675 0.1959 0.044 Uiso 0.499(4) 1 calc PR A 1
H11C H 0.4581 0.4334 0.2085 0.044 Uiso 0.499(4) 1 calc PR A 1
C13 C 0.3985(3) 0.7696(9) 0.2971(6) 0.0199(18) Uani 0.491(16) 1 d P B 1
H13 H 0.4107 0.7505 0.2433 0.024 Uiso 0.491(16) 1 calc PR B 1
C14 C 0.4273(2) 0.8221(9) 0.3664(6) 0.026(2) Uani 0.491(16) 1 d P B 1
H14 H 0.4594 0.8333 0.3617 0.031 Uiso 0.491(16) 1 calc PR B 1
C15 C 0.4089(4) 0.8575(10) 0.4413(8) 0.025(2) Uani 0.491(16) 1 d P B 1
H15 H 0.4284 0.8947 0.4880 0.030 Uiso 0.491(16) 1 calc PR B 1
C1B C 0.2520(3) 0.4529(6) 0.0250(4) 0.0224(14) Uani 0.501(4) 1 d P A 2
H1B1 H 0.2298 0.4857 0.0618 0.034 Uiso 0.501(4) 1 calc PR A 2
H1B2 H 0.2724 0.4001 0.0615 0.034 Uiso 0.501(4) 1 calc PR A 2
H1B3 H 0.2348 0.4131 -0.0261 0.034 Uiso 0.501(4) 1 calc PR A 2
C2B C 0.2537(2) 0.6219(5) -0.0597(4) 0.0178(12) Uani 0.501(4) 1 d P A 2
H2B1 H 0.2365 0.5862 -0.1128 0.027 Uiso 0.501(4) 1 calc PR A 2
H2B2 H 0.2747 0.6790 -0.0787 0.027 Uiso 0.501(4) 1 calc PR A 2
H2B3 H 0.2315 0.6572 -0.0240 0.027 Uiso 0.501(4) 1 calc PR A 2
C3B C 0.3113(2) 0.4751(5) -0.0684(4) 0.0165(12) Uani 0.501(4) 1 d P A 2
H3B1 H 0.3301 0.4196 -0.0302 0.020 Uiso 0.501(4) 1 calc PR A 2
H3B2 H 0.2905 0.4326 -0.1140 0.020 Uiso 0.501(4) 1 calc PR A 2
C5B C 0.3760(2) 0.6136(6) -0.0809(4) 0.0191(13) Uani 0.501(4) 1 d P A 2
H5B1 H 0.3673 0.6882 -0.1068 0.023 Uiso 0.501(4) 1 calc PR A 2
H5B2 H 0.4055 0.5910 -0.1032 0.023 Uiso 0.501(4) 1 calc PR A 2
C6B C 0.4195(5) 0.7655(14) 0.0556(7) 0.020(2) Uani 0.501(4) 1 d P A 2
H6 H 0.4399 0.7651 0.1147 0.024 Uiso 0.501(4) 1 calc PR A 2
C7B C 0.4529(2) 0.7806(6) -0.0172(5) 0.0267(15) Uani 0.501(4) 1 d P A 2
H7A H 0.4344 0.7942 -0.0757 0.040 Uiso 0.501(4) 1 calc PR A 2
H7B H 0.4716 0.7125 -0.0204 0.040 Uiso 0.501(4) 1 calc PR A 2
H7C H 0.4736 0.8445 -0.0013 0.040 Uiso 0.501(4) 1 calc PR A 2
C8B C 0.3886(2) 0.8649(6) 0.0572(5) 0.0298(16) Uani 0.501(4) 1 d P A 2
H8A H 0.4076 0.9311 0.0756 0.045 Uiso 0.501(4) 1 calc PR A 2
H8B H 0.3662 0.8520 0.1000 0.045 Uiso 0.501(4) 1 calc PR A 2
H8C H 0.3717 0.8772 -0.0029 0.045 Uiso 0.501(4) 1 calc PR A 2
C9B C 0.4312(2) 0.5252(6) 0.0790(5) 0.0230(14) Uani 0.501(4) 1 d P A 2
H9B H 0.4601 0.5463 0.0527 0.028 Uiso 0.501(4) 1 calc PR A 2
C10B C 0.4166(2) 0.4076(6) 0.0451(5) 0.0276(15) Uani 0.501(4) 1 d P A 2
H10D H 0.4406 0.3533 0.0690 0.041 Uiso 0.501(4) 1 calc PR A 2
H10E H 0.4132 0.4065 -0.0207 0.041 Uiso 0.501(4) 1 calc PR A 2
H10F H 0.3868 0.3877 0.0655 0.041 Uiso 0.501(4) 1 calc PR A 2
C11B C 0.4429(3) 0.5253(8) 0.1807(5) 0.0339(18) Uani 0.501(4) 1 d P A 2
H11D H 0.4144 0.5129 0.2082 0.051 Uiso 0.501(4) 1 calc PR A 2
H11E H 0.4566 0.5977 0.2004 0.051 Uiso 0.501(4) 1 calc PR A 2
H11F H 0.4653 0.4653 0.1989 0.051 Uiso 0.501(4) 1 calc PR A 2
C13B C 0.4006(2) 0.7160(11) 0.3199(6) 0.023(2) Uani 0.509(16) 1 d P B 2
H13B H 0.4134 0.6699 0.2776 0.028 Uiso 0.509(16) 1 calc PR B 2
C14B C 0.4292(2) 0.7549(10) 0.3940(5) 0.030(3) Uani 0.509(16) 1 d P B 2
H14B H 0.4617 0.7400 0.3997 0.036 Uiso 0.509(16) 1 calc PR B 2
C15B C 0.4110(4) 0.8155(11) 0.4603(7) 0.027(2) Uani 0.509(16) 1 d P B 2
H15B H 0.4308 0.8404 0.5120 0.033 Uiso 0.509(16) 1 calc PR B 2
C4 C 0.34209(13) 0.5392(3) -0.1136(2) 0.0288(8) Uani 1 1 d . . .
