# Electronic Supplementary Material (ESI) for Journal of Materials Chemistry C.
# This journal is © The Royal Society of Chemistry 2017

####################################################################### 
# 
# 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_mx4090
_database_code_depnum_ccdc_archive 'CCDC 1542254'
_audit_update_record             
;
2017-04-05 deposited with the CCDC.
2017-07-03 downloaded from the CCDC.
;
_audit_creation_date             2015-09-15
_audit_creation_method           
;
Olex2 1.2
(compiled 2015.01.26 svn.r3150 for OlexSys, GUI svn.r4998)
;
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C35 H26 Cl2 N6 O Pt2, C6 H5 Cl, C6 H7 Cl'
_chemical_formula_sum            'C43 H0 Cl N0 O0 Pt2'
_chemical_formula_weight         942.06
_chemical_melting_point          ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
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'
Pt Pt -1.7033 8.3905 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   8.5256(17)
_cell_length_b                   16.023(3)
_cell_length_c                   17.850(4)
_cell_angle_alpha                66.28(3)
_cell_angle_beta                 84.01(3)
_cell_angle_gamma                76.94(3)
_cell_volume                     2174.4(9)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    8048
_cell_measurement_temperature    173.1500
_cell_measurement_theta_max      27.4855
_cell_measurement_theta_min      1.2463
_shelx_estimated_absorpt_T_max   ?
_shelx_estimated_absorpt_T_min   ?
_exptl_absorpt_coefficient_mu    6.510
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.5616
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   ?
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            red
_exptl_crystal_colour_primary    red
_exptl_crystal_density_diffrn    1.439
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       rod
_exptl_crystal_F_000             862
_exptl_crystal_size_max          0.22
_exptl_crystal_size_mid          0.04
_exptl_crystal_size_min          0.04
_exptl_special_details           
;
 ?
;
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0566
_diffrn_reflns_av_unetI/netI     0.0547
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.995
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_k_min       -20
_diffrn_reflns_limit_l_max       23
_diffrn_reflns_limit_l_min       -23
_diffrn_reflns_number            28469
_diffrn_reflns_point_group_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.995
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         27.517
_diffrn_reflns_theta_min         1.246
_diffrn_ambient_temperature      173.1500
_diffrn_detector_area_resol_mean 28.5714
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.995
_diffrn_measurement_details      
;
scan:
	Number of images: 360
	           Slice: -110.0000 - 70.0000
	     Image width: 0.5000
	        Exp time: 8.0000
	   Rotation axis: Omega
	           Omega: 0.0000
	             Chi: 45.0000
	             Phi: 180.0000
	             XTD: 40.0181
	          2theta: -20.2353
scan:
	Number of images: 360
	           Slice: -110.0000 - 70.0000
	     Image width: 0.5000
	        Exp time: 8.0000
	   Rotation axis: Omega
	           Omega: 0.0000
	             Chi: 45.0000
	             Phi: 270.0000
	             XTD: 40.0181
	          2theta: -20.2353
scan:
	Number of images: 330
	           Slice: -110.0000 - 55.0000
	     Image width: 0.5000
	        Exp time: 8.0000
	   Rotation axis: Omega
	           Omega: 0.0000
	             Chi: 45.0000
	             Phi: 0.0000
	             XTD: 40.0181
	          2theta: -20.2353
;
_diffrn_measurement_device       
;
Saturn724+ (2x2 bin mode)
;
_diffrn_measurement_device_details 
;
AFC10: Fixed Chi 2 circle
;
_diffrn_measurement_device_type  'multiwire proportional'
_diffrn_measurement_method       dtprofit.ref
_diffrn_number_total             9957
_diffrn_orient_matrix_type       d*Trek
_diffrn_orient_matrix_UB_11      -0.0589
_diffrn_orient_matrix_UB_12      0.0826
_diffrn_orient_matrix_UB_13      -0.0650
_diffrn_orient_matrix_UB_21      -0.0044
_diffrn_orient_matrix_UB_22      0.0268
_diffrn_orient_matrix_UB_23      0.0641
_diffrn_orient_matrix_UB_31      0.0525
_diffrn_orient_matrix_UB_32      0.0139
_diffrn_orient_matrix_UB_33      -0.0282
_diffrn_radiation_detector       CCD
_diffrn_radiation_monochromator  Confocal
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   'Rotating Anode'
_diffrn_source_current           24.0000
_diffrn_source_power             1.2000
_diffrn_source_voltage           50.0000
_diffrn_special_details          
;
 ?
;
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                9147
_reflns_number_total             9957
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'CrystalClear (Rigaku Inc., 2007)'
_computing_data_collection       'CrystalClear (Rigaku Inc., 2007)'
_computing_data_reduction        'CrystalClear (Rigaku Inc., 2007)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2008)'
_computing_structure_solution    
;
????
;
_refine_diff_density_max         6.638
_refine_diff_density_min         -2.501
_refine_diff_density_rms         0.339
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.604
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     473
_refine_ls_number_reflns         9957
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0775
_refine_ls_R_factor_gt           0.0721
_refine_ls_restrained_S_all      1.604
_refine_ls_shift/su_max          0.272
_refine_ls_shift/su_mean         0.030
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.1000P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2234
_refine_ls_wR_factor_ref         0.2286
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2.a Ternary CH refined with riding coordinates:
 C47(H46B)
2.b Secondary CH2 refined with riding coordinates:
 C42(H42A,H42B)
2.c Aromatic/amide H refined with riding coordinates:
 C1(H1), C2(H2), C3(H3), C4(H4), C7(H7), C9(H9), C13(H13), C14(H14), C15(H15),
 C16(H16), C21(H21), C25(H25), C27(H27), C28(H28), C29(H29), C30(H30), C32(H32),
  C33(H33), C34(H34), C35(H35), C37(H37), C38(H38), C39(H39), C40(H40),
 C41(H41), C43(H43), C44(H44), C45(H45), C46(H46A)
2.d Idealised Me refined as rotating group:
 C17(H17A,H17B,H17C), C19(H19A,H19B,H19C)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   ?
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt1 Pt 1.14134(4) 0.14824(2) 0.57856(2) 0.02570(15) Uani 1 1 d . . . . .
Pt2 Pt 0.36884(4) 0.28487(2) 0.57686(2) 0.02658(15) Uani 1 1 d . . . . .
Cl1 Cl 1.2485(3) 0.1364(2) 0.45285(15) 0.0388(6) Uani 1 1 d . . . . .
Cl2 Cl 0.2684(3) 0.40500(19) 0.44867(16) 0.0407(6) Uani 1 1 d . . . . .
O1 O 0.7537(9) 0.0245(7) 1.0169(4) 0.056(3) Uani 1 1 d . . . . .
N1 N 1.2833(9) 0.0330(6) 0.6603(5) 0.0284(17) Uani 1 1 d . . . . .
N2 N 0.9649(9) 0.2619(6) 0.5328(5) 0.0304(17) Uani 1 1 d . . . . .
N3 N 0.8039(10) 0.1411(7) 0.8978(5) 0.036(2) Uani 1 1 d . . . . .
N4 N 0.6974(10) 0.0191(6) 0.8969(5) 0.0350(19) Uani 1 1 d . . . . .
N5 N 0.2243(9) 0.3327(6) 0.6557(5) 0.0308(18) Uani 1 1 d . . . . .
N6 N 0.5470(9) 0.2085(6) 0.5328(5) 0.0287(17) Uani 1 1 d . . . . .
C1 C 1.4102(12) -0.0232(7) 0.6405(7) 0.034(2) Uani 1 1 d . . . . .
H1 H 1.4378 -0.0100 0.5857 0.041 Uiso 1 1 calc R . . . .
C2 C 1.4996(13) -0.0999(8) 0.7005(7) 0.042(3) Uani 1 1 d . . . . .
H2 H 1.5842 -0.1391 0.6864 0.050 Uiso 1 1 calc R . . . .
C3 C 1.4604(13) -0.1167(9) 0.7818(7) 0.046(3) Uani 1 1 d . . . . .
H3 H 1.5184 -0.1682 0.8227 0.055 Uiso 1 1 calc R . . . .
C4 C 1.3361(13) -0.0580(9) 0.8028(7) 0.040(3) Uani 1 1 d . . . . .
H4 H 1.3129 -0.0674 0.8573 0.048 Uiso 1 1 calc R . . . .
C5 C 1.2463(11) 0.0158(7) 0.7404(6) 0.031(2) Uani 1 1 d . . . . .
C6 C 1.1043(11) 0.0835(7) 0.7513(6) 0.0282(19) Uani 1 1 d . . . . .
C7 C 1.0273(11) 0.0830(8) 0.8246(6) 0.035(2) Uani 1 1 d . . . . .
H7 H 1.0668 0.0378 0.8745 0.042 Uiso 1 1 calc R . . . .
C8 C 0.8938(11) 0.1495(8) 0.8221(6) 0.030(2) Uani 1 1 d . . . . .
C9 C 0.8344(11) 0.2212(8) 0.7492(6) 0.032(2) Uani 1 1 d . . . . .
H9 H 0.7454 0.2670 0.7494 0.038 Uiso 1 1 calc R . . . .
C10 C 0.9116(11) 0.2227(7) 0.6757(6) 0.0274(19) Uani 1 1 d . . . . .
C11 C 1.0455(11) 0.1528(7) 0.6789(7) 0.032(2) Uani 1 1 d . . . . .
C12 C 0.8679(11) 0.2861(7) 0.5921(6) 0.027(2) Uani 1 1 d . . . . .
C13 C 0.7397(12) 0.3619(7) 0.5683(6) 0.032(2) Uani 1 1 d . . . . .
H13 H 0.6747 0.3782 0.6074 0.038 Uiso 1 1 calc R . . . .
C14 C 0.7096(12) 0.4129(7) 0.4858(6) 0.034(2) Uani 1 1 d . . . . .
H14 H 0.6260 0.4648 0.4697 0.041 Uiso 1 1 calc R . . . .
C15 C 0.8019(14) 0.3876(8) 0.4278(7) 0.035(2) Uani 1 1 d . . . . .
H15 H 0.7783 0.4197 0.3726 0.042 Uiso 1 1 calc R . . . .
C16 C 0.9330(13) 0.3118(7) 0.4538(6) 0.034(2) Uani 1 1 d . . . . .
H16 H 0.9994 0.2961 0.4147 0.040 Uiso 1 1 calc R . . . .
C17 C 0.8566(15) 0.1841(12) 0.9442(9) 0.062(4) Uani 1 1 d . . . . .
H17A H 0.9470 0.1428 0.9767 0.093 Uiso 1 1 calc GR . . . .
H17B H 0.7705 0.1974 0.9795 0.093 Uiso 1 1 calc GR . . . .
H17C H 0.8879 0.2409 0.9077 0.093 Uiso 1 1 calc GR . . . .
C18 C 0.7506(11) 0.0586(9) 0.9425(6) 0.040(3) Uani 1 1 d . . . . .
C19 C 0.6656(15) -0.0748(9) 0.9399(8) 0.057(4) Uani 1 1 d . . . . .
H19A H 0.7460 -0.1112 0.9807 0.086 Uiso 1 1 calc GR . . . .
H19B H 0.6690 -0.1034 0.9016 0.086 Uiso 1 1 calc GR . . . .
H19C H 0.5611 -0.0715 0.9657 0.086 Uiso 1 1 calc GR . . . .
C20 C 0.6131(12) 0.0752(8) 0.8207(6) 0.035(2) Uani 1 1 d . . . . .
C21 C 0.4761(11) 0.1436(7) 0.8229(6) 0.032(2) Uani 1 1 d . . . . .
H21 H 0.4377 0.1475 0.8724 0.038 Uiso 1 1 calc R . . . .
C22 C 0.4002(11) 0.2043(7) 0.7505(6) 0.029(2) Uani 1 1 d . . . . .
C23 C 0.4595(11) 0.1952(7) 0.6775(6) 0.030(2) Uani 1 1 d . . . . .
C24 C 0.5983(11) 0.1256(6) 0.6763(6) 0.0250(18) Uani 1 1 d . . . . .
C25 C 0.6717(12) 0.0657(8) 0.7489(6) 0.032(2) Uani 1 1 d . . . . .
H25 H 0.7601 0.0191 0.7496 0.038 Uiso 1 1 calc R . . . .
C26 C 0.2643(11) 0.2821(7) 0.7368(6) 0.031(2) Uani 1 1 d . . . . .
C27 C 0.1722(12) 0.3058(8) 0.7979(6) 0.040(3) Uani 1 1 d . . . . .
H27 H 0.1969 0.2709 0.8528 0.048 Uiso 1 1 calc R . . . .
C28 C 0.0469(14) 0.3800(9) 0.7766(7) 0.046(3) Uani 1 1 d . . . . .
H28 H -0.0117 0.3977 0.8167 0.056 Uiso 1 1 calc R . . . .
C29 C 0.0065(12) 0.4294(8) 0.6949(7) 0.040(2) Uani 1 1 d . . . . .
H29 H -0.0802 0.4796 0.6800 0.048 Uiso 1 1 calc R . . . .
C30 C 0.0956(11) 0.4035(7) 0.6361(6) 0.031(2) Uani 1 1 d . . . . .
H30 H 0.0663 0.4357 0.5815 0.037 Uiso 1 1 calc R . . . .
C31 C 0.6436(12) 0.1334(7) 0.5921(6) 0.030(2) Uani 1 1 d . . . . .
C32 C 0.7642(12) 0.0772(7) 0.5684(6) 0.032(2) Uani 1 1 d . . . . .
H32 H 0.8257 0.0261 0.6082 0.039 Uiso 1 1 calc R . . . .
C33 C 0.7975(13) 0.0937(7) 0.4880(6) 0.032(2) Uani 1 1 d . . . . .
H33 H 0.8822 0.0554 0.4729 0.038 Uiso 1 1 calc R . . . .
C34 C 0.7033(14) 0.1685(8) 0.4292(7) 0.038(3) Uani 1 1 d . . . . .
H34 H 0.7248 0.1812 0.3740 0.046 Uiso 1 1 calc R . . . .
C35 C 0.5765(12) 0.2246(7) 0.4531(6) 0.030(2) Uani 1 1 d . . . . .
H35 H 0.5113 0.2739 0.4135 0.036 Uiso 1 1 calc R . . . .
Cl3 Cl 0.936(2) 0.3749(12) -0.0039(11) 0.314(8) Uiso 1 1 d . . . . .
C36 C 0.979(5) 0.297(3) 0.103(3) 0.193(14) Uiso 1 1 d . . . . .
C37 C 1.071(5) 0.342(3) 0.134(3) 0.226(19) Uiso 1 1 d . . . . .
H37 H 1.1127 0.3954 0.1037 0.271 Uiso 1 1 calc R . . . .
C38 C 1.088(3) 0.283(2) 0.2291(19) 0.140(9) Uiso 1 1 d . . . . .
H38 H 1.1284 0.3058 0.2621 0.167 Uiso 1 1 calc R . . . .
C39 C 1.046(3) 0.2059(19) 0.2601(16) 0.122(8) Uiso 1 1 d . . . . .
H39 H 1.0628 0.1704 0.3156 0.147 Uiso 1 1 calc R . . . .
C40 C 0.974(2) 0.1701(13) 0.2148(12) 0.078(5) Uiso 1 1 d . . . . .