H4A H 0.3460 0.5768 -0.1710 0.035 Uiso 0.499(4) 1 calc PR A 1
H4B H 0.3406 0.4581 -0.1277 0.035 Uiso 0.499(4) 1 calc PR A 1
H4C H 0.3584 0.4836 -0.1475 0.035 Uiso 0.499(4) 1 calc PR A 2
H4D H 0.3215 0.5819 -0.1593 0.035 Uiso 0.499(4) 1 calc PR A 2
C12 C 0.35166(10) 0.7443(3) 0.3057(2) 0.0193(6) Uani 1 1 d . . .
C16 C 0.36273(12) 0.8397(3) 0.4497(2) 0.0238(7) Uani 1 1 d . . .
H16 H 0.3507 0.8588 0.5037 0.029 Uiso 1 1 calc R B 1
C17 C 0.33383(11) 0.7935(3) 0.3782(2) 0.0179(6) Uani 1 1 d . B .
H17 H 0.3010 0.7955 0.3786 0.021 Uiso 1 1 calc R . .
C18 C 0.32186(10) 0.6948(2) 0.23035(19) 0.0145(5) Uani 1 1 d . A .
C19 C 0.27907(10) 0.6600(2) 0.20591(19) 0.0147(5) Uani 1 1 d . . .
C20 C 0.23292(10) 0.6586(3) 0.23581(18) 0.0150(6) Uani 1 1 d . B .
C21 C 0.21449(10) 0.7538(3) 0.27310(19) 0.0174(6) Uani 1 1 d . . .
H21 H 0.2321 0.8212 0.2781 0.021 Uiso 1 1 calc R B .
C22 C 0.17101(11) 0.7515(3) 0.3028(2) 0.0237(7) Uani 1 1 d . B .
H22 H 0.1593 0.8170 0.3281 0.028 Uiso 1 1 calc R . .
C23 C 0.14446(12) 0.6541(3) 0.2958(2) 0.0300(8) Uani 1 1 d . . .
H23 H 0.1148 0.6526 0.3166 0.036 Uiso 1 1 calc R B .
C24 C 0.16171(12) 0.5590(3) 0.2582(2) 0.0288(7) Uani 1 1 d . B .
H24 H 0.1437 0.4922 0.2529 0.035 Uiso 1 1 calc R . .
C25 C 0.20515(11) 0.5613(3) 0.2281(2) 0.0204(6) Uani 1 1 d . . .
H25 H 0.2164 0.4959 0.2018 0.024 Uiso 1 1 calc R B .
N1 N 0.27977(9) 0.5407(2) -0.00748(17) 0.0192(5) Uani 1 1 d . . .
P1 P 0.38841(3) 0.62958(7) 0.04805(5) 0.01902(15) Uani 1 1 d . . .
Pt1 Pt 0.321158(3) 0.623554(9) 0.109555(6) 0.01270(4) Uani 1 1 d . A .
O100 O 0.5152(6) 1.1829(14) 0.1679(11) 0.164(6) Uiso 0.50 1 d P C -1
C100 C 0.5015(6) 1.1838(7) 0.2648(9) 0.057(3) Uiso 0.50 1 d P C -1
H99A H 0.4749 1.2348 0.2693 0.069 Uiso 0.50 1 calc PR C -1
H99B H 0.5282 1.2066 0.3092 0.069 Uiso 0.50 1 calc PR C -1
C103 C 0.5154(6) 1.0667(15) 0.1380(12) 0.108(5) Uiso 0.50 1 d P C -1
H99C H 0.4991 1.0595 0.0760 0.129 Uiso 0.50 1 calc PR C -1
H99D H 0.5478 1.0390 0.1393 0.129 Uiso 0.50 1 calc PR C -1
C101 C 0.4883(5) 1.0651(11) 0.2781(9) 0.071(3) Uiso 0.50 1 d P C -1
H99E H 0.5095 1.0319 0.3283 0.086 Uiso 0.50 1 calc PR C -1
H99F H 0.4560 1.0614 0.2935 0.086 Uiso 0.50 1 calc PR C -1
C102 C 0.4914(6) 1.0054(14) 0.1996(10) 0.095(5) Uiso 0.50 1 d P C -1
H99G H 0.4595 0.9872 0.1706 0.114 Uiso 0.50 1 calc PR C -1
H99H H 0.5079 0.9339 0.2148 0.114 Uiso 0.50 1 calc PR C -1


_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
C1 N1 1.449(7) . ?
C1 H1A 0.9800 . ?
C1 H1B 0.9800 . ?
C1 H1C 0.9800 . ?
C2 N1 1.611(6) . ?
C2 H2A 0.9800 . ?
C2 H2B 0.9800 . ?
C2 H2C 0.9800 . ?
C3 N1 1.463(6) . ?
C3 C4 1.628(7) . ?
C3 H3A 0.9900 . ?
C3 H3B 0.9900 . ?
C5 C4 1.661(7) . ?
C5 P1 1.784(6) . ?
C5 H5A 0.9900 . ?
C5 H5B 0.9900 . ?
C6 C8 1.547(15) . ?
C6 C7 1.549(14) . ?
C6 P1 1.831(16) . ?
C6 H6B 1.0000 . ?
C7 H7B1 0.9800 . ?
C7 H7B2 0.9800 . ?
C7 H7B3 0.9800 . ?
C8 H8B1 0.9800 . ?
C8 H8B2 0.9800 . ?
C8 H8B3 0.9800 . ?
C9 C11 1.523(10) . ?
C9 C10 1.525(8) . ?
C9 P1 1.974(7) . ?
C9 H9 1.0000 . ?
C10 H10A 0.9800 . ?
C10 H10B 0.9800 . ?
C10 H10C 0.9800 . ?
C11 H11A 0.9800 . ?
C11 H11B 0.9800 . ?
C11 H11C 0.9800 . ?
C13 C14 1.393(10) . ?
C13 C12 1.408(8) . ?
C13 H13 0.9500 . ?
C14 C15 1.370(14) . ?
C14 H14 0.9500 . ?
C15 C16 1.372(13) . ?
C15 H15 0.9500 . ?
C1B N1 1.443(7) . ?
C1B H1B1 0.9800 . ?
C1B H1B2 0.9800 . ?
C1B H1B3 0.9800 . ?
C2B N1 1.403(6) . ?
C2B H2B1 0.9800 . ?
C2B H2B2 0.9800 . ?
C2B H2B3 0.9800 . ?
C3B C4 1.410(7) . ?
C3B N1 1.580(6) . ?
C3B H3B1 0.9900 . ?
C3B H3B2 0.9900 . ?
C5B C4 1.365(7) . ?
C5B P1 1.932(5) . ?
C5B H5B1 0.9900 . ?
C5B H5B2 0.9900 . ?
C6B C8B 1.486(17) . ?
C6B C7B 1.558(16) . ?
C6B P1 1.850(16) . ?
C6B H6 1.0000 . ?
C7B H7A 0.9800 . ?
C7B H7B 0.9800 . ?
C7B H7C 0.9800 . ?
C8B H8A 0.9800 . ?
C8B H8B 0.9800 . ?
C8B H8C 0.9800 . ?
C9B C11B 1.519(10) . ?
C9B C10B 1.532(10) . ?
C9B P1 1.774(6) . ?
C9B H9B 1.0000 . ?
C10B H10D 0.9800 . ?
C10B H10E 0.9800 . ?
C10B H10F 0.9800 . ?
C11B H11D 0.9800 . ?
C11B H11E 0.9800 . ?
C11B H11F 0.9800 . ?
C13B C14B 1.375(9) . ?
C13B C12 1.443(8) . ?
C13B H13B 0.9500 . ?
C14B C15B 1.386(13) . ?
C14B H14B 0.9500 . ?
C15B C16 1.414(13) . ?
C15B H15B 0.9500 . ?
C4 H4A 0.9900 . ?
C4 H4B 0.9900 . ?
C4 H4C 0.9900 . ?
C4 H4D 0.9900 . ?
C12 C17 1.392(4) . ?
C12 C18 1.455(4) . ?
C16 C17 1.386(4) . ?
C16 H16 0.9500 . ?
C17 H17 0.9500 . ?
C18 C19 1.310(4) . ?
C18 Pt1 2.000(3) . ?
C19 C20 1.460(4) . ?
C19 Pt1 2.052(3) . ?
C20 C21 1.401(4) . ?
C20 C25 1.407(4) . ?
C21 C22 1.386(4) . ?
C21 H21 0.9500 . ?
C22 C23 1.389(5) . ?