H40 H 0.9441 0.1125 0.2398 0.094 Uiso 1 1 calc R . . . .
C41 C 0.953(4) 0.214(3) 0.147(2) 0.166(12) Uiso 1 1 d . . . . .
H41 H 0.9116 0.1863 0.1182 0.199 Uiso 1 1 calc R . . . .
Cl4 Cl 0.5916(12) 0.6972(7) 0.0188(6) 0.176(3) Uiso 1 1 d . . . . .
C42 C 0.750(9) 0.506(6) 0.099(6) 0.57(7) Uiso 1 1 d . . . . .
H42A H 0.7519 0.4823 0.0562 0.685 Uiso 1 1 calc R . . . .
H42B H 0.8527 0.5191 0.1049 0.685 Uiso 1 1 calc R . . . .
C43 C 0.638(6) 0.453(3) 0.192(3) 0.241(19) Uiso 1 1 d . . . . .
H43 H 0.6859 0.3901 0.2162 0.289 Uiso 1 1 calc R . . . .
C44 C 0.505(5) 0.470(3) 0.243(3) 0.230(18) Uiso 1 1 d . . . . .
H44 H 0.4598 0.4223 0.2821 0.277 Uiso 1 1 calc R . . . .
C45 C 0.458(3) 0.548(2) 0.2324(17) 0.123(8) Uiso 1 1 d . . . . .
H45 H 0.3994 0.5631 0.2738 0.148 Uiso 1 1 calc R . . . .
C46 C 0.484(2) 0.6124(15) 0.1655(13) 0.093(6) Uiso 1 1 d . . . . .
H46A H 0.4492 0.6739 0.1599 0.112 Uiso 1 1 calc R . . . .
C47 C 0.554(3) 0.5957(19) 0.1072(17) 0.134(9) Uiso 1 1 d . . . . .
H46B H 0.4706 0.5769 0.0870 0.160 Uiso 1 1 calc R . . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Pt1 Pt2 3.2262(9) 1_655 ?
Pt1 Cl1 2.396(2) . ?
Pt1 N1 2.048(8) . ?
Pt1 N2 2.017(8) . ?
Pt1 C11 1.912(10) . ?
Pt2 Pt1 3.2263(9) 1_455 ?
Pt2 Cl2 2.407(3) . ?
Pt2 N5 2.040(8) . ?
Pt2 N6 2.027(8) . ?
Pt2 C23 1.898(10) . ?
O1 C18 1.217(12) . ?
N1 C1 1.356(12) . ?
N1 C5 1.359(12) . ?
N2 C12 1.399(13) . ?
N2 C16 1.333(13) . ?
N3 C8 1.454(11) . ?
N3 C17 1.429(15) . ?
N3 C18 1.392(15) . ?
N4 C18 1.375(15) . ?
N4 C19 1.463(15) . ?
N4 C20 1.449(12) . ?
N5 C26 1.380(12) . ?
N5 C30 1.347(12) . ?
N6 C31 1.399(12) . ?
N6 C35 1.346(12) . ?
C1 H1 0.9300 . ?
C1 C2 1.388(15) . ?
C2 H2 0.9300 . ?
C2 C3 1.384(16) . ?
C3 H3 0.9300 . ?
C3 C4 1.378(15) . ?
C4 H4 0.9300 . ?
C4 C5 1.391(15) . ?
C5 C6 1.486(13) . ?
C6 C7 1.400(13) . ?
C6 C11 1.372(14) . ?
C7 H7 0.9300 . ?
C7 C8 1.363(14) . ?
C8 C9 1.394(14) . ?
C9 H9 0.9300 . ?
C9 C10 1.399(13) . ?
C10 C11 1.394(13) . ?
C10 C12 1.457(13) . ?
C12 C13 1.389(14) . ?
C13 H13 0.9300 . ?
C13 C14 1.384(14) . ?
C14 H14 0.9300 . ?
C14 C15 1.371(15) . ?
C15 H15 0.9300 . ?
C15 C16 1.407(16) . ?
C16 H16 0.9300 . ?
C17 H17A 0.9600 . ?
C17 H17B 0.9600 . ?
C17 H17C 0.9600 . ?
C19 H19A 0.9600 . ?
C19 H19B 0.9600 . ?
C19 H19C 0.9600 . ?
C20 C21 1.418(13) . ?
C20 C25 1.381(13) . ?
C21 H21 0.9300 . ?
C21 C22 1.383(12) . ?
C22 C23 1.398(14) . ?
C22 C26 1.455(13) . ?
C23 C24 1.436(13) . ?
C24 C25 1.374(13) . ?
C24 C31 1.474(14) . ?
C25 H25 0.9300 . ?
C26 C27 1.405(13) . ?
C27 H27 0.9300 . ?
C27 C28 1.359(15) . ?
C28 H28 0.9300 . ?
C28 C29 1.388(16) . ?
C29 H29 0.9300 . ?
C29 C30 1.376(14) . ?
C30 H30 0.9300 . ?
C31 C32 1.358(15) . ?
C32 H32 0.9300 . ?
C32 C33 1.361(14) . ?
C33 H33 0.9300 . ?
C33 C34 1.382(15) . ?
C34 H34 0.9300 . ?
C34 C35 1.389(16) . ?
C35 H35 0.9300 . ?
Cl3 C36 1.83(4) . ?
C36 C37 1.45(5) . ?
C36 C41 1.30(4) . ?
C37 H37 0.9300 . ?
C37 C38 1.58(5) . ?
C38 H38 0.9300 . ?
C38 C39 1.26(3) . ?
C39 H39 0.9300 . ?
C39 C40 1.41(3) . ?
C40 H40 0.9300 . ?
C40 C41 1.14(3) . ?
C41 H41 0.9300 . ?
Cl4 C47 1.82(3) . ?
C42 H42A 0.9700 . ?
C42 H42B 0.9700 . ?
C42 C43 1.83(9) . ?
C42 C47 1.98(8) . ?
C43 H43 0.9300 . ?
C43 C44 1.42(5) . ?
C44 H44 0.9300 . ?
C44 C45 1.17(4) . ?
C45 H45 0.9300 . ?
C45 C46 1.26(3) . ?
C46 H46A 0.9300 . ?
C46 C47 1.24(3) . ?
C47 H46B 0.9800 . ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
Cl1 Pt1 Pt2 94.72(7) . 1_655 ?
N1 Pt1 Pt2 93.0(2) . 1_655 ?
N1 Pt1 Cl1 99.9(2) . . ?
N2 Pt1 Pt2 87.8(2) . 1_655 ?
N2 Pt1 Cl1 99.0(2) . . ?
N2 Pt1 N1 161.0(3) . . ?
C11 Pt1 Pt2 89.1(3) . 1_655 ?
C11 Pt1 Cl1 176.1(3) . . ?
C11 Pt1 N1 80.2(4) . . ?
C11 Pt1 N2 80.8(4) . . ?
Cl2 Pt2 Pt1 94.01(8) . 1_455 ?
N5 Pt2 Pt1 94.3(2) . 1_455 ?
N5 Pt2 Cl2 99.6(2) . . ?
N6 Pt2 Pt1 87.0(2) . 1_455 ?
N6 Pt2 Cl2 98.6(2) . . ?
N6 Pt2 N5 161.5(3) . . ?
C23 Pt2 Pt1 90.1(3) . 1_455 ?
C23 Pt2 Cl2 175.8(3) . . ?
C23 Pt2 N5 80.6(4) . . ?
C23 Pt2 N6 81.0(4) . . ?
C1 N1 Pt1 125.5(7) . . ?
C1 N1 C5 119.5(9) . . ?
C5 N1 Pt1 115.0(6) . . ?
C12 N2 Pt1 114.4(6) . . ?
C16 N2 Pt1 126.0(7) . . ?
C16 N2 C12 119.5(9) . . ?
C8 N3 C17 114.9(9) . . ?
C18 N3 C8 118.2(8) . . ?
C18 N3 C17 116.3(10) . . ?
C18 N4 C19 117.4(9) . . ?
C18 N4 C20 121.8(9) . . ?
C20 N4 C19 116.1(9) . . ?
C26 N5 Pt2 113.7(6) . . ?
C30 N5 Pt2 126.7(7) . . ?
C30 N5 C26 119.5(8) . . ?
C31 N6 Pt2 115.2(6) . . ?
C35 N6 Pt2 125.3(7) . . ?
C35 N6 C31 119.5(8) . . ?
N1 C1 H1 119.4 . . ?
N1 C1 C2 121.2(9) . . ?
C2 C1 H1 119.4 . . ?
C1 C2 H2 120.7 . . ?
C1 C2 C3 118.7(10) . . ?
C3 C2 H2 120.7 . . ?
C2 C3 H3 119.7 . . ?
C4 C3 C2 120.7(11) . . ?
C4 C3 H3 119.7 . . ?
C3 C4 H4 120.8 . . ?
C5 C4 C3 118.3(10) . . ?
C5 C4 H4 120.8 . . ?
N1 C5 C4 121.5(9) . . ?
N1 C5 C6 112.5(9) . . ?
C4 C5 C6 125.9(9) . . ?
C7 C6 C5 127.8(9) . . ?
C11 C6 C5 113.5(9) . . ?
C11 C6 C7 118.8(9) . . ?
C6 C7 H7 120.3 . . ?
C8 C7 C6 119.3(9) . . ?
C8 C7 H7 120.3 . . ?
C7 C8 N3 118.4(9) . . ?
C7 C8 C9 122.4(9) . . ?
C9 C8 N3 119.0(8) . . ?
C8 C9 H9 120.7 . . ?
C8 C9 C10 118.6(9) . . ?
C10 C9 H9 120.7 . . ?
C9 C10 C12 129.0(9) . . ?
C11 C10 C9 118.4(9) . . ?
C11 C10 C12 112.5(9) . . ?
C6 C11 Pt1 118.6(7) . . ?
C6 C11 C10 122.5(9) . . ?
C10 C11 Pt1 118.7(8) . . ?
N2 C12 C10 113.5(8) . . ?
C13 C12 N2 119.9(9) . . ?
C13 C12 C10 126.6(9) . . ?
C12 C13 H13 120.3 . . ?
C12 C13 C14 119.5(10) . . ?
C14 C13 H13 120.3 . . ?
C13 C14 H14 119.7 . . ?
C15 C14 C13 120.6(10) . . ?
C15 C14 H14 119.7 . . ?
C14 C15 H15 120.7 . . ?
C14 C15 C16 118.5(10) . . ?
C16 C15 H15 120.8 . . ?
N2 C16 C15 121.9(10) . . ?
N2 C16 H16 119.0 . . ?
C15 C16 H16 119.0 . . ?
N3 C17 H17A 109.5 . . ?
N3 C17 H17B 109.5 . . ?
N3 C17 H17C 109.4 . . ?
H17A C17 H17B 109.5 . . ?
H17A C17 H17C 109.5 . . ?
H17B C17 H17C 109.5 . . ?
O1 C18 N3 121.1(11) . . ?
O1 C18 N4 123.4(12) . . ?
N4 C18 N3 115.5(8) . . ?
N4 C19 H19A 109.4 . . ?
N4 C19 H19B 109.5 . . ?
N4 C19 H19C 109.5 . . ?
H19A C19 H19B 109.5 . . ?
H19A C19 H19C 109.5 . . ?
H19B C19 H19C 109.5 . . ?
C21 C20 N4 117.0(9) . . ?
C25 C20 N4 120.5(9) . . ?
C25 C20 C21 122.3(9) . . ?
C20 C21 H21 120.5 . . ?
C22 C21 C20 119.1(9) . . ?
C22 C21 H21 120.5 . . ?
C21 C22 C23 118.9(9) . . ?
C21 C22 C26 129.1(9) . . ?
C23 C22 C26 112.0(8) . . ?
C22 C23 Pt2 119.2(7) . . ?
C22 C23 C24 121.4(9) . . ?
C24 C23 Pt2 119.1(7) . . ?
C23 C24 C31 111.4(8) . . ?
C25 C24 C23 118.9(9) . . ?
C25 C24 C31 129.6(9) . . ?
C20 C25 H25 120.3 . . ?
C24 C25 C20 119.4(9) . . ?
C24 C25 H25 120.3 . . ?
N5 C26 C22 114.4(8) . . ?
N5 C26 C27 119.8(9) . . ?
C27 C26 C22 125.7(9) . . ?
C26 C27 H27 120.1 . . ?
C28 C27 C26 119.7(10) . . ?
C28 C27 H27 120.1 . . ?
C27 C28 H28 120.1 . . ?
C27 C28 C29 119.8(11) . . ?
C29 C28 H28 120.1 . . ?
C28 C29 H29 120.2 . . ?
C30 C29 C28 119.6(10) . . ?
C30 C29 H29 120.2 . . ?
N5 C30 C29 121.5(10) . . ?
N5 C30 H30 119.2 . . ?
C29 C30 H30 119.3 . . ?
N6 C31 C24 113.2(8) . . ?
C32 C31 N6 119.4(9) . . ?
C32 C31 C24 127.4(9) . . ?
C31 C32 H32 119.1 . . ?
C31 C32 C33 121.8(10) . . ?
C33 C32 H32 119.1 . . ?
C32 C33 H33 120.5 . . ?
C32 C33 C34 118.9(10) . . ?
C34 C33 H33 120.6 . . ?
C33 C34 H34 120.1 . . ?
C35 C34 C33 119.7(10) . . ?
C35 C34 H34 120.2 . . ?
N6 C35 C34 120.7(9) . . ?
N6 C35 H35 119.6 . . ?
C34 C35 H35 119.7 . . ?
C37 C36 Cl3 106(3) . . ?
C41 C36 Cl3 132(4) . . ?
C41 C36 C37 122(4) . . ?
C36 C37 H37 126.6 . . ?
C36 C37 C38 106(4) . . ?
C38 C37 H37 126.9 . . ?
C37 C38 H38 120.0 . . ?
C39 C38 C37 120(3) . . ?
C39 C38 H38 120.3 . . ?
C38 C39 H39 118.5 . . ?
C38 C39 C40 123(3) . . ?
C40 C39 H39 118.3 . . ?
C39 C40 H40 121.0 . . ?
C41 C40 C39 118(3) . . ?
C41 C40 H40 120.9 . . ?
C36 C41 H41 115.8 . . ?
C40 C41 C36 129(4) . . ?
C40 C41 H41 115.2 . . ?
H42A C42 H42B 113.7 . . ?
C43 C42 H42A 116.5 . . ?
C43 C42 H42B 117.1 . . ?
C43 C42 C47 70(4) . . ?
C47 C42 H42A 116.2 . . ?
C47 C42 H42B 117.0 . . ?
C42 C43 H43 107.7 . . ?
C44 C43 C42 145(5) . . ?
C44 C43 H43 107.8 . . ?
C43 C44 H44 122.5 . . ?
C45 C44 C43 115(5) . . ?
C45 C44 H44 122.4 . . ?
C44 C45 H45 119.3 . . ?
C44 C45 C46 121(4) . . ?
C46 C45 H45 119.5 . . ?
C45 C46 H46A 119.1 . . ?
C47 C46 C45 122(3) . . ?
C47 C46 H46A 119.2 . . ?
Cl4 C47 C42 98(3) . . ?
Cl4 C47 H46B 102.0 . . ?
C42 C47 H46B 102.3 . . ?
C46 C47 Cl4 115(2) . . ?
C46 C47 C42 133(4) . . ?
C46 C47 H46B 101.8 . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
Pt1 Pt2 C23 C22 -97.5(8) 1_455 . . . ?
Pt1 Pt2 C23 C24 89.0(7) 1_455 . . . ?
Pt1 N1 C1 C2 179.9(8) . . . . ?
Pt1 N1 C5 C4 -177.5(8) . . . . ?
Pt1 N1 C5 C6 2.3(10) . . . . ?
Pt1 N2 C12 C10 -1.4(10) . . . . ?
Pt1 N2 C12 C13 -178.5(7) . . . . ?
Pt1 N2 C16 C15 176.7(8) . . . . ?
Pt2 N5 C26 C22 -0.5(11) . . . . ?
Pt2 N5 C26 C27 -178.4(8) . . . . ?
Pt2 N5 C30 C29 179.8(8) . . . . ?
Pt2 N6 C31 C24 -1.2(10) . . . . ?
Pt2 N6 C31 C32 178.8(8) . . . . ?
Pt2 N6 C35 C34 179.2(8) . . . . ?
Pt2 C23 C24 C25 174.6(7) . . . . ?
Pt2 C23 C24 C31 -3.1(11) . . . . ?
N1 C1 C2 C3 -2.1(17) . . . . ?
N1 C5 C6 C7 175.6(9) . . . . ?
N1 C5 C6 C11 -3.9(12) . . . . ?
N2 C12 C13 C14 -0.1(15) . . . . ?
N3 C8 C9 C10 -172.9(9) . . . . ?
N4 C20 C21 C22 174.3(9) . . . . ?
N4 C20 C25 C24 -173.9(10) . . . . ?
N5 Pt2 C23 C22 -3.2(7) . . . . ?
N5 Pt2 C23 C24 -176.7(8) . . . . ?
N5 C26 C27 C28 -1.7(18) . . . . ?
N6 Pt2 C23 C22 175.5(8) . . . . ?
N6 Pt2 C23 C24 2.0(7) . . . . ?
N6 C31 C32 C33 2.3(15) . . . . ?
C1 N1 C5 C4 0.3(15) . . . . ?
C1 N1 C5 C6 -179.8(9) . . . . ?
C1 C2 C3 C4 -0.7(19) . . . . ?
C2 C3 C4 C5 3.2(19) . . . . ?
C3 C4 C5 N1 -3.0(17) . . . . ?
C3 C4 C5 C6 177.2(11) . . . . ?
C4 C5 C6 C7 -4.6(17) . . . . ?
C4 C5 C6 C11 175.9(10) . . . . ?
C5 N1 C1 C2 2.3(15) . . . . ?
C5 C6 C7 C8 -177.5(10) . . . . ?
C5 C6 C11 Pt1 3.9(12) . . . . ?
C5 C6 C11 C10 179.2(9) . . . . ?
C6 C7 C8 N3 172.3(9) . . . . ?
C6 C7 C8 C9 -3.0(16) . . . . ?
C7 C6 C11 Pt1 -175.6(7) . . . . ?
C7 C6 C11 C10 -0.3(15) . . . . ?
C7 C8 C9 C10 2.4(16) . . . . ?
C8 N3 C18 O1 141.0(9) . . . . ?
C8 N3 C18 N4 -38.2(12) . . . . ?
C8 C9 C10 C11 -0.7(15) . . . . ?
C8 C9 C10 C12 176.1(10) . . . . ?
C9 C10 C11 Pt1 175.0(7) . . . . ?
C9 C10 C11 C6 -0.3(15) . . . . ?
C9 C10 C12 N2 -174.6(10) . . . . ?
C9 C10 C12 C13 2.2(18) . . . . ?
C10 C12 C13 C14 -176.8(9) . . . . ?
C11 C6 C7 C8 1.9(15) . . . . ?
C11 C10 C12 N2 2.3(12) . . . . ?
C11 C10 C12 C13 179.2(10) . . . . ?
C12 N2 C16 C15 -1.3(15) . . . . ?
C12 C10 C11 Pt1 -2.3(12) . . . . ?
C12 C10 C11 C6 -177.6(9) . . . . ?
C12 C13 C14 C15 2.0(16) . . . . ?
C13 C14 C15 C16 -3.4(16) . . . . ?
C14 C15 C16 N2 3.1(16) . . . . ?
C16 N2 C12 C10 176.9(9) . . . . ?
C16 N2 C12 C13 -0.2(14) . . . . ?
C17 N3 C8 C7 88.9(13) . . . . ?
C17 N3 C8 C9 -95.7(12) . . . . ?
C17 N3 C18 O1 -1.9(14) . . . . ?
C17 N3 C18 N4 178.8(9) . . . . ?
C18 N3 C8 C7 -54.6(12) . . . . ?
C18 N3 C8 C9 120.9(10) . . . . ?
C18 N4 C20 C21 -53.5(14) . . . . ?
C18 N4 C20 C25 122.4(12) . . . . ?
C19 N4 C18 O1 -9.2(14) . . . . ?
C19 N4 C18 N3 170.1(9) . . . . ?
C19 N4 C20 C21 101.7(13) . . . . ?
C19 N4 C20 C25 -82.4(13) . . . . ?
C20 N4 C18 O1 145.7(10) . . . . ?
C20 N4 C18 N3 -35.1(12) . . . . ?
C20 C21 C22 C23 1.1(15) . . . . ?
C20 C21 C22 C26 -176.7(11) . . . . ?
C21 C20 C25 C24 1.7(17) . . . . ?
C21 C22 C23 Pt2 -174.4(8) . . . . ?
C21 C22 C23 C24 -1.0(15) . . . . ?
C21 C22 C26 N5 176.0(10) . . . . ?
C21 C22 C26 C27 -6.3(18) . . . . ?
C22 C23 C24 C25 1.3(14) . . . . ?
C22 C23 C24 C31 -176.4(9) . . . . ?
C22 C26 C27 C28 -179.3(11) . . . . ?
C23 C22 C26 N5 -1.9(13) . . . . ?
C23 C22 C26 C27 175.8(11) . . . . ?
C23 C24 C25 C20 -1.5(15) . . . . ?
C23 C24 C31 N6 2.6(12) . . . . ?
C23 C24 C31 C32 -177.3(10) . . . . ?
C24 C31 C32 C33 -177.8(9) . . . . ?
C25 C20 C21 C22 -1.5(17) . . . . ?
C25 C24 C31 N6 -174.8(10) . . . . ?
C25 C24 C31 C32 5.3(18) . . . . ?
C26 N5 C30 C29 2.8(15) . . . . ?
C26 C22 C23 Pt2 3.8(12) . . . . ?
C26 C22 C23 C24 177.1(9) . . . . ?
C26 C27 C28 C29 2.7(19) . . . . ?
C27 C28 C29 C30 -1.0(18) . . . . ?
C28 C29 C30 N5 -1.8(16) . . . . ?
C30 N5 C26 C22 176.8(9) . . . . ?
C30 N5 C26 C27 -1.0(15) . . . . ?
C31 N6 C35 C34 -1.1(14) . . . . ?
C31 C24 C25 C20 175.7(10) . . . . ?
C31 C32 C33 C34 -1.6(16) . . . . ?
C32 C33 C34 C35 -0.5(16) . . . . ?
C33 C34 C35 N6 1.8(16) . . . . ?
C35 N6 C31 C24 179.1(8) . . . . ?
C35 N6 C31 C32 -1.0(14) . . . . ?
Cl3 C36 C37 C38 172(2) . . . . ?
Cl3 C36 C41 C40 -175(3) . . . . ?
C36 C37 C38 C39 10(5) . . . . ?
C37 C36 C41 C40 12(7) . . . . ?
C37 C38 C39 C40 -4(4) . . . . ?
C38 C39 C40 C41 0(4) . . . . ?
C39 C40 C41 C36 -4(6) . . . . ?
C41 C36 C37 C38 -14(6) . . . . ?
C42 C43 C44 C45 -18(11) . . . . ?
C43 C44 C45 C46 22(6) . . . . ?
C44 C45 C46 C47 3(5) . . . . ?
C45 C46 C47 Cl4 -176(2) . . . . ?
C45 C46 C47 C42 -45(6) . . . . ?
C47 C42 C43 C44 -7(10) . . . . ?

_shelx_SHELXL_version_number     2014/7
_olex2_submission_special_instructions 'No special instructions were received'
####################################################################### 
# 
# 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_mx4090_sq
_database_code_depnum_ccdc_archive 'CCDC 1427840'
_audit_update_record             
;
2015-09-28 deposited with the CCDC.
2017-07-03 downloaded from the CCDC.
;
_audit_creation_date             2015-09-15
_audit_creation_method           
;
Olex2 1.2
(compiled 2015.01.26 svn.r3150 for OlexSys, GUI svn.r4998)
;
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C35 H26 Cl2 N6 O Pt2'
_chemical_formula_sum            'C35 H26 Cl2 N6 O Pt2'
_chemical_formula_weight         1007.70
_chemical_melting_point          ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
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'
Pt Pt -1.7033 8.3905 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   8.5256(17)
_cell_length_b                   16.023(3)
_cell_length_c                   17.850(8)
_cell_angle_alpha                66.275(8)
_cell_angle_beta                 84.005(11)
_cell_angle_gamma                76.938(10)
_cell_volume                     2174.3(11)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    8048
_cell_measurement_temperature    173.1500
_cell_measurement_theta_max      27.4855
_cell_measurement_theta_min      1.2463
_shelx_estimated_absorpt_T_max   ?
_shelx_estimated_absorpt_T_min   ?
_exptl_absorpt_coefficient_mu    6.579
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.5616
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'CrystalClear (Rigaku Inc., 2007)'
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            red
_exptl_crystal_colour_primary    red
_exptl_crystal_density_diffrn    1.539
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       rod
_exptl_crystal_F_000             952
_exptl_crystal_size_max          0.22
_exptl_crystal_size_mid          0.04
_exptl_crystal_size_min          0.04
_exptl_special_details           
;
 ?
;
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0566
_diffrn_reflns_av_unetI/netI     0.0548
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.995
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_k_min       -20
_diffrn_reflns_limit_l_max       23
_diffrn_reflns_limit_l_min       -23
_diffrn_reflns_number            28462
_diffrn_reflns_point_group_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.995
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         27.517
_diffrn_reflns_theta_min         1.477
_diffrn_ambient_temperature      173.1500
_diffrn_detector_area_resol_mean 28.5714
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.995
_diffrn_measurement_details      
;
scan:
	Number of images: 360
	           Slice: -110.0000 - 70.0000
	     Image width: 0.5000
	        Exp time: 8.0000
	   Rotation axis: Omega
	           Omega: 0.0000
	             Chi: 45.0000
	             Phi: 180.0000
	             XTD: 40.0181
	          2theta: -20.2353
scan:
	Number of images: 360
	           Slice: -110.0000 - 70.0000
	     Image width: 0.5000
	        Exp time: 8.0000
	   Rotation axis: Omega
	           Omega: 0.0000
	             Chi: 45.0000
	             Phi: 270.0000
	             XTD: 40.0181
	          2theta: -20.2353
scan:
	Number of images: 330
	           Slice: -110.0000 - 55.0000
	     Image width: 0.5000
	        Exp time: 8.0000
	   Rotation axis: Omega
	           Omega: 0.0000
	             Chi: 45.0000
	             Phi: 0.0000
	             XTD: 40.0181
	          2theta: -20.2353
;
_diffrn_measurement_device       
;
Saturn724+ (2x2 bin mode)
;
_diffrn_measurement_device_details 
;
AFC10: Fixed Chi 2 circle
;
_diffrn_measurement_device_type  'MM007-HF CCD(Saturn 724+)'
_diffrn_measurement_method       'ω scans at fixed χ = 45°'
_diffrn_number_total             9957
_diffrn_orient_matrix_type       d*Trek
_diffrn_orient_matrix_UB_11      -0.0589
_diffrn_orient_matrix_UB_12      0.0826
_diffrn_orient_matrix_UB_13      -0.0650
_diffrn_orient_matrix_UB_21      -0.0044
_diffrn_orient_matrix_UB_22      0.0268
_diffrn_orient_matrix_UB_23      0.0641
_diffrn_orient_matrix_UB_31      0.0525
_diffrn_orient_matrix_UB_32      0.0139
_diffrn_orient_matrix_UB_33      -0.0282
_diffrn_radiation_detector       CCD
_diffrn_radiation_monochromator  Confocal
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   'Rotating Anode'
_diffrn_source_current           24.0000
_diffrn_source_power             1.2000
_diffrn_source_voltage           50.0000
_diffrn_special_details          
;
 ?
;
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                9146
_reflns_number_total             9955
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 Structure factors included contributions from the .fab file.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'CrystalClear (Rigaku Inc., 2007)'
_computing_data_collection       'CrystalClear (Rigaku Inc., 2007)'
_computing_data_reduction        'CrystalClear (Rigaku Inc., 2007)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'CIFTAB (Sheldrick, 2013)'
_computing_structure_refinement  'SHELXL (Sheldrick, 2014)'
_computing_structure_solution    
;
'SHELXT (Sheldrick, 2014)'
;
_refine_diff_density_max         6.729
_refine_diff_density_min         -2.273
_refine_diff_density_rms         0.236
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.089
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     417
_refine_ls_number_reflns         9955
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0634
_refine_ls_R_factor_gt           0.0595
_refine_ls_restrained_S_all      1.089
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0724P)²+21.2101P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1527
_refine_ls_wR_factor_ref         0.1557
_refine_special_details          ?
_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.a Aromatic/amide H refined with riding coordinates:
 C1(H1), C2(H2), C3(H3), C4(H4), C7(H7), C9(H9), C13(H13), C14(H14), C15(H15),
 C16(H16), C21(H21), C25(H25), C27(H27), C28(H28), C29(H29), C30(H30), C32(H32),
  C33(H33), C34(H34), C35(H35)
2.b Idealised Me refined as rotating group:
 C17(H17A,H17B,H17C), C19(H19A,H19B,H19C)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt1 Pt 1.14117(4) 0.14823(2) 0.57855(2) 0.02533(10) Uani 1 1 d . . . . .
Pt2 Pt 0.36864(4) 0.28484(2) 0.57688(2) 0.02623(10) Uani 1 1 d . . . . .
Cl1 Cl 1.2481(3) 0.13662(17) 0.45280(14) 0.0383(5) Uani 1 1 d . . . . .
Cl2 Cl 0.2684(3) 0.40484(16) 0.44869(14) 0.0400(5) Uani 1 1 d . . . . .
O1 O 0.7523(9) 0.0244(7) 1.0171(4) 0.058(2) Uani 1 1 d . . . . .
N1 N 1.2841(8) 0.0327(5) 0.6599(4) 0.0279(14) Uani 1 1 d . . . . .
N2 N 0.9642(8) 0.2618(5) 0.5323(4) 0.0306(15) Uani 1 1 d . . . . .
N3 N 0.8032(9) 0.1413(6) 0.8976(4) 0.0348(17) Uani 1 1 d . . . . .
N4 N 0.6957(9) 0.0198(5) 0.8960(4) 0.0337(17) Uani 1 1 d . . . . .