C22 H22 0.9500 . ?
C23 C24 1.388(5) . ?
C23 H23 0.9500 . ?
C24 C25 1.387(4) . ?
C24 H24 0.9500 . ?
C25 H25 0.9500 . ?
N1 Pt1 2.225(2) . ?
P1 Pt1 2.2562(7) . ?
O100 C103 1.46(2) . ?
O100 C100 1.55(2) . ?
C100 C101 1.486(15) . ?
C100 H99A 0.9900 . ?
C100 H99B 0.9900 . ?
C103 C102 1.43(2) . ?
C103 H99C 0.9900 . ?
C103 H99D 0.9900 . ?
C101 C102 1.388(16) . ?
C101 H99E 0.9900 . ?
C101 H99F 0.9900 . ?
C102 H99G 0.9900 . ?
C102 H99H 0.9900 . ?

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 C1 H1A 109.5 . . ?
N1 C1 H1B 109.5 . . ?
N1 C1 H1C 109.5 . . ?
N1 C2 H2A 109.5 . . ?
N1 C2 H2B 109.5 . . ?
N1 C2 H2C 109.5 . . ?
N1 C3 C4 111.2(4) . . ?
N1 C3 H3A 109.4 . . ?
C4 C3 H3A 109.4 . . ?
N1 C3 H3B 109.4 . . ?
C4 C3 H3B 109.4 . . ?
H3A C3 H3B 108.0 . . ?
C4 C5 P1 110.3(3) . . ?
C4 C5 H5A 109.6 . . ?
P1 C5 H5A 109.6 . . ?
C4 C5 H5B 109.6 . . ?
P1 C5 H5B 109.6 . . ?
H5A C5 H5B 108.1 . . ?
C8 C6 C7 108.1(11) . . ?
C8 C6 P1 113.7(8) . . ?
C7 C6 P1 106.7(8) . . ?
C8 C6 H6B 109.4 . . ?
C7 C6 H6B 109.4 . . ?
P1 C6 H6B 109.4 . . ?
C11 C9 C10 111.7(6) . . ?
C11 C9 P1 110.0(5) . . ?
C10 C9 P1 114.2(5) . . ?
C11 C9 H9 106.8 . . ?
C10 C9 H9 106.8 . . ?
P1 C9 H9 106.8 . . ?
C14 C13 C12 121.0(6) . . ?
C14 C13 H13 119.5 . . ?
C12 C13 H13 119.5 . . ?
C15 C14 C13 119.7(8) . . ?
C15 C14 H14 120.2 . . ?
C13 C14 H14 120.2 . . ?
C14 C15 C16 120.7(8) . . ?
C14 C15 H15 119.7 . . ?
C16 C15 H15 119.7 . . ?
N1 C1B H1B1 109.5 . . ?
N1 C1B H1B2 109.5 . . ?
H1B1 C1B H1B2 109.5 . . ?
N1 C1B H1B3 109.5 . . ?
H1B1 C1B H1B3 109.5 . . ?
H1B2 C1B H1B3 109.5 . . ?
N1 C2B H2B1 109.5 . . ?
N1 C2B H2B2 109.5 . . ?
H2B1 C2B H2B2 109.5 . . ?
N1 C2B H2B3 109.5 . . ?
H2B1 C2B H2B3 109.5 . . ?
H2B2 C2B H2B3 109.5 . . ?
C4 C3B N1 117.1(4) . . ?
C4 C3B H3B1 108.0 . . ?
N1 C3B H3B1 108.0 . . ?
C4 C3B H3B2 108.0 . . ?
N1 C3B H3B2 108.0 . . ?
H3B1 C3B H3B2 107.3 . . ?
C4 C5B P1 117.1(4) . . ?
C4 C5B H5B1 108.0 . . ?
P1 C5B H5B1 108.0 . . ?
C4 C5B H5B2 108.0 . . ?
P1 C5B H5B2 108.0 . . ?
H5B1 C5B H5B2 107.3 . . ?
C8B C6B C7B 110.3(10) . . ?
C8B C6B P1 114.4(9) . . ?
C7B C6B P1 113.4(9) . . ?
C8B C6B H6 106.0 . . ?
C7B C6B H6 106.0 . . ?
P1 C6B H6 106.0 . . ?
C6B C7B H7A 109.5 . . ?
C6B C7B H7B 109.5 . . ?
H7A C7B H7B 109.5 . . ?
C6B C7B H7C 109.5 . . ?
H7A C7B H7C 109.5 . . ?
H7B C7B H7C 109.5 . . ?
C6B C8B H8A 109.5 . . ?
C6B C8B H8B 109.5 . . ?
H8A C8B H8B 109.5 . . ?
C6B C8B H8C 109.5 . . ?
H8A C8B H8C 109.5 . . ?
H8B C8B H8C 109.5 . . ?
C11B C9B C10B 110.5(6) . . ?
C11B C9B P1 108.6(5) . . ?