N5 N 0.2232(8) 0.3328(5) 0.6558(4) 0.0286(15) Uani 1 1 d . . . . .
N6 N 0.5461(8) 0.2080(5) 0.5329(4) 0.0270(14) Uani 1 1 d . . . . .
C1 C 1.4087(10) -0.0228(6) 0.6404(6) 0.0305(18) Uani 1 1 d . . . . .
H1 H 1.4365 -0.0099 0.5856 0.037 Uiso 1 1 calc R . . . .
C2 C 1.4982(12) -0.1004(7) 0.7017(6) 0.041(2) Uani 1 1 d . . . . .
H2 H 1.5817 -0.1402 0.6875 0.049 Uiso 1 1 calc R . . . .
C3 C 1.4622(12) -0.1172(8) 0.7824(6) 0.043(2) Uani 1 1 d . . . . .
H3 H 1.5227 -0.1674 0.8233 0.051 Uiso 1 1 calc R . . . .
C4 C 1.3348(11) -0.0587(8) 0.8025(6) 0.041(2) Uani 1 1 d . . . . .
H4 H 1.3082 -0.0695 0.8570 0.049 Uiso 1 1 calc R . . . .
C5 C 1.2468(10) 0.0166(6) 0.7401(5) 0.0313(18) Uani 1 1 d . . . . .
C6 C 1.1061(10) 0.0835(6) 0.7514(5) 0.0285(17) Uani 1 1 d . . . . .
C7 C 1.0282(10) 0.0822(7) 0.8242(5) 0.0325(19) Uani 1 1 d . . . . .
H7 H 1.0665 0.0363 0.8740 0.039 Uiso 1 1 calc R . . . .
C8 C 0.8923(10) 0.1503(6) 0.8216(5) 0.0285(17) Uani 1 1 d . . . . .
C9 C 0.8335(10) 0.2209(6) 0.7490(6) 0.0302(18) Uani 1 1 d . . . . .
H9 H 0.7435 0.2663 0.7490 0.036 Uiso 1 1 calc R . . . .
C10 C 0.9119(9) 0.2230(6) 0.6755(5) 0.0253(16) Uani 1 1 d . . . . .
C11 C 1.0462(10) 0.1533(6) 0.6789(6) 0.0307(18) Uani 1 1 d . . . . .
C12 C 0.8668(10) 0.2870(6) 0.5913(5) 0.0266(16) Uani 1 1 d . . . . .
C13 C 0.7402(11) 0.3615(6) 0.5687(6) 0.0327(18) Uani 1 1 d . . . . .
H13 H 0.6755 0.3774 0.6081 0.039 Uiso 1 1 calc R . . . .
C14 C 0.7097(11) 0.4129(7) 0.4861(5) 0.0349(19) Uani 1 1 d . . . . .
H14 H 0.6265 0.4650 0.4704 0.042 Uiso 1 1 calc R . . . .
C15 C 0.8004(12) 0.3881(7) 0.4267(6) 0.035(2) Uani 1 1 d . . . . .
H15 H 0.7760 0.4196 0.3715 0.043 Uiso 1 1 calc R . . . .
C16 C 0.9314(11) 0.3130(6) 0.4542(5) 0.0305(18) Uani 1 1 d . . . . .
H16 H 0.9994 0.2983 0.4151 0.037 Uiso 1 1 calc R . . . .
C17 C 0.8565(15) 0.1868(10) 0.9439(7) 0.059(3) Uani 1 1 d . . . . .
H17A H 0.9611 0.1537 0.9658 0.089 Uiso 1 1 calc GR . . . .
H17B H 0.7815 0.1868 0.9880 0.089 Uiso 1 1 calc GR . . . .
H17C H 0.8618 0.2498 0.9085 0.089 Uiso 1 1 calc GR . . . .
C18 C 0.7509(10) 0.0597(8) 0.9415(5) 0.038(2) Uani 1 1 d . . . . .
C19 C 0.6634(15) -0.0749(8) 0.9397(6) 0.055(3) Uani 1 1 d . . . . .
H19A H 0.7319 -0.1079 0.9863 0.083 Uiso 1 1 calc GR . . . .
H19B H 0.6844 -0.1074 0.9036 0.083 Uiso 1 1 calc GR . . . .
H19C H 0.5528 -0.0710 0.9575 0.083 Uiso 1 1 calc GR . . . .
C20 C 0.6129(10) 0.0757(7) 0.8216(5) 0.034(2) Uani 1 1 d . . . . .
C21 C 0.4779(10) 0.1432(7) 0.8231(5) 0.0329(19) Uani 1 1 d . . . . .
H21 H 0.4406 0.1475 0.8725 0.039 Uiso 1 1 calc R . . . .
C22 C 0.3991(9) 0.2041(6) 0.7512(5) 0.0274(17) Uani 1 1 d . . . . .
C23 C 0.4616(9) 0.1955(6) 0.6779(5) 0.0282(17) Uani 1 1 d . . . . .
C24 C 0.5963(10) 0.1257(6) 0.6768(5) 0.0269(16) Uani 1 1 d . . . . .
C25 C 0.6716(11) 0.0653(7) 0.7490(5) 0.0329(19) Uani 1 1 d . . . . .
H25 H 0.7595 0.0186 0.7495 0.040 Uiso 1 1 calc R . . . .
C26 C 0.2628(10) 0.2806(6) 0.7371(5) 0.0301(18) Uani 1 1 d . . . . .
C27 C 0.1729(12) 0.3062(8) 0.7969(6) 0.044(2) Uani 1 1 d . . . . .
H27 H 0.1998 0.2726 0.8516 0.053 Uiso 1 1 calc R . . . .
C28 C 0.0456(12) 0.3800(7) 0.7762(6) 0.044(2) Uani 1 1 d . . . . .
H28 H -0.0141 0.3963 0.8167 0.053 Uiso 1 1 calc R . . . .
C29 C 0.0058(11) 0.4301(7) 0.6954(7) 0.042(2) Uani 1 1 d . . . . .
H29 H -0.0803 0.4806 0.6803 0.050 Uiso 1 1 calc R . . . .
C30 C 0.0979(10) 0.4031(6) 0.6370(6) 0.0313(18) Uani 1 1 d . . . . .
H30 H 0.0703 0.4359 0.5823 0.038 Uiso 1 1 calc R . . . .
C31 C 0.6422(10) 0.1351(6) 0.5912(5) 0.0283(17) Uani 1 1 d . . . . .
C32 C 0.7669(11) 0.0761(7) 0.5688(6) 0.0336(19) Uani 1 1 d . . . . .
H32 H 0.8290 0.0255 0.6087 0.040 Uiso 1 1 calc R . . . .
C33 C 0.7971(11) 0.0932(7) 0.4880(6) 0.0350(19) Uani 1 1 d . . . . .
H33 H 0.8814 0.0550 0.4724 0.042 Uiso 1 1 calc R . . . .
C34 C 0.7014(12) 0.1678(7) 0.4293(6) 0.037(2) Uani 1 1 d . . . . .
H34 H 0.7210 0.1799 0.3740 0.045 Uiso 1 1 calc R . . . .
C35 C 0.5772(11) 0.2240(6) 0.4532(5) 0.0302(18) Uani 1 1 d . . . . .
H35 H 0.5134 0.2739 0.4135 0.036 Uiso 1 1 calc R . . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Pt1 Pt2 3.2263(6) 1_655 ?
Pt1 Cl1 2.395(2) . ?
Pt1 N1 2.051(7) . ?
Pt1 N2 2.020(8) . ?
Pt1 C11 1.912(9) . ?
Pt2 Pt1 3.2263(6) 1_455 ?
Pt2 Cl2 2.406(2) . ?
Pt2 N5 2.046(7) . ?
Pt2 N6 2.026(7) . ?
Pt2 C23 1.908(9) . ?
O1 C18 1.237(11) . ?
N1 C1 1.336(11) . ?
N1 C5 1.365(11) . ?
N2 C12 1.405(11) . ?
N2 C16 1.323(11) . ?
N3 C8 1.454(10) . ?
N3 C17 1.461(13) . ?
N3 C18 1.375(13) . ?
N4 C18 1.386(13) . ?
N4 C19 1.476(13) . ?
N4 C20 1.420(10) . ?
N5 C26 1.384(11) . ?
N5 C30 1.323(11) . ?
N6 C31 1.374(10) . ?
N6 C35 1.349(11) . ?
C1 H1 0.9300 . ?
C1 C2 1.406(13) . ?
C2 H2 0.9300 . ?
C2 C3 1.369(14) . ?
C3 H3 0.9300 . ?
C3 C4 1.384(14) . ?
C4 H4 0.9300 . ?
C4 C5 1.394(13) . ?
C5 C6 1.473(12) . ?
C6 C7 1.391(11) . ?
C6 C11 1.378(13) . ?
C7 H7 0.9300 . ?
C7 C8 1.390(12) . ?
C8 C9 1.382(12) . ?
C9 H9 0.9300 . ?
C9 C10 1.400(11) . ?
C10 C11 1.394(12) . ?
C10 C12 1.470(11) . ?
C12 C13 1.368(12) . ?
C13 H13 0.9300 . ?
C13 C14 1.388(12) . ?
C14 H14 0.9300 . ?
C14 C15 1.381(13) . ?
C15 H15 0.9300 . ?
C15 C16 1.403(13) . ?
C16 H16 0.9300 . ?
C17 H17A 0.9600 . ?
C17 H17B 0.9600 . ?
C17 H17C 0.9600 . ?
C19 H19A 0.9600 . ?
C19 H19B 0.9600 . ?
C19 H19C 0.9600 . ?
C20 C21 1.397(12) . ?
C20 C25 1.399(12) . ?
C21 H21 0.9300 . ?
C21 C22 1.388(11) . ?
C22 C23 1.407(12) . ?
C22 C26 1.445(11) . ?
C23 C24 1.414(12) . ?
C24 C25 1.378(12) . ?
C24 C31 1.492(12) . ?
C25 H25 0.9300 . ?
C26 C27 1.390(13) . ?
C27 H27 0.9300 . ?
C27 C28 1.366(13) . ?
C28 H28 0.9300 . ?
C28 C29 1.373(14) . ?
C29 H29 0.9300 . ?
C29 C30 1.389(14) . ?
C30 H30 0.9300 . ?
C31 C32 1.395(13) . ?
C32 H32 0.9300 . ?
C32 C33 1.363(12) . ?
C33 H33 0.9300 . ?
C33 C34 1.388(13) . ?
C34 H34 0.9300 . ?
C34 C35 1.377(14) . ?
C35 H35 0.9300 . ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
Cl1 Pt1 Pt2 94.72(6) . 1_655 ?
N1 Pt1 Pt2 93.01(19) . 1_655 ?
N1 Pt1 Cl1 99.6(2) . . ?
N2 Pt1 Pt2 88.1(2) . 1_655 ?
N2 Pt1 Cl1 98.6(2) . . ?
N2 Pt1 N1 161.5(3) . . ?
C11 Pt1 Pt2 88.8(2) . 1_655 ?
C11 Pt1 Cl1 176.5(2) . . ?
C11 Pt1 N1 80.6(3) . . ?
C11 Pt1 N2 81.0(3) . . ?
Cl2 Pt2 Pt1 93.99(6) . 1_455 ?
N5 Pt2 Pt1 94.2(2) . 1_455 ?
N5 Pt2 Cl2 99.6(2) . . ?
N6 Pt2 Pt1 86.78(19) . 1_455 ?
N6 Pt2 Cl2 98.7(2) . . ?
N6 Pt2 N5 161.6(3) . . ?
C23 Pt2 Pt1 90.8(2) . 1_455 ?
C23 Pt2 Cl2 175.2(2) . . ?
C23 Pt2 N5 80.8(3) . . ?
C23 Pt2 N6 80.8(3) . . ?
C1 N1 Pt1 125.8(6) . . ?
C1 N1 C5 120.0(8) . . ?
C5 N1 Pt1 114.2(6) . . ?
C12 N2 Pt1 114.6(6) . . ?
C16 N2 Pt1 127.4(6) . . ?
C16 N2 C12 118.0(8) . . ?
C8 N3 C17 114.5(8) . . ?
C18 N3 C8 118.1(8) . . ?
C18 N3 C17 117.4(8) . . ?
C18 N4 C19 117.6(8) . . ?
C18 N4 C20 121.2(8) . . ?
C20 N4 C19 116.7(8) . . ?
C26 N5 Pt2 113.2(5) . . ?
C30 N5 Pt2 127.2(6) . . ?
C30 N5 C26 119.6(8) . . ?
C31 N6 Pt2 115.2(6) . . ?
C35 N6 Pt2 125.7(6) . . ?
C35 N6 C31 119.1(7) . . ?
N1 C1 H1 119.6 . . ?
N1 C1 C2 120.7(8) . . ?
C2 C1 H1 119.6 . . ?
C1 C2 H2 120.1 . . ?
C3 C2 C1 119.8(9) . . ?
C3 C2 H2 120.1 . . ?
C2 C3 H3 120.3 . . ?
C2 C3 C4 119.4(9) . . ?
C4 C3 H3 120.3 . . ?
C3 C4 H4 120.4 . . ?
C3 C4 C5 119.3(9) . . ?
C5 C4 H4 120.4 . . ?
N1 C5 C4 120.8(8) . . ?
N1 C5 C6 113.3(8) . . ?
C4 C5 C6 125.8(8) . . ?
C7 C6 C5 128.0(8) . . ?
C11 C6 C5 113.5(8) . . ?
C11 C6 C7 118.5(8) . . ?
C6 C7 H7 120.4 . . ?
C8 C7 C6 119.3(8) . . ?
C8 C7 H7 120.4 . . ?
C7 C8 N3 118.0(8) . . ?
C9 C8 N3 119.6(8) . . ?
C9 C8 C7 122.2(8) . . ?
C8 C9 H9 120.6 . . ?
C8 C9 C10 118.9(8) . . ?
C10 C9 H9 120.6 . . ?
C9 C10 C12 128.7(8) . . ?
C11 C10 C9 118.3(8) . . ?
C11 C10 C12 112.9(7) . . ?
C6 C11 Pt1 118.3(6) . . ?
C6 C11 C10 122.9(8) . . ?
C10 C11 Pt1 118.6(7) . . ?
N2 C12 C10 112.8(7) . . ?
C13 C12 N2 120.9(8) . . ?
C13 C12 C10 126.3(8) . . ?
C12 C13 H13 120.5 . . ?
C12 C13 C14 119.1(9) . . ?
C14 C13 H13 120.5 . . ?
C13 C14 H14 119.3 . . ?
C15 C14 C13 121.3(9) . . ?
C15 C14 H14 119.3 . . ?
C14 C15 H15 121.8 . . ?
C14 C15 C16 116.4(8) . . ?
C16 C15 H15 121.8 . . ?
N2 C16 C15 124.1(8) . . ?
N2 C16 H16 118.0 . . ?
C15 C16 H16 118.0 . . ?
N3 C17 H17A 109.5 . . ?
N3 C17 H17B 109.5 . . ?
N3 C17 H17C 109.5 . . ?
H17A C17 H17B 109.5 . . ?
H17A C17 H17C 109.5 . . ?
H17B C17 H17C 109.5 . . ?
O1 C18 N3 121.7(10) . . ?
O1 C18 N4 122.2(10) . . ?
N3 C18 N4 116.1(7) . . ?
N4 C19 H19A 109.5 . . ?
N4 C19 H19B 109.5 . . ?
N4 C19 H19C 109.5 . . ?
H19A C19 H19B 109.5 . . ?
H19A C19 H19C 109.5 . . ?
H19B C19 H19C 109.5 . . ?
C21 C20 N4 118.0(8) . . ?
C21 C20 C25 121.9(8) . . ?
C25 C20 N4 120.0(8) . . ?
C20 C21 H21 119.8 . . ?
C22 C21 C20 120.4(8) . . ?
C22 C21 H21 119.8 . . ?
C21 C22 C23 117.5(8) . . ?
C21 C22 C26 130.4(8) . . ?
C23 C22 C26 112.0(7) . . ?
C22 C23 Pt2 118.7(6) . . ?
C22 C23 C24 121.9(8) . . ?
C24 C23 Pt2 119.2(6) . . ?
C23 C24 C31 110.9(7) . . ?
C25 C24 C23 119.6(8) . . ?
C25 C24 C31 129.4(8) . . ?
C20 C25 H25 120.7 . . ?
C24 C25 C20 118.6(8) . . ?
C24 C25 H25 120.7 . . ?
N5 C26 C22 115.2(7) . . ?
N5 C26 C27 118.8(8) . . ?
C27 C26 C22 126.0(8) . . ?
C26 C27 H27 119.6 . . ?
C28 C27 C26 120.7(9) . . ?
C28 C27 H27 119.6 . . ?
C27 C28 H28 120.1 . . ?
C27 C28 C29 119.9(9) . . ?
C29 C28 H28 120.1 . . ?
C28 C29 H29 121.0 . . ?
C28 C29 C30 118.1(9) . . ?
C30 C29 H29 121.0 . . ?
N5 C30 C29 122.9(9) . . ?
N5 C30 H30 118.6 . . ?
C29 C30 H30 118.6 . . ?
N6 C31 C24 113.8(7) . . ?
N6 C31 C32 120.7(8) . . ?
C32 C31 C24 125.5(8) . . ?
C31 C32 H32 120.3 . . ?
C33 C32 C31 119.5(9) . . ?
C33 C32 H32 120.3 . . ?
C32 C33 H33 120.2 . . ?
C32 C33 C34 119.6(9) . . ?
C34 C33 H33 120.2 . . ?
C33 C34 H34 120.2 . . ?
C35 C34 C33 119.7(8) . . ?
C35 C34 H34 120.2 . . ?
N6 C35 C34 121.4(8) . . ?
N6 C35 H35 119.3 . . ?
C34 C35 H35 119.3 . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
Pt1 N1 C1 C2 -179.9(7) . . . . ?
Pt1 N1 C5 C4 -179.2(7) . . . . ?
Pt1 N1 C5 C6 2.7(9) . . . . ?
Pt1 N2 C12 C10 -1.7(8) . . . . ?
Pt1 N2 C12 C13 -178.7(6) . . . . ?
Pt1 N2 C16 C15 176.3(7) . . . . ?
Pt2 N5 C26 C22 1.0(9) . . . . ?
Pt2 N5 C26 C27 179.9(7) . . . . ?
Pt2 N5 C30 C29 179.7(7) . . . . ?
Pt2 N6 C31 C24 0.5(9) . . . . ?
Pt2 N6 C31 C32 178.9(6) . . . . ?
Pt2 N6 C35 C34 179.7(7) . . . . ?
Pt2 C23 C24 C25 175.1(6) . . . . ?
Pt2 C23 C24 C31 -0.8(9) . . . . ?
N1 C1 C2 C3 -2.9(15) . . . . ?
N1 C5 C6 C7 173.8(8) . . . . ?
N1 C5 C6 C11 -4.3(11) . . . . ?
N2 C12 C13 C14 -0.7(13) . . . . ?
N3 C8 C9 C10 -173.7(8) . . . . ?
N4 C20 C21 C22 175.5(8) . . . . ?
N4 C20 C25 C24 -174.6(8) . . . . ?
N5 C26 C27 C28 1.5(16) . . . . ?
N6 C31 C32 C33 2.4(13) . . . . ?
C1 N1 C5 C4 -1.6(13) . . . . ?
C1 N1 C5 C6 -179.7(7) . . . . ?
C1 C2 C3 C4 1.8(16) . . . . ?
C2 C3 C4 C5 -0.6(16) . . . . ?
C3 C4 C5 N1 0.5(15) . . . . ?
C3 C4 C5 C6 178.4(9) . . . . ?
C4 C5 C6 C7 -4.2(15) . . . . ?
C4 C5 C6 C11 177.7(9) . . . . ?
C5 N1 C1 C2 2.8(13) . . . . ?
C5 C6 C7 C8 -177.4(8) . . . . ?
C5 C6 C11 Pt1 4.1(10) . . . . ?
C5 C6 C11 C10 179.0(8) . . . . ?
C6 C7 C8 N3 173.4(8) . . . . ?
C6 C7 C8 C9 -1.5(14) . . . . ?
C7 C6 C11 Pt1 -174.2(6) . . . . ?
C7 C6 C11 C10 0.7(13) . . . . ?
C7 C8 C9 C10 1.1(13) . . . . ?
C8 N3 C18 O1 142.0(8) . . . . ?
C8 N3 C18 N4 -38.5(10) . . . . ?
C8 C9 C10 C11 0.1(12) . . . . ?
C8 C9 C10 C12 175.9(8) . . . . ?
C9 C10 C11 Pt1 173.8(6) . . . . ?
C9 C10 C11 C6 -1.0(12) . . . . ?
C9 C10 C12 N2 -173.3(8) . . . . ?
C9 C10 C12 C13 3.5(14) . . . . ?
C10 C12 C13 C14 -177.2(8) . . . . ?
C11 C6 C7 C8 0.6(13) . . . . ?
C11 C10 C12 N2 2.7(10) . . . . ?
C11 C10 C12 C13 179.5(8) . . . . ?
C12 N2 C16 C15 -3.4(13) . . . . ?
C12 C10 C11 Pt1 -2.6(9) . . . . ?
C12 C10 C11 C6 -177.5(8) . . . . ?
C12 C13 C14 C15 2.6(14) . . . . ?
C13 C14 C15 C16 -4.5(14) . . . . ?
C14 C15 C16 N2 5.1(14) . . . . ?
C16 N2 C12 C10 178.0(7) . . . . ?
C16 N2 C12 C13 1.1(12) . . . . ?
C17 N3 C8 C7 90.1(11) . . . . ?
C17 N3 C8 C9 -94.8(10) . . . . ?
C17 N3 C18 O1 -1.7(13) . . . . ?
C17 N3 C18 N4 177.8(8) . . . . ?
C18 N3 C8 C7 -54.6(11) . . . . ?
C18 N3 C8 C9 120.4(9) . . . . ?
C18 N4 C20 C21 -54.3(12) . . . . ?
C18 N4 C20 C25 122.6(10) . . . . ?
C19 N4 C18 O1 -10.1(13) . . . . ?
C19 N4 C18 N3 170.4(8) . . . . ?
C19 N4 C20 C21 101.1(11) . . . . ?
C19 N4 C20 C25 -82.0(11) . . . . ?
C20 N4 C18 O1 145.1(9) . . . . ?
C20 N4 C18 N3 -34.4(11) . . . . ?
C20 C21 C22 C23 -0.8(13) . . . . ?
C20 C21 C22 C26 -177.5(9) . . . . ?
C21 C20 C25 C24 2.1(14) . . . . ?
C21 C22 C23 Pt2 -174.4(6) . . . . ?
C21 C22 C23 C24 2.1(12) . . . . ?
C21 C22 C26 N5 174.4(9) . . . . ?
C21 C22 C26 C27 -4.4(16) . . . . ?
C22 C23 C24 C25 -1.3(12) . . . . ?
C22 C23 C24 C31 -177.2(7) . . . . ?
C22 C26 C27 C28 -179.7(10) . . . . ?
C23 C22 C26 N5 -2.5(11) . . . . ?
C23 C22 C26 C27 178.7(9) . . . . ?
C23 C24 C25 C20 -0.8(13) . . . . ?
C23 C24 C31 N6 0.2(10) . . . . ?
C23 C24 C31 C32 -178.2(8) . . . . ?
C24 C31 C32 C33 -179.3(8) . . . . ?
C25 C20 C21 C22 -1.4(15) . . . . ?
C25 C24 C31 N6 -175.2(8) . . . . ?
C25 C24 C31 C32 6.4(14) . . . . ?
C26 N5 C30 C29 2.5(13) . . . . ?
C26 C22 C23 Pt2 2.9(10) . . . . ?
C26 C22 C23 C24 179.4(8) . . . . ?
C26 C27 C28 C29 -0.3(18) . . . . ?
C27 C28 C29 C30 0.2(16) . . . . ?
C28 C29 C30 N5 -1.3(14) . . . . ?
C30 N5 C26 C22 178.6(8) . . . . ?
C30 N5 C26 C27 -2.5(13) . . . . ?
C31 N6 C35 C34 1.0(12) . . . . ?
C31 C24 C25 C20 174.3(8) . . . . ?
C31 C32 C33 C34 -1.3(14) . . . . ?
C32 C33 C34 C35 0.1(14) . . . . ?
C33 C34 C35 N6 0.0(14) . . . . ?
C35 N6 C31 C24 179.3(7) . . . . ?
C35 N6 C31 C32 -2.2(12) . . . . ?

_shelx_SHELXL_version_number     2014/7
_olex2_submission_special_instructions 'No special instructions were received'
####################################################################### 
# 
# 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_sa3815
_database_code_depnum_ccdc_archive 'CCDC 1427841'
_audit_update_record             
;
2015-09-28 deposited with the CCDC.
2017-07-03 downloaded from the CCDC.
;
_audit_creation_date             2014-12-26
_audit_creation_method           
;
Olex2 1.2
(compiled 2013.12.10 svn.r2850 for OlexSys, GUI svn.r4736)
;
_shelxl_version_number           2013-4
_chemical_name_common            ?
_chemical_name_systematic        
;
 ?
;
_chemical_formula_moiety         'C35 H26 Cl2 N6 O Pt2, C H Cl3, 1.5(C2 H4 Cl2)'
_chemical_formula_sum            'C39 H33 Cl8 N6 O Pt2 '
_chemical_formula_weight         1275.49
_chemical_melting_point          ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
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'
Pt Pt -1.7033 8.3905 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   11.891(2)
_cell_length_b                   14.270(3)
_cell_length_c                   14.277(3)
_cell_angle_alpha                64.40(3)
_cell_angle_beta                 77.81(3)
_cell_angle_gamma                71.21(3)
_cell_volume                     2060.9(10)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    7022
_cell_measurement_temperature    173.1500
_cell_measurement_theta_max      27.4850
_cell_measurement_theta_min      1.8155
_shelx_estimated_absorpt_T_max   ?
_shelx_estimated_absorpt_T_min   ?
_exptl_absorpt_coefficient_mu    7.341
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.7344
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'CrystalClear (Rigaku Inc., 2007)'
_exptl_crystal_colour            yellow
_exptl_crystal_colour_primary    yellow
_exptl_crystal_density_diffrn    2.055
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       block
_exptl_crystal_F_000             1218
_exptl_crystal_size_max          0.234
_exptl_crystal_size_mid          0.167
_exptl_crystal_size_min          0.156
_exptl_special_details           
;
 ?
;
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0359
_diffrn_reflns_av_unetI/netI     0.0368
_diffrn_reflns_Laue_measured_fraction_full 0.995
_diffrn_reflns_Laue_measured_fraction_max 0.993
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_l_max       18
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            26178
_diffrn_reflns_point_group_measured_fraction_full 0.995
_diffrn_reflns_point_group_measured_fraction_max 0.993
_diffrn_reflns_theta_full        26.000
_diffrn_reflns_theta_max         27.504
_diffrn_reflns_theta_min         1.587
_diffrn_ambient_temperature      173.1500
_diffrn_detector_area_resol_mean 28.5714
_diffrn_measured_fraction_theta_full 0.995
_diffrn_measured_fraction_theta_max 0.993
_diffrn_measurement_device       
;
Saturn724+ (2x2 bin mode)
;
_diffrn_measurement_device_details 
;
AFC10: Fixed Chi 2 circle
;
_diffrn_measurement_device_type  'Saturn724+ CCD'
_diffrn_measurement_method       'ω scans at fixed χ = 45°'
_diffrn_number_total             9440
_diffrn_orient_matrix_type       d*Trek
_diffrn_orient_matrix_UB_11      -0.0867
_diffrn_orient_matrix_UB_12      0.0106
_diffrn_orient_matrix_UB_13      0.0179
_diffrn_orient_matrix_UB_21      0.0032
_diffrn_orient_matrix_UB_22      -0.0591
_diffrn_orient_matrix_UB_23      -0.0546
_diffrn_orient_matrix_UB_31      0.0187
_diffrn_orient_matrix_UB_32      -0.0236
_diffrn_orient_matrix_UB_33      0.0719
_diffrn_radiation_detector       CCD
_diffrn_radiation_monochromator  'Graphite Monochromator'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   'Sealed Tube'
_diffrn_source_current           30.0000
_diffrn_source_power             1.5000
_diffrn_source_voltage           50.0000
_diffrn_special_details          
;
 ?
;
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                8745
_reflns_number_total             9421
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'CrystalClear (Rigaku Inc., 2007)'
_computing_data_collection       'CrystalClear (Rigaku Inc., 2007)'
_computing_data_reduction        'CrystalClear (Rigaku Inc., 2007)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL (Sheldrick, 2013)'
_computing_structure_solution    
;
'SHELXS (Sheldrick, 2013)'
;
_refine_diff_density_max         0.778
_refine_diff_density_min         -0.789
_refine_diff_density_rms         0.118
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.147
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     507
_refine_ls_number_reflns         9421
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0369
_refine_ls_R_factor_gt           0.0322
_refine_ls_restrained_S_all      1.147
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0130P)²+4.2964P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0591
_refine_ls_wR_factor_ref         0.0609
_refine_special_details          
;
 ?
;
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2.a Ternary CH refined with riding coordinates:
 C39(H39)
2.b Secondary CH2 refined with riding coordinates:
 C37(H37A,H37B), C38(H38A,H38B), C36(H36A,H36B)
2.c Aromatic/amide H refined with riding coordinates:
 C1(H1), C2(H2), C3(H3), C4(H4), C7(H7), C9(H9), C13(H13), C14(H14), C15(H15),
 C16(H16), C21(H21), C24(H24), C25(H25), C26(H26), C27(H27), C28(H28), C32(H32),
  C33(H33), C34(H34), C35(H35)
2.d Idealised Me refined as rotating group:
 C17(H17A,H17B,H17C), C19(H19A,H19B,H19C)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt1 Pt 0.33995(2) 0.93463(2) 0.48140(2) 0.02093(5) Uani 1 1 d . . . . .
Pt2 Pt 0.68592(2) 0.95069(2) 0.06279(2) 0.01979(5) Uani 1 1 d . . . . .
Cl1 Cl 0.29315(10) 0.76345(9) 0.57770(9) 0.0331(3) Uani 1 1 d . . . . .