C10B C9B P1 113.8(5) . . ?
C11B C9B H9B 107.9 . . ?
C10B C9B H9B 107.9 . . ?
P1 C9B H9B 107.9 . . ?
C9B C10B H10D 109.5 . . ?
C9B C10B H10E 109.5 . . ?
H10D C10B H10E 109.5 . . ?
C9B C10B H10F 109.5 . . ?
H10D C10B H10F 109.5 . . ?
H10E C10B H10F 109.5 . . ?
C9B C11B H11D 109.5 . . ?
C9B C11B H11E 109.5 . . ?
H11D C11B H11E 109.5 . . ?
C9B C11B H11F 109.5 . . ?
H11D C11B H11F 109.5 . . ?
H11E C11B H11F 109.5 . . ?
C14B C13B C12 121.0(6) . . ?
C14B C13B H13B 119.5 . . ?
C12 C13B H13B 119.5 . . ?
C13B C14B C15B 120.9(7) . . ?
C13B C14B H14B 119.5 . . ?
C15B C14B H14B 119.5 . . ?
C14B C15B C16 119.0(8) . . ?
C14B C15B H15B 120.5 . . ?
C16 C15B H15B 120.5 . . ?
C5B C4 C3B 130.4(4) . . ?
C5B C4 C3 116.8(4) . . ?
C3B C4 C3 52.4(3) . . ?
C3B C4 C5 111.9(4) . . ?
C3 C4 C5 134.5(3) . . ?
C5B C4 H4A 82.0 . . ?
C3B C4 H4A 144.3 . . ?
C3 C4 H4A 103.6 . . ?
C5 C4 H4A 103.6 . . ?
C5B C4 H4B 136.2 . . ?
C3B C4 H4B 63.9 . . ?
C3 C4 H4B 103.6 . . ?
C5 C4 H4B 103.6 . . ?
H4A C4 H4B 105.3 . . ?
C5B C4 H4C 104.7 . . ?
C3B C4 H4C 104.7 . . ?
C3 C4 H4C 138.0 . . ?
C5 C4 H4C 84.3 . . ?
H4A C4 H4C 75.1 . . ?
C5B C4 H4D 104.7 . . ?
C3B C4 H4D 104.7 . . ?
C3 C4 H4D 59.1 . . ?
C5 C4 H4D 138.1 . . ?
H4B C4 H4D 110.4 . . ?
H4C C4 H4D 105.7 . . ?
C17 C12 C13 116.0(4) . . ?
C17 C12 C13B 115.9(4) . . ?
C17 C12 C18 122.5(3) . . ?
C13 C12 C18 119.7(4) . . ?
C13B C12 C18 119.4(4) . . ?
C15 C16 C17 119.1(5) . . ?
C17 C16 C15B 119.5(5) . . ?
C15 C16 H16 120.5 . . ?
C17 C16 H16 120.5 . . ?
C15B C16 H16 114.6 . . ?
C16 C17 C12 121.8(3) . . ?
C16 C17 H17 119.1 . . ?
C12 C17 H17 119.1 . . ?
C19 C18 C12 142.0(3) . . ?
C19 C18 Pt1 73.30(18) . . ?
C12 C18 Pt1 144.4(2) . . ?
C18 C19 C20 141.5(3) . . ?
C18 C19 Pt1 68.99(17) . . ?
C20 C19 Pt1 149.4(2) . . ?
C21 C20 C25 117.4(3) . . ?
C21 C20 C19 121.5(3) . . ?
C25 C20 C19 121.2(3) . . ?
C22 C21 C20 121.3(3) . . ?
C22 C21 H21 119.4 . . ?
C20 C21 H21 119.4 . . ?
C21 C22 C23 120.4(3) . . ?
C21 C22 H22 119.8 . . ?
C23 C22 H22 119.8 . . ?
C24 C23 C22 119.4(3) . . ?
C24 C23 H23 120.3 . . ?
C22 C23 H23 120.3 . . ?
C25 C24 C23 120.2(3) . . ?
C25 C24 H24 119.9 . . ?
C23 C24 H24 119.9 . . ?
C24 C25 C20 121.3(3) . . ?
C24 C25 H25 119.4 . . ?
C20 C25 H25 119.4 . . ?
C2B N1 C1B 114.1(4) . . ?
C2B N1 C1 134.5(4) . . ?
C2B N1 C3 57.4(3) . . ?
C1B N1 C3 131.5(4) . . ?
C1 N1 C3 114.0(4) . . ?
C2B N1 C3B 109.1(4) . . ?
C1B N1 C3B 102.9(4) . . ?
C1 N1 C3B 71.3(4) . . ?
C3 N1 C3B 52.7(3) . . ?
C2B N1 C2 47.5(3) . . ?
C1B N1 C2 71.4(4) . . ?
C1 N1 C2 102.3(4) . . ?
C3 N1 C2 100.9(4) . . ?