Cl2 Cl 0.83084(10) 0.78389(9) 0.07523(10) 0.0334(3) Uani 1 1 d . . . . .
O1 O 0.3344(3) 1.5248(2) 0.0694(3) 0.0321(7) Uani 1 1 d . . . . .
N1 N 0.1812(3) 1.0346(3) 0.5070(3) 0.0248(8) Uani 1 1 d . . . . .
N2 N 0.5118(3) 0.8817(3) 0.4290(3) 0.0209(7) Uani 1 1 d . . . . .
N3 N 0.4360(3) 1.3670(3) 0.1876(3) 0.0254(8) Uani 1 1 d . . . . .
N4 N 0.3335(3) 1.3675(3) 0.0645(3) 0.0246(8) Uani 1 1 d . . . . .
N5 N 0.5458(3) 0.8922(3) 0.1497(3) 0.0223(7) Uani 1 1 d . . . . .
N6 N 0.7849(3) 1.0556(3) -0.0289(3) 0.0228(8) Uani 1 1 d . . . . .
C1 C 0.0888(4) 1.0046(4) 0.5729(4) 0.0294(10) Uani 1 1 d . . . . .
H1 H 0.0936 0.9317 0.6097 0.035 Uiso 1 1 calc R . . . .
C2 C -0.0128(4) 1.0785(4) 0.5877(4) 0.0368(12) Uani 1 1 d . . . . .
H2 H -0.0752 1.0555 0.6347 0.044 Uiso 1 1 calc R . . . .
C3 C -0.0223(4) 1.1872(4) 0.5326(4) 0.0383(12) Uani 1 1 d . . . . .
H3 H -0.0911 1.2382 0.5412 0.046 Uiso 1 1 calc R . . . .
C4 C 0.0725(4) 1.2186(4) 0.4645(4) 0.0332(11) Uani 1 1 d . . . . .
H4 H 0.0677 1.2913 0.4260 0.040 Uiso 1 1 calc R . . . .
C5 C 0.1747(4) 1.1420(4) 0.4533(3) 0.0234(9) Uani 1 1 d . . . . .
C6 C 0.2845(4) 1.1647(3) 0.3874(3) 0.0187(8) Uani 1 1 d . . . . .
C7 C 0.3055(4) 1.2632(3) 0.3182(3) 0.0251(9) Uani 1 1 d . . . . .
H7 H 0.2457 1.3268 0.3086 0.030 Uiso 1 1 calc R . . . .
C8 C 0.4172(4) 1.2653(3) 0.2633(3) 0.0221(9) Uani 1 1 d . . . . .
C9 C 0.5091(4) 1.1713(3) 0.2782(3) 0.0228(9) Uani 1 1 d . . . . .
H9 H 0.5844 1.1748 0.2439 0.027 Uiso 1 1 calc R . . . .
C10 C 0.4876(4) 1.0716(3) 0.3449(3) 0.0205(8) Uani 1 1 d . . . . .
C11 C 0.3740(4) 1.0706(3) 0.3972(3) 0.0216(9) Uani 1 1 d . . . . .
C12 C 0.5656(4) 0.9628(3) 0.3644(3) 0.0198(8) Uani 1 1 d . . . . .
C13 C 0.6813(4) 0.9371(4) 0.3224(3) 0.0251(9) Uani 1 1 d . . . . .
H13 H 0.7172 0.9917 0.2778 0.030 Uiso 1 1 calc R . . . .
C14 C 0.7435(4) 0.8311(4) 0.3462(4) 0.0277(10) Uani 1 1 d . . . . .
H14 H 0.8211 0.8138 0.3172 0.033 Uiso 1 1 calc R . . . .
C15 C 0.6904(4) 0.7505(4) 0.4134(4) 0.0305(10) Uani 1 1 d . . . . .
H15 H 0.7319 0.6785 0.4313 0.037 Uiso 1 1 calc R . . . .
C16 C 0.5752(4) 0.7789(3) 0.4532(3) 0.0262(9) Uani 1 1 d . . . . .
H16 H 0.5394 0.7246 0.4988 0.031 Uiso 1 1 calc R . . . .
C17 C 0.4841(5) 1.4262(4) 0.2234(4) 0.0431(13) Uani 1 1 d . . . . .
H17A H 0.4217 1.4616 0.2612 0.065 Uiso 1 1 calc GR . . . .
H17B H 0.5162 1.4788 0.1645 0.065 Uiso 1 1 calc GR . . . .
H17C H 0.5460 1.3772 0.2683 0.065 Uiso 1 1 calc GR . . . .
C18 C 0.3665(4) 1.4259(3) 0.1047(3) 0.0245(9) Uani 1 1 d . . . . .
C19 C 0.2495(4) 1.4259(4) -0.0157(4) 0.0346(11) Uani 1 1 d . . . . .
H19A H 0.1843 1.4753 0.0053 0.052 Uiso 1 1 calc GR . . . .
H19B H 0.2198 1.3758 -0.0252 0.052 Uiso 1 1 calc GR . . . .
H19C H 0.2892 1.4650 -0.0801 0.052 Uiso 1 1 calc GR . . . .
C20 C 0.4154(4) 1.2695(3) 0.0608(3) 0.0233(9) Uani 1 1 d . . . . .
C21 C 0.3793(4) 1.1742(3) 0.1093(3) 0.0215(9) Uani 1 1 d . . . . .
H21 H 0.3022 1.1745 0.1405 0.026 Uiso 1 1 calc R . . . .
C22 C 0.4610(4) 1.0790(3) 0.1099(3) 0.0200(8) Uani 1 1 d . . . . .
C23 C 0.4457(4) 0.9689(3) 0.1623(3) 0.0210(8) Uani 1 1 d . . . . .
C24 C 0.3445(4) 0.9394(4) 0.2217(3) 0.0270(10) Uani 1 1 d . . . . .
H24 H 0.2776 0.9912 0.2318 0.032 Uiso 1 1 calc R . . . .
C25 C 0.3443(5) 0.8325(4) 0.2654(4) 0.0324(11) Uani 1 1 d . . . . .
H25 H 0.2778 0.8115 0.3065 0.039 Uiso 1 1 calc R . . . .
C26 C 0.4432(5) 0.7563(4) 0.2481(4) 0.0329(11) Uani 1 1 d . . . . .
H26 H 0.4426 0.6844 0.2750 0.039 Uiso 1 1 calc R . . . .
C27 C 0.5427(4) 0.7885(3) 0.1905(3) 0.0259(9) Uani 1 1 d . . . . .
H27 H 0.6096 0.7371 0.1796 0.031 Uiso 1 1 calc R . . . .
C28 C 0.5288(4) 1.2730(3) 0.0089(3) 0.0222(9) Uani 1 1 d . . . . .
H28 H 0.5498 1.3379 -0.0236 0.027 Uiso 1 1 calc R . . . .
C29 C 0.6101(4) 1.1779(3) 0.0065(3) 0.0210(8) Uani 1 1 d . . . . .
C30 C 0.5736(4) 1.0811(3) 0.0598(3) 0.0211(8) Uani 1 1 d . . . . .
C31 C 0.7296(4) 1.1612(3) -0.0447(3) 0.0220(9) Uani 1 1 d . . . . .
C32 C 0.7861(4) 1.2422(4) -0.1079(4) 0.0287(10) Uani 1 1 d . . . . .
H32 H 0.7488 1.3135 -0.1176 0.034 Uiso 1 1 calc R . . . .
C33 C 0.8981(4) 1.2151(4) -0.1560(4) 0.0357(11) Uani 1 1 d . . . . .
H33 H 0.9375 1.2680 -0.1975 0.043 Uiso 1 1 calc R . . . .
C34 C 0.9516(4) 1.1087(4) -0.1420(4) 0.0379(12) Uani 1 1 d . . . . .
H34 H 1.0259 1.0897 -0.1759 0.046 Uiso 1 1 calc R . . . .
C35 C 0.8930(4) 1.0315(4) -0.0773(4) 0.0289(10) Uani 1 1 d . . . . .
H35 H 0.9299 0.9599 -0.0667 0.035 Uiso 1 1 calc R . . . .
Cl6 Cl 0.84016(15) 0.45016(14) 0.30450(13) 0.0608(4) Uani 1 1 d . . . . .
Cl7 Cl 1.05124(15) 0.51230(14) 0.18291(13) 0.0658(5) Uani 1 1 d . . . . .
Cl8 Cl 0.97130(17) 0.54288(14) 0.37518(14) 0.0623(4) Uani 1 1 d . . . . .
C39 C 0.9260(5) 0.5422(5) 0.2660(4) 0.0475(14) Uani 1 1 d . . . . .
H39 H 0.8768 0.6143 0.2278 0.057 Uiso 1 1 calc R . . . .
Cl4 Cl 1.05360(13) 0.20875(14) 0.22542(12) 0.0523(4) Uani 1 1 d . . . . .
Cl5 Cl 0.84739(13) 0.14183(11) 0.15901(11) 0.0436(3) Uani 1 1 d . . . . .
C37 C 0.9614(5) 0.2935(5) 0.1219(4) 0.0439(13) Uani 1 1 d . . . . .
H37A H 0.9529 0.3680 0.1084 0.053 Uiso 1 1 calc R . . . .
H37B H 0.9994 0.2816 0.0594 0.053 Uiso 1 1 calc R . . . .
C38 C 0.8405(5) 0.2737(4) 0.1452(5) 0.0441(13) Uani 1 1 d . . . . .
H38A H 0.7912 0.3263 0.0892 0.053 Uiso 1 1 calc R . . . .
H38B H 0.8034 0.2831 0.2090 0.053 Uiso 1 1 calc R . . . .
Cl3 Cl 0.33179(16) 0.53189(13) 0.44285(13) 0.0591(4) Uani 1 1 d . . . . .
C36 C 0.4396(5) 0.5164(5) 0.5225(5) 0.0552(16) Uani 1 1 d . . . . .
H36A H 0.4284 0.5840 0.5286 0.066 Uiso 1 1 calc R . . . .
H36B H 0.4283 0.4626 0.5919 0.066 Uiso 1 1 calc R . . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Pt1 Cl1 2.4120(14) . ?
Pt1 N1 2.039(4) . ?
Pt1 N2 2.038(4) . ?
Pt1 C11 1.913(4) . ?
Pt2 Cl2 2.4059(14) . ?
Pt2 N5 2.035(4) . ?
Pt2 N6 2.032(4) . ?
Pt2 C30 1.899(4) . ?
O1 C18 1.229(5) . ?
N1 C1 1.339(6) . ?
N1 C5 1.370(6) . ?
N2 C12 1.379(5) . ?
N2 C16 1.342(5) . ?
N3 C8 1.440(5) . ?
N3 C17 1.452(6) . ?
N3 C18 1.377(6) . ?
N4 C18 1.378(5) . ?
N4 C19 1.458(6) . ?
N4 C20 1.440(5) . ?
N5 C23 1.374(5) . ?
N5 C27 1.346(5) . ?
N6 C31 1.373(5) . ?
N6 C35 1.339(6) . ?
C1 C2 1.371(7) . ?
C2 C3 1.381(7) . ?
C3 C4 1.380(7) . ?
C4 C5 1.381(6) . ?
C5 C6 1.479(6) . ?
C6 C7 1.391(6) . ?
C6 C11 1.391(6) . ?
C7 C8 1.395(6) . ?
C8 C9 1.395(6) . ?
C9 C10 1.399(6) . ?
C10 C11 1.400(6) . ?
C10 C12 1.469(6) . ?
C12 C13 1.379(6) . ?
C13 C14 1.376(6) . ?
C14 C15 1.378(6) . ?
C15 C16 1.370(6) . ?
C20 C21 1.396(6) . ?
C20 C28 1.399(6) . ?
C21 C22 1.391(6) . ?
C22 C23 1.473(6) . ?
C22 C30 1.381(6) . ?
C23 C24 1.390(6) . ?
C24 C25 1.377(6) . ?
C25 C26 1.382(7) . ?
C26 C27 1.378(6) . ?
C28 C29 1.400(6) . ?
C29 C30 1.419(5) . ?
C29 C31 1.450(6) . ?
C31 C32 1.394(6) . ?
C32 C33 1.381(7) . ?
C33 C34 1.386(7) . ?
C34 C35 1.377(7) . ?
Cl6 C39 1.753(6) . ?
Cl7 C39 1.758(6) . ?
Cl8 C39 1.758(6) . ?
Cl4 C37 1.770(6) . ?
Cl5 C38 1.781(5) . ?
C37 C38 1.495(7) . ?
Cl3 C36 1.789(7) . ?
C36 C36 1.461(11) 2_666 ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
N1 Pt1 Cl1 99.72(11) . . ?
N2 Pt1 Cl1 99.05(11) . . ?
N2 Pt1 N1 161.23(14) . . ?
C11 Pt1 Cl1 176.29(12) . . ?
C11 Pt1 N1 80.46(17) . . ?
C11 Pt1 N2 80.80(17) . . ?
N5 Pt2 Cl2 99.41(11) . . ?
N6 Pt2 Cl2 99.55(11) . . ?
N6 Pt2 N5 161.04(14) . . ?
C30 Pt2 Cl2 177.05(12) . . ?
C30 Pt2 N5 80.20(16) . . ?
C30 Pt2 N6 80.90(16) . . ?
C1 N1 Pt1 126.3(3) . . ?
C1 N1 C5 119.3(4) . . ?
C5 N1 Pt1 114.4(3) . . ?
C12 N2 Pt1 114.3(3) . . ?
C16 N2 Pt1 126.6(3) . . ?
C16 N2 C12 119.0(4) . . ?
C8 N3 C17 117.0(4) . . ?
C18 N3 C8 119.9(4) . . ?
C18 N3 C17 117.2(4) . . ?
C18 N4 C19 117.9(4) . . ?
C18 N4 C20 119.7(4) . . ?
C20 N4 C19 115.9(4) . . ?
C23 N5 Pt2 114.8(3) . . ?
C27 N5 Pt2 125.9(3) . . ?
C27 N5 C23 119.3(4) . . ?
C31 N6 Pt2 114.6(3) . . ?
C35 N6 Pt2 126.3(3) . . ?
C35 N6 C31 119.0(4) . . ?
N1 C1 C2 121.9(5) . . ?
C1 C2 C3 119.9(5) . . ?
C4 C3 C2 118.5(5) . . ?
C3 C4 C5 120.1(5) . . ?
N1 C5 C4 120.4(4) . . ?
N1 C5 C6 114.1(4) . . ?
C4 C5 C6 125.5(4) . . ?
C7 C6 C5 129.0(4) . . ?
C7 C6 C11 119.2(4) . . ?
C11 C6 C5 111.7(4) . . ?
C6 C7 C8 119.1(4) . . ?
C7 C8 N3 118.7(4) . . ?
C7 C8 C9 121.5(4) . . ?
C9 C8 N3 119.8(4) . . ?
C8 C9 C10 119.7(4) . . ?
C9 C10 C11 118.0(4) . . ?
C9 C10 C12 129.3(4) . . ?
C11 C10 C12 112.5(4) . . ?
C6 C11 Pt1 119.2(3) . . ?
C6 C11 C10 122.3(4) . . ?
C10 C11 Pt1 118.5(3) . . ?
N2 C12 C10 113.8(4) . . ?
N2 C12 C13 119.8(4) . . ?
C13 C12 C10 126.4(4) . . ?
C14 C13 C12 120.1(4) . . ?
C13 C14 C15 119.8(4) . . ?
C16 C15 C14 118.5(4) . . ?
N2 C16 C15 122.7(4) . . ?
O1 C18 N3 122.1(4) . . ?
O1 C18 N4 121.8(4) . . ?
N3 C18 N4 116.1(4) . . ?
C21 C20 N4 118.9(4) . . ?
C21 C20 C28 122.3(4) . . ?
C28 C20 N4 118.8(4) . . ?
C22 C21 C20 118.6(4) . . ?
C21 C22 C23 128.0(4) . . ?
C30 C22 C21 119.7(4) . . ?
C30 C22 C23 112.3(4) . . ?
N5 C23 C22 113.1(4) . . ?
N5 C23 C24 120.5(4) . . ?
C24 C23 C22 126.4(4) . . ?
C25 C24 C23 119.2(5) . . ?
C24 C25 C26 119.9(4) . . ?
C27 C26 C25 119.1(4) . . ?
N5 C27 C26 121.8(4) . . ?
C20 C28 C29 119.4(4) . . ?
C28 C29 C30 117.6(4) . . ?
C28 C29 C31 129.8(4) . . ?
C30 C29 C31 112.6(4) . . ?
C22 C30 Pt2 119.6(3) . . ?
C22 C30 C29 122.4(4) . . ?
C29 C30 Pt2 117.9(3) . . ?
N6 C31 C29 113.9(4) . . ?
N6 C31 C32 120.7(4) . . ?
C32 C31 C29 125.4(4) . . ?
C33 C32 C31 119.1(4) . . ?
C32 C33 C34 119.7(4) . . ?
C35 C34 C33 118.9(4) . . ?
N6 C35 C34 122.5(4) . . ?
Cl6 C39 Cl7 110.9(3) . . ?
Cl6 C39 Cl8 110.8(3) . . ?
Cl7 C39 Cl8 110.0(3) . . ?
C38 C37 Cl4 112.4(4) . . ?
C37 C38 Cl5 111.9(4) . . ?
C36 C36 Cl3 110.6(6) 2_666 . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
Pt1 N1 C1 C2 177.4(4) . . . . ?
Pt1 N1 C5 C4 -179.2(3) . . . . ?
Pt1 N1 C5 C6 -0.3(4) . . . . ?
Pt1 N2 C12 C10 -0.9(4) . . . . ?
Pt1 N2 C12 C13 -178.8(3) . . . . ?
Pt1 N2 C16 C15 179.4(3) . . . . ?
Pt2 N5 C23 C22 -0.2(4) . . . . ?
Pt2 N5 C23 C24 -178.8(3) . . . . ?
Pt2 N5 C27 C26 -179.6(3) . . . . ?
Pt2 N6 C31 C29 -0.6(5) . . . . ?
Pt2 N6 C31 C32 -178.5(3) . . . . ?
Pt2 N6 C35 C34 176.9(4) . . . . ?
N1 C1 C2 C3 0.9(8) . . . . ?
N1 C5 C6 C7 175.2(4) . . . . ?
N1 C5 C6 C11 -2.2(5) . . . . ?
N2 C12 C13 C14 -1.2(6) . . . . ?
N3 C8 C9 C10 -174.4(4) . . . . ?
N4 C20 C21 C22 -176.8(4) . . . . ?
N4 C20 C28 C29 178.7(4) . . . . ?
N5 Pt2 C30 C22 -0.9(3) . . . . ?
N5 Pt2 C30 C29 178.3(3) . . . . ?
N5 C23 C24 C25 -1.9(6) . . . . ?
N6 Pt2 C30 C22 177.5(3) . . . . ?
N6 Pt2 C30 C29 -3.4(3) . . . . ?
N6 C31 C32 C33 0.9(7) . . . . ?
C1 N1 C5 C4 -2.0(6) . . . . ?
C1 N1 C5 C6 176.9(4) . . . . ?
C1 C2 C3 C4 -0.8(8) . . . . ?
C2 C3 C4 C5 -0.7(8) . . . . ?
C3 C4 C5 N1 2.1(7) . . . . ?
C3 C4 C5 C6 -176.7(4) . . . . ?
C4 C5 C6 C7 -5.9(7) . . . . ?
C4 C5 C6 C11 176.6(4) . . . . ?
C5 N1 C1 C2 0.5(7) . . . . ?
C5 C6 C7 C8 -179.7(4) . . . . ?
C5 C6 C11 Pt1 4.1(5) . . . . ?
C5 C6 C11 C10 -178.0(4) . . . . ?
C6 C7 C8 N3 176.6(4) . . . . ?
C6 C7 C8 C9 -1.6(6) . . . . ?
C7 C6 C11 Pt1 -173.7(3) . . . . ?
C7 C6 C11 C10 4.3(6) . . . . ?
C7 C8 C9 C10 3.8(6) . . . . ?
C8 N3 C18 O1 143.9(4) . . . . ?
C8 N3 C18 N4 -35.2(6) . . . . ?
C8 C9 C10 C11 -2.0(6) . . . . ?
C8 C9 C10 C12 173.3(4) . . . . ?
C9 C10 C11 Pt1 176.0(3) . . . . ?
C9 C10 C11 C6 -2.0(6) . . . . ?
C9 C10 C12 N2 -174.9(4) . . . . ?
C9 C10 C12 C13 2.9(7) . . . . ?
C10 C12 C13 C14 -178.8(4) . . . . ?
C11 C6 C7 C8 -2.4(6) . . . . ?
C11 C10 C12 N2 0.6(5) . . . . ?
C11 C10 C12 C13 178.4(4) . . . . ?
C12 N2 C16 C15 -2.4(6) . . . . ?
C12 C10 C11 Pt1 -0.1(5) . . . . ?
C12 C10 C11 C6 -178.1(4) . . . . ?
C12 C13 C14 C15 -0.8(7) . . . . ?
C13 C14 C15 C16 1.2(7) . . . . ?
C14 C15 C16 N2 0.4(7) . . . . ?
C16 N2 C12 C10 -179.3(4) . . . . ?
C16 N2 C12 C13 2.8(6) . . . . ?
C17 N3 C8 C7 92.9(5) . . . . ?
C17 N3 C8 C9 -88.9(5) . . . . ?
C17 N3 C18 O1 -8.2(7) . . . . ?
C17 N3 C18 N4 172.8(4) . . . . ?
C18 N3 C8 C7 -59.2(5) . . . . ?
C18 N3 C8 C9 119.0(5) . . . . ?
C18 N4 C20 C21 123.8(4) . . . . ?
C18 N4 C20 C28 -56.0(5) . . . . ?
C19 N4 C18 O1 -5.6(6) . . . . ?
C19 N4 C18 N3 173.5(4) . . . . ?
C19 N4 C20 C21 -85.2(5) . . . . ?
C19 N4 C20 C28 95.1(5) . . . . ?
C20 N4 C18 O1 144.9(4) . . . . ?
C20 N4 C18 N3 -36.0(6) . . . . ?
C20 C21 C22 C23 175.2(4) . . . . ?
C20 C21 C22 C30 -2.3(6) . . . . ?
C20 C28 C29 C30 -1.5(6) . . . . ?
C20 C28 C29 C31 177.4(4) . . . . ?
C21 C20 C28 C29 -1.0(6) . . . . ?
C21 C22 C23 N5 -178.1(4) . . . . ?
C21 C22 C23 C24 0.3(7) . . . . ?
C21 C22 C30 Pt2 178.9(3) . . . . ?
C21 C22 C30 C29 -0.2(6) . . . . ?
C22 C23 C24 C25 179.8(4) . . . . ?
C23 N5 C27 C26 -2.5(6) . . . . ?
C23 C22 C30 Pt2 1.0(5) . . . . ?
C23 C22 C30 C29 -178.1(4) . . . . ?
C23 C24 C25 C26 -1.3(7) . . . . ?
C24 C25 C26 C27 2.6(7) . . . . ?
C25 C26 C27 N5 -0.7(7) . . . . ?
C27 N5 C23 C22 -177.7(4) . . . . ?
C27 N5 C23 C24 3.8(6) . . . . ?
C28 C20 C21 C22 3.0(6) . . . . ?
C28 C29 C30 Pt2 -177.0(3) . . . . ?
C28 C29 C30 C22 2.1(6) . . . . ?
C28 C29 C31 N6 179.1(4) . . . . ?
C28 C29 C31 C32 -3.1(7) . . . . ?
C29 C31 C32 C33 -176.8(4) . . . . ?
C30 C22 C23 N5 -0.4(5) . . . . ?
C30 C22 C23 C24 178.0(4) . . . . ?
C30 C29 C31 N6 -2.0(5) . . . . ?
C30 C29 C31 C32 175.8(4) . . . . ?
C31 N6 C35 C34 0.4(7) . . . . ?
C31 C29 C30 Pt2 4.0(5) . . . . ?
C31 C29 C30 C22 -176.9(4) . . . . ?
C31 C32 C33 C34 1.0(7) . . . . ?
C32 C33 C34 C35 -2.2(8) . . . . ?
C33 C34 C35 N6 1.5(8) . . . . ?
C35 N6 C31 C29 176.3(4) . . . . ?
C35 N6 C31 C32 -1.6(6) . . . . ?
Cl4 C37 C38 Cl5 -64.2(5) . . . . ?

####################################################################### 
# 
# 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_a
_database_code_depnum_ccdc_archive 'CCDC 1427838'
_audit_update_record             
;
2015-09-28 deposited with the CCDC.
2017-07-03 downloaded from the CCDC.
;
_audit_creation_date             2015-08-18
_audit_creation_method           
;
Olex2 1.2
(compiled 2015.01.26 svn.r3150 for OlexSys, GUI svn.r4998)
;
_shelxl_version_number           2013-4
_chemical_name_common            ?
_chemical_name_systematic        
;
 ?
;
_chemical_formula_moiety         'C35 H26 Cl2 N6 O Pt2'
_chemical_formula_sum            'C35 H26 Cl2 N6 O Pt2'
_chemical_formula_weight         1007.70
_chemical_melting_point          ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
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'
Pt Pt -1.7033 8.3905 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_space_group_crystal_system      orthorhombic
_space_group_IT_number           60
_space_group_name_H-M_alt        'P b c n'
_space_group_name_Hall           '-P 2n 2ab'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, -y+1/2, z+1/2'
'-x, y, -z+1/2'
'x+1/2, -y+1/2, -z'
'-x, -y, -z'
'x-1/2, y-1/2, -z-1/2'
'x, -y, z-1/2'
'-x-1/2, y-1/2, z'

_cell_length_a                   17.353(2)
_cell_length_b                   13.8521(17)
_cell_length_c                   25.760(3)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_volume                     6192.0(13)
_cell_formula_units_Z            8
_cell_measurement_reflns_used    16478
_cell_measurement_temperature    173.1500
_cell_measurement_theta_max      27.4846
_cell_measurement_theta_min      1.1735
_shelx_estimated_absorpt_T_max   ?
_shelx_estimated_absorpt_T_min   ?
_exptl_absorpt_coefficient_mu    9.241
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.6018
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'CrystalClear (Rigaku Inc., 2007)'
_exptl_crystal_colour            orange
_exptl_crystal_colour_primary    orange
_exptl_crystal_density_diffrn    2.162
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       Plate
_exptl_crystal_F_000             3808
_exptl_crystal_size_max          0.27
_exptl_crystal_size_mid          0.07
_exptl_crystal_size_min          0.03
_exptl_special_details           
;
 ?
;
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0839
_diffrn_reflns_av_unetI/netI     0.0762
_diffrn_reflns_Laue_measured_fraction_full 0.997
_diffrn_reflns_Laue_measured_fraction_max 0.997
_diffrn_reflns_limit_h_max       22
_diffrn_reflns_limit_h_min       -19
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_k_min       -10
_diffrn_reflns_limit_l_max       33
_diffrn_reflns_limit_l_min       -33
_diffrn_reflns_number            24323
_diffrn_reflns_point_group_measured_fraction_full 0.997
_diffrn_reflns_point_group_measured_fraction_max 0.997
_diffrn_reflns_theta_full        26.000
_diffrn_reflns_theta_max         27.484
_diffrn_reflns_theta_min         1.881
_diffrn_ambient_temperature      173.1500
_diffrn_detector_area_resol_mean 28.5714
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_details      
;
scan:
	Number of images: 360
	           Slice: -110.0000 - 70.0000
	     Image width: 0.5000
	        Exp time: 13.0000
	   Rotation axis: Omega
	           Omega: 0.0000
	             Chi: 45.0000
	             Phi: 90.0000
	             XTD: 45.0306
	          2theta: -20.2473
;
_diffrn_measurement_device       
;
Saturn724+ (2x2 bin mode)
;
_diffrn_measurement_device_details 
;
AFC10: Fixed Chi 2 circle
;
_diffrn_measurement_device_type  'MM007-HF CCD(Saturn 724+)'
_diffrn_measurement_method       'ω scans at fixed χ = 45°'
_diffrn_number_total             7782
_diffrn_orient_matrix_type       d*Trek
_diffrn_orient_matrix_UB_11      -0.0003
_diffrn_orient_matrix_UB_12      0.0450
_diffrn_orient_matrix_UB_13      0.0565
_diffrn_orient_matrix_UB_21      0.0094
_diffrn_orient_matrix_UB_22      -0.0445
_diffrn_orient_matrix_UB_23      0.0354
_diffrn_orient_matrix_UB_31      0.0383
_diffrn_orient_matrix_UB_32      0.0050
_diffrn_orient_matrix_UB_33      -0.0038
_diffrn_radiation_detector       CCD
_diffrn_radiation_monochromator  Confocal
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   'Rotating Anode'
_diffrn_source_current           24.0000
_diffrn_source_power             1.2000
_diffrn_source_voltage           50.0000
_diffrn_special_details          
;
 ?
;
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                6302
_reflns_number_total             7077
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'CrystalClear (Rigaku Inc., 2007)'
_computing_data_collection       'CrystalClear (Rigaku Inc., 2007)'
_computing_data_reduction        'CrystalClear (Rigaku Inc., 2007)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'CIFTAB (Sheldrick, 2013)'
_computing_structure_refinement  'SHELXL (Sheldrick, 2014)'
_computing_structure_solution    
;
'SHELXT (Sheldrick, 2014)'
;
_refine_diff_density_max         1.517
_refine_diff_density_min         -1.762
_refine_diff_density_rms         0.286
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.216
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     417
_refine_ls_number_reflns         7077
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0839
_refine_ls_R_factor_gt           0.0729
_refine_ls_restrained_S_all      1.216
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0607P)²+60.0606P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1666
_refine_ls_wR_factor_ref         0.1729
_refine_special_details          
;
 ?
;
_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.a Aromatic/amide H refined with riding coordinates:
 C1(H1), C2(H2), C3(H3), C4(H4), C7(H7), C9(H9), C13(H13), C14(H14), C15(H15),
 C16(H16), C21(H21), C25(H25), C27(H27), C28(H28), C29(H29), C30(H30), C32(H32),
  C33(H33), C34(H34), C35(H35)
2.b Idealised Me refined as rotating group:
 C17(H17A,H17B,H17C), C19(H19A,H19B,H19C)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   ?