C3B N1 C2 140.6(3) . . ?
C2B N1 Pt1 109.2(3) . . ?
C1B N1 Pt1 108.8(3) . . ?
C1 N1 Pt1 112.0(3) . . ?
C3 N1 Pt1 119.2(3) . . ?
C3B N1 Pt1 112.7(3) . . ?
C2 N1 Pt1 105.7(3) . . ?
C9B P1 C5 74.5(3) . . ?
C9B P1 C6 115.6(5) . . ?
C5 P1 C6 104.0(5) . . ?
C9B P1 C6B 106.5(5) . . ?
C5 P1 C6B 113.4(5) . . ?
C9B P1 C5B 103.1(3) . . ?
C6 P1 C5B 86.8(4) . . ?
C6B P1 C5B 100.0(4) . . ?
C5 P1 C9 98.6(3) . . ?
C6 P1 C9 98.7(5) . . ?
C6B P1 C9 86.2(4) . . ?
C5B P1 C9 124.9(3) . . ?
C9B P1 Pt1 118.5(2) . . ?
C5 P1 Pt1 120.5(2) . . ?
C6 P1 Pt1 116.2(5) . . ?
C6B P1 Pt1 116.1(5) . . ?
C5B P1 Pt1 110.42(17) . . ?
C9 P1 Pt1 115.36(18) . . ?
C18 Pt1 C19 37.71(11) . . ?
C18 Pt1 N1 147.79(11) . . ?
C19 Pt1 N1 110.11(11) . . ?
C18 Pt1 P1 116.66(8) . . ?
C19 Pt1 P1 154.26(9) . . ?
N1 Pt1 P1 95.41(7) . . ?
C103 O100 C100 107.9(13) . . ?
O100 C100 C101 102.7(11) . . ?
O100 C100 H99A 111.2 . . ?
C101 C100 H99A 111.2 . . ?
O100 C100 H99B 111.2 . . ?
C101 C100 H99B 111.2 . . ?
H99A C100 H99B 109.1 . . ?
C102 C103 O100 105.4(15) . . ?
C102 C103 H99C 110.7 . . ?
O100 C103 H99C 110.7 . . ?
C102 C103 H99D 110.7 . . ?
O100 C103 H99D 110.7 . . ?
H99C C103 H99D 108.8 . . ?
C102 C101 C100 109.2(11) . . ?
C102 C101 H99E 109.8 . . ?
C100 C101 H99E 109.8 . . ?
C102 C101 H99F 109.8 . . ?
C100 C101 H99F 109.8 . . ?
H99E C101 H99F 108.3 . . ?
C101 C102 C103 112.1(14) . . ?
C101 C102 H99G 109.2 . . ?
C103 C102 H99G 109.2 . . ?
C101 C102 H99H 109.2 . . ?
C103 C102 H99H 109.2 . . ?
H99G C102 H99H 107.9 . . ?

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
C12 C13 C14 C15 -5.0(13) . . . . ?
C13 C14 C15 C16 1.3(14) . . . . ?
C12 C13B C14B C15B 4.7(15) . . . . ?
C13B C14B C15B C16 -1.7(15) . . . . ?
P1 C5B C4 C3B 4.8(8) . . . . ?
P1 C5B C4 C3 66.9(6) . . . . ?
P1 C5B C4 C5 -63.7(5) . . . . ?
N1 C3B C4 C5B 55.5(7) . . . . ?
N1 C3B C4 C3 -39.8(4) . . . . ?
N1 C3B C4 C5 90.3(5) . . . . ?
N1 C3 C4 C5B -80.5(6) . . . . ?
N1 C3 C4 C3B 41.2(4) . . . . ?
N1 C3 C4 C5 -43.2(7) . . . . ?
P1 C5 C4 C5B 67.1(5) . . . . ?
P1 C5 C4 C3B -63.0(5) . . . . ?
P1 C5 C4 C3 -4.9(7) . . . . ?
C14 C13 C12 C17 12.0(10) . . . . ?
C14 C13 C12 C13B -85.3(12) . . . . ?
C14 C13 C12 C18 176.8(6) . . . . ?
C14B C13B C12 C17 -11.9(11) . . . . ?
C14B C13B C12 C13 85.5(13) . . . . ?
C14B C13B C12 C18 -175.3(7) . . . . ?
C14 C15 C16 C17 -5.2(11) . . . . ?
C14 C15 C16 C15B 93(2) . . . . ?
C14B C15B C16 C15 -90(2) . . . . ?
C14B C15B C16 C17 6.2(11) . . . . ?
C15 C16 C17 C12 13.0(7) . . . . ?
C15B C16 C17 C12 -14.3(8) . . . . ?
C13 C12 C17 C16 -16.1(7) . . . . ?
C13B C12 C17 C16 16.7(7) . . . . ?
C18 C12 C17 C16 179.6(3) . . . . ?
C17 C12 C18 C19 -15.0(6) . . . . ?
C13 C12 C18 C19 -178.8(6) . . . . ?
C13B C12 C18 C19 147.4(7) . . . . ?
C17 C12 C18 Pt1 175.0(3) . . . . ?
C13 C12 C18 Pt1 11.2(8) . . . . ?
C13B C12 C18 Pt1 -22.7(8) . . . . ?
C12 C18 C19 C20 8.1(8) . . . . ?
Pt1 C18 C19 C20 -177.9(4) . . . . ?
C12 C18 C19 Pt1 -174.0(5) . . . . ?
C18 C19 C20 C21 43.6(6) . . . . ?
Pt1 C19 C20 C21 -132.6(4) . . . . ?
C18 C19 C20 C25 -136.5(4) . . . . ?
Pt1 C19 C20 C25 47.3(6) . . . . ?
C25 C20 C21 C22 1.2(4) . . . . ?
C19 C20 C21 C22 -178.9(3) . . . . ?
C20 C21 C22 C23 -0.3(5) . . . . ?
C21 C22 C23 C24 -0.4(5) . . . . ?
C22 C23 C24 C25 0.2(5) . . . . ?
C23 C24 C25 C20 0.7(5) . . . . ?
C21 C20 C25 C24 -1.4(5) . . . . ?
C19 C20 C25 C24 178.7(3) . . . . ?
C4 C3 N1 C2B 156.8(6) . . . . ?
C4 C3 N1 C1B -108.5(6) . . . . ?
C4 C3 N1 C1 -74.4(5) . . . . ?
C4 C3 N1 C3B -35.9(4) . . . . ?
C4 C3 N1 C2 176.7(4) . . . . ?
C4 C3 N1 Pt1 61.6(5) . . . . ?
C4 C3B N1 C2B 56.4(5) . . . . ?
C4 C3B N1 C1B 177.9(5) . . . . ?
C4 C3B N1 C1 -171.8(5) . . . . ?
C4 C3B N1 C3 45.1(5) . . . . ?
C4 C3B N1 C2 101.5(6) . . . . ?
C4 C3B N1 Pt1 -65.1(5) . . . . ?
C11B C9B P1 C5 -172.1(7) . . . . ?
C10B C9B P1 C5 -48.6(5) . . . . ?
C11B C9B P1 C6 89.5(7) . . . . ?
C10B C9B P1 C6 -147.0(6) . . . . ?
C11B C9B P1 C6B 77.6(7) . . . . ?
C10B C9B P1 C6B -158.9(6) . . . . ?
C11B C9B P1 C5B -177.7(6) . . . . ?
C10B C9B P1 C5B -54.2(5) . . . . ?
C11B C9B P1 C9 34.8(6) . . . . ?
C10B C9B P1 C9 158.3(9) . . . . ?
C11B C9B P1 Pt1 -55.5(7) . . . . ?
C10B C9B P1 Pt1 68.0(5) . . . . ?
C4 C5 P1 C9B 141.8(5) . . . . ?
C4 C5 P1 C6 -105.0(6) . . . . ?
C4 C5 P1 C6B -116.7(6) . . . . ?
C4 C5 P1 C5B -49.6(5) . . . . ?
C4 C5 P1 C9 153.7(4) . . . . ?
C4 C5 P1 Pt1 27.5(5) . . . . ?
C8 C6 P1 C9B -91.3(11) . . . . ?
C7 C6 P1 C9B 149.6(7) . . . . ?
C8 C6 P1 C5 -170.6(9) . . . . ?
C7 C6 P1 C5 70.3(9) . . . . ?
C8 C6 P1 C6B -38(3) . . . . ?
C7 C6 P1 C6B -158(5) . . . . ?
C8 C6 P1 C5B 165.8(10) . . . . ?
C7 C6 P1 C5B 46.6(8) . . . . ?
C8 C6 P1 C9 -69.4(10) . . . . ?
C7 C6 P1 C9 171.5(8) . . . . ?
C8 C6 P1 Pt1 54.5(10) . . . . ?
C7 C6 P1 Pt1 -64.6(8) . . . . ?
C8B C6B P1 C9B -163.7(7) . . . . ?
C7B C6B P1 C9B 68.6(7) . . . . ?
C8B C6B P1 C5 116.4(7) . . . . ?
C7B C6B P1 C5 -11.3(9) . . . . ?
C8B C6B P1 C6 65(4) . . . . ?
C7B C6B P1 C6 -63(4) . . . . ?
C8B C6B P1 C5B 89.4(7) . . . . ?
C7B C6B P1 C5B -38.3(8) . . . . ?
C8B C6B P1 C9 -145.8(7) . . . . ?
C7B C6B P1 C9 86.5(7) . . . . ?
C8B C6B P1 Pt1 -29.3(8) . . . . ?
C7B C6B P1 Pt1 -157.0(6) . . . . ?
C4 C5B P1 C9B 88.6(5) . . . . ?
C4 C5B P1 C5 77.3(7) . . . . ?
C4 C5B P1 C6 -155.8(7) . . . . ?
C4 C5B P1 C6B -161.8(7) . . . . ?
C4 C5B P1 C9 105.8(5) . . . . ?
C4 C5B P1 Pt1 -39.0(5) . . . . ?
C11 C9 P1 C9B -58.0(7) . . . . ?
C10 C9 P1 C9B 68.6(7) . . . . ?
C11 C9 P1 C5 -84.1(6) . . . . ?
C10 C9 P1 C5 42.4(6) . . . . ?
C11 C9 P1 C6 170.1(7) . . . . ?
C10 C9 P1 C6 -63.3(7) . . . . ?
C11 C9 P1 C6B 162.7(7) . . . . ?
C10 C9 P1 C6B -70.7(7) . . . . ?
C11 C9 P1 C5B -97.7(6) . . . . ?
C10 C9 P1 C5B 28.8(7) . . . . ?
C11 C9 P1 Pt1 45.6(6) . . . . ?
C10 C9 P1 Pt1 172.2(4) . . . . ?
C12 C18 Pt1 C19 173.6(5) . . . . ?
C19 C18 Pt1 N1 2.9(3) . . . . ?
C12 C18 Pt1 N1 176.5(3) . . . . ?
C19 C18 Pt1 P1 177.01(15) . . . . ?
C12 C18 Pt1 P1 -9.4(4) . . . . ?
C20 C19 Pt1 C18 177.5(5) . . . . ?
C18 C19 Pt1 N1 -178.38(17) . . . . ?
C20 C19 Pt1 N1 -0.9(5) . . . . ?
C18 C19 Pt1 P1 -6.2(3) . . . . ?
C20 C19 Pt1 P1 171.3(3) . . . . ?
C2B N1 Pt1 C18 75.7(4) . . . . ?
C1B N1 Pt1 C18 -49.3(4) . . . . ?
C1 N1 Pt1 C18 -84.7(4) . . . . ?
C3 N1 Pt1 C18 138.4(3) . . . . ?
C3B N1 Pt1 C18 -162.8(3) . . . . ?
C2 N1 Pt1 C18 26.0(4) . . . . ?
C2B N1 Pt1 C19 77.6(3) . . . . ?
C1B N1 Pt1 C19 -47.5(4) . . . . ?
C1 N1 Pt1 C19 -82.8(4) . . . . ?
C3 N1 Pt1 C19 140.3(3) . . . . ?
C3B N1 Pt1 C19 -160.9(3) . . . . ?
C2 N1 Pt1 C19 27.8(3) . . . . ?
C2B N1 Pt1 P1 -99.0(3) . . . . ?
C1B N1 Pt1 P1 135.9(4) . . . . ?
C1 N1 Pt1 P1 100.5(3) . . . . ?
C3 N1 Pt1 P1 -36.3(3) . . . . ?
C3B N1 Pt1 P1 22.4(3) . . . . ?
C2 N1 Pt1 P1 -148.8(3) . . . . ?
C9B P1 Pt1 C18 84.3(3) . . . . ?
C5 P1 Pt1 C18 172.3(3) . . . . ?
C6 P1 Pt1 C18 -60.6(3) . . . . ?
C6B P1 Pt1 C18 -44.5(4) . . . . ?
C5B P1 Pt1 C18 -157.3(3) . . . . ?
C9 P1 Pt1 C18 54.2(3) . . . . ?
C9B P1 Pt1 C19 88.5(4) . . . . ?
C5 P1 Pt1 C19 176.5(3) . . . . ?
C6 P1 Pt1 C19 -56.3(4) . . . . ?
C6B P1 Pt1 C19 -40.2(4) . . . . ?
C5B P1 Pt1 C19 -153.1(3) . . . . ?
C9 P1 Pt1 C19 58.5(3) . . . . ?
C9B P1 Pt1 N1 -98.9(3) . . . . ?
C5 P1 Pt1 N1 -10.8(3) . . . . ?
C6 P1 Pt1 N1 116.3(3) . . . . ?
C6B P1 Pt1 N1 132.4(4) . . . . ?
C5B P1 Pt1 N1 19.6(2) . . . . ?
C9 P1 Pt1 N1 -128.9(3) . . . . ?
C103 O100 C100 C101 -7.6(16) . . . . ?
C100 O100 C103 C102 14.8(18) . . . . ?
O100 C100 C101 C102 -2.8(17) . . . . ?
C100 C101 C102 C103 12.8(19) . . . . ?
O100 C103 C102 C101 -17(2) . . . . ?

_diffrn_measured_fraction_theta_max 0.997
_diffrn_reflns_theta_full        28.35
_diffrn_measured_fraction_theta_full 0.997
_refine_diff_density_max         1.613
_refine_diff_density_min         -0.601
_refine_diff_density_rms         0.105