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt1 Pt 0.79520(2) 0.80760(3) 0.44917(2) 0.02956(14) Uani 1 1 d . . . . .
Pt2 Pt 0.84172(2) 0.52917(3) 0.36370(2) 0.02965(14) Uani 1 1 d . . . . .
Cl1 Cl 0.91786(16) 0.8271(3) 0.49086(12) 0.0421(7) Uani 1 1 d . . . . .
Cl2 Cl 0.97987(17) 0.5323(3) 0.35435(13) 0.0463(8) Uani 1 1 d . . . . .
O1 O 0.3813(5) 0.6243(7) 0.3564(3) 0.044(2) Uani 1 1 d . . . . .
N1 N 0.8308(6) 0.7931(7) 0.3743(4) 0.033(2) Uani 1 1 d . . . . .
N2 N 0.7268(6) 0.8107(7) 0.5136(4) 0.032(2) Uani 1 1 d . . . . .
N3 N 0.4892(6) 0.7156(8) 0.3477(4) 0.036(2) Uani 1 1 d . . . . .
N4 N 0.4929(5) 0.5643(7) 0.3872(4) 0.031(2) Uani 1 1 d . . . . .
N5 N 0.8343(5) 0.5458(7) 0.4422(4) 0.029(2) Uani 1 1 d . . . . .
N6 N 0.8108(5) 0.5136(7) 0.2875(4) 0.033(2) Uani 1 1 d . . . . .
C1 C 0.9022(7) 0.7902(10) 0.3571(5) 0.041(3) Uani 1 1 d . . . . .
H1 H 0.9419 0.7978 0.3810 0.049 Uiso 1 1 calc R . . . .
C2 C 0.9215(8) 0.7765(12) 0.3058(6) 0.051(4) Uani 1 1 d . . . . .
H2 H 0.9729 0.7736 0.2956 0.061 Uiso 1 1 calc R . . . .
C3 C 0.8632(8) 0.7672(10) 0.2700(5) 0.046(3) Uani 1 1 d . . . . .
H3 H 0.8742 0.7600 0.2349 0.055 Uiso 1 1 calc R . . . .
C4 C 0.7875(7) 0.7687(9) 0.2873(5) 0.039(3) Uani 1 1 d . . . . .
H4 H 0.7476 0.7605 0.2637 0.047 Uiso 1 1 calc R . . . .
C5 C 0.7709(7) 0.7820(7) 0.3383(4) 0.029(2) Uani 1 1 d . . . . .
C6 C 0.6959(7) 0.7802(8) 0.3621(4) 0.029(2) Uani 1 1 d . . . . .
C7 C 0.6244(6) 0.7597(8) 0.3403(4) 0.028(2) Uani 1 1 d . . . . .
H7 H 0.6204 0.7520 0.3046 0.034 Uiso 1 1 calc R . . . .
C8 C 0.5590(6) 0.7505(9) 0.3708(4) 0.032(2) Uani 1 1 d . . . . .
C9 C 0.5612(6) 0.7691(8) 0.4245(4) 0.030(2) Uani 1 1 d . . . . .
H9 H 0.5163 0.7668 0.4442 0.037 Uiso 1 1 calc R . . . .
C10 C 0.6305(6) 0.7907(9) 0.4476(4) 0.030(2) Uani 1 1 d . . . . .
C11 C 0.6964(7) 0.7923(8) 0.4166(5) 0.032(2) Uani 1 1 d . . . . .
C12 C 0.6494(6) 0.7989(8) 0.5028(4) 0.029(2) Uani 1 1 d . . . . .
C13 C 0.5981(7) 0.7970(9) 0.5435(5) 0.034(3) Uani 1 1 d . . . . .
H13 H 0.5456 0.7932 0.5367 0.041 Uiso 1 1 calc R . . . .
C14 C 0.6229(8) 0.8008(11) 0.5942(5) 0.048(3) Uani 1 1 d . . . . .
H14 H 0.5879 0.7974 0.6215 0.058 Uiso 1 1 calc R . . . .
C15 C 0.7008(7) 0.8095(9) 0.6036(5) 0.039(3) Uani 1 1 d . . . . .
H15 H 0.7192 0.8125 0.6375 0.047 Uiso 1 1 calc R . . . .
C16 C 0.7503(8) 0.8137(9) 0.5630(5) 0.037(3) Uani 1 1 d . . . . .
H16 H 0.8028 0.8189 0.5697 0.045 Uiso 1 1 calc R . . . .
C17 C 0.4416(10) 0.7879(11) 0.3210(6) 0.060(4) Uani 1 1 d . . . . .
H17A H 0.4035 0.8125 0.3446 0.089 Uiso 1 1 calc GR . . . .
H17B H 0.4165 0.7585 0.2918 0.089 Uiso 1 1 calc GR . . . .
H17C H 0.4737 0.8399 0.3093 0.089 Uiso 1 1 calc GR . . . .
C18 C 0.4512(6) 0.6336(10) 0.3634(4) 0.037(3) Uani 1 1 d . . . . .
C19 C 0.4514(7) 0.4829(11) 0.4101(6) 0.047(3) Uani 1 1 d . . . . .
H19A H 0.4110 0.5068 0.4321 0.071 Uiso 1 1 calc GR . . . .
H19B H 0.4864 0.4445 0.4302 0.071 Uiso 1 1 calc GR . . . .
H19C H 0.4295 0.4441 0.3830 0.071 Uiso 1 1 calc GR . . . .
C20 C 0.5748(6) 0.5506(9) 0.3812(5) 0.032(2) Uani 1 1 d . . . . .
C21 C 0.6062(7) 0.5354(8) 0.3322(4) 0.032(2) Uani 1 1 d . . . . .
H21 H 0.5746 0.5309 0.3032 0.038 Uiso 1 1 calc R . . . .
C22 C 0.6864(7) 0.5271(9) 0.3275(4) 0.031(2) Uani 1 1 d . . . . .
C23 C 0.7329(7) 0.5342(8) 0.3710(5) 0.032(2) Uani 1 1 d . . . . .
C24 C 0.7010(6) 0.5454(8) 0.4207(5) 0.031(2) Uani 1 1 d . . . . .
C25 C 0.6207(7) 0.5551(8) 0.4253(5) 0.032(2) Uani 1 1 d . . . . .
H25 H 0.5984 0.5645 0.4577 0.038 Uiso 1 1 calc R . . . .
C26 C 0.7611(7) 0.5527(8) 0.4612(4) 0.034(3) Uani 1 1 d . . . . .
C27 C 0.7497(8) 0.5660(9) 0.5134(5) 0.039(3) Uani 1 1 d . . . . .
H27 H 0.6999 0.5728 0.5261 0.047 Uiso 1 1 calc R . . . .
C28 C 0.8107(8) 0.5693(11) 0.5471(5) 0.048(4) Uani 1 1 d . . . . .
H28 H 0.8025 0.5746 0.5826 0.058 Uiso 1 1 calc R . . . .
C29 C 0.8845(8) 0.5645(10) 0.5275(6) 0.046(3) Uani 1 1 d . . . . .
H29 H 0.9268 0.5698 0.5495 0.055 Uiso 1 1 calc R . . . .
C30 C 0.8943(7) 0.5521(9) 0.4756(5) 0.036(3) Uani 1 1 d . . . . .
H30 H 0.9442 0.5479 0.4625 0.043 Uiso 1 1 calc R . . . .
C31 C 0.7322(7) 0.5136(8) 0.2796(5) 0.032(2) Uani 1 1 d . . . . .
C32 C 0.7044(7) 0.5110(9) 0.2294(5) 0.035(3) Uani 1 1 d . . . . .
H32 H 0.6516 0.5143 0.2236 0.042 Uiso 1 1 calc R . . . .
C33 C 0.7533(7) 0.5036(10) 0.1883(5) 0.040(3) Uani 1 1 d . . . . .
H33 H 0.7340 0.4996 0.1547 0.048 Uiso 1 1 calc R . . . .
C34 C 0.8316(7) 0.5019(10) 0.1970(5) 0.039(3) Uani 1 1 d . . . . .
H34 H 0.8657 0.4986 0.1692 0.046 Uiso 1 1 calc R . . . .
C35 C 0.8587(6) 0.5051(9) 0.2467(5) 0.034(3) Uani 1 1 d . . . . .
H35 H 0.9115 0.5013 0.2525 0.041 Uiso 1 1 calc R . . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Pt1 Cl1 2.399(3) . ?
Pt1 N1 2.036(11) . ?
Pt1 N2 2.040(10) . ?
Pt1 C11 1.921(12) . ?
Pt2 Cl2 2.410(3) . ?
Pt2 N5 2.039(9) . ?
Pt2 N6 2.047(10) . ?
Pt2 C23 1.900(12) . ?
O1 C18 1.233(13) . ?
N1 C1 1.316(15) . ?
N1 C5 1.402(15) . ?
N2 C12 1.381(14) . ?
N2 C16 1.338(14) . ?
N3 C8 1.432(15) . ?
N3 C17 1.468(17) . ?
N3 C18 1.374(17) . ?
N4 C18 1.350(16) . ?
N4 C19 1.461(16) . ?
N4 C20 1.441(13) . ?
N5 C26 1.364(15) . ?
N5 C30 1.354(15) . ?
N6 C31 1.378(14) . ?
N6 C35 1.344(15) . ?
C1 H1 0.9300 . ?
C1 C2 1.375(18) . ?
C2 H2 0.9300 . ?
C2 C3 1.375(19) . ?
C3 H3 0.9300 . ?
C3 C4 1.387(18) . ?
C4 H4 0.9300 . ?
C4 C5 1.356(16) . ?
C5 C6 1.439(16) . ?
C6 C7 1.390(16) . ?
C6 C11 1.414(16) . ?
C7 H7 0.9300 . ?
C7 C8 1.386(15) . ?
C8 C9 1.409(16) . ?
C9 H9 0.9300 . ?
C9 C10 1.375(15) . ?
C10 C11 1.394(16) . ?
C10 C12 1.465(14) . ?
C12 C13 1.376(16) . ?
C13 H13 0.9300 . ?
C13 C14 1.374(17) . ?
C14 H14 0.9300 . ?
C14 C15 1.380(18) . ?
C15 H15 0.9300 . ?
C15 C16 1.355(18) . ?
C16 H16 0.9300 . ?
C17 H17A 0.9600 . ?
C17 H17B 0.9600 . ?
C17 H17C 0.9600 . ?
C19 H19A 0.9600 . ?
C19 H19B 0.9600 . ?
C19 H19C 0.9600 . ?
C20 C21 1.391(16) . ?
C20 C25 1.389(16) . ?
C21 H21 0.9300 . ?
C21 C22 1.401(16) . ?
C22 C23 1.384(16) . ?
C22 C31 1.479(16) . ?
C23 C24 1.403(16) . ?
C24 C25 1.406(16) . ?
C24 C26 1.480(16) . ?
C25 H25 0.9300 . ?
C26 C27 1.371(16) . ?
C27 H27 0.9300 . ?
C27 C28 1.369(18) . ?
C28 H28 0.9300 . ?
C28 C29 1.38(2) . ?
C29 H29 0.9300 . ?
C29 C30 1.360(18) . ?
C30 H30 0.9300 . ?
C31 C32 1.382(16) . ?
C32 H32 0.9300 . ?
C32 C33 1.359(16) . ?
C33 H33 0.9300 . ?
C33 C34 1.376(17) . ?
C34 H34 0.9300 . ?
C34 C35 1.365(17) . ?
C35 H35 0.9300 . ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
N1 Pt1 Cl1 99.6(3) . . ?
N1 Pt1 N2 161.7(4) . . ?
N2 Pt1 Cl1 98.6(3) . . ?
C11 Pt1 Cl1 179.3(4) . . ?
C11 Pt1 N1 81.1(4) . . ?
C11 Pt1 N2 80.7(4) . . ?
N5 Pt2 Cl2 99.2(3) . . ?
N5 Pt2 N6 161.2(4) . . ?
N6 Pt2 Cl2 99.6(3) . . ?
C23 Pt2 Cl2 176.9(4) . . ?
C23 Pt2 N5 80.5(4) . . ?
C23 Pt2 N6 80.7(4) . . ?
C1 N1 Pt1 127.4(9) . . ?
C1 N1 C5 118.2(11) . . ?
C5 N1 Pt1 114.4(7) . . ?
C12 N2 Pt1 113.6(7) . . ?
C16 N2 Pt1 126.6(9) . . ?
C16 N2 C12 119.4(10) . . ?
C8 N3 C17 116.1(11) . . ?
C18 N3 C8 124.2(10) . . ?
C18 N3 C17 115.6(10) . . ?
C18 N4 C19 117.9(10) . . ?
C18 N4 C20 125.0(10) . . ?
C20 N4 C19 115.3(10) . . ?
C26 N5 Pt2 115.0(8) . . ?
C30 N5 Pt2 126.0(8) . . ?
C30 N5 C26 118.9(10) . . ?
C31 N6 Pt2 113.6(8) . . ?
C35 N6 Pt2 126.7(8) . . ?
C35 N6 C31 119.8(10) . . ?
N1 C1 H1 118.1 . . ?
N1 C1 C2 123.9(13) . . ?
C2 C1 H1 118.1 . . ?
C1 C2 H2 120.8 . . ?
C1 C2 C3 118.5(12) . . ?
C3 C2 H2 120.8 . . ?
C2 C3 H3 120.6 . . ?
C2 C3 C4 118.7(12) . . ?
C4 C3 H3 120.6 . . ?
C3 C4 H4 119.5 . . ?
C5 C4 C3 120.9(13) . . ?
C5 C4 H4 119.5 . . ?
N1 C5 C6 113.0(10) . . ?
C4 C5 N1 119.8(11) . . ?
C4 C5 C6 127.0(11) . . ?
C7 C6 C5 129.7(10) . . ?
C7 C6 C11 115.5(10) . . ?
C11 C6 C5 114.5(10) . . ?
C6 C7 H7 119.3 . . ?
C8 C7 C6 121.5(10) . . ?
C8 C7 H7 119.3 . . ?
C7 C8 N3 119.3(10) . . ?
C7 C8 C9 121.1(11) . . ?
C9 C8 N3 119.5(10) . . ?
C8 C9 H9 120.4 . . ?
C10 C9 C8 119.3(10) . . ?
C10 C9 H9 120.4 . . ?
C9 C10 C11 118.2(10) . . ?
C9 C10 C12 129.2(10) . . ?
C11 C10 C12 111.9(10) . . ?
C6 C11 Pt1 116.9(8) . . ?
C10 C11 Pt1 118.9(9) . . ?
C10 C11 C6 124.2(11) . . ?
N2 C12 C10 114.9(10) . . ?
C13 C12 N2 118.6(10) . . ?
C13 C12 C10 126.5(10) . . ?
C12 C13 H13 119.3 . . ?
C14 C13 C12 121.3(12) . . ?
C14 C13 H13 119.3 . . ?
C13 C14 H14 120.7 . . ?
C13 C14 C15 118.5(13) . . ?
C15 C14 H14 120.7 . . ?
C14 C15 H15 120.4 . . ?
C16 C15 C14 119.2(12) . . ?
C16 C15 H15 120.4 . . ?
N2 C16 C15 122.7(12) . . ?
N2 C16 H16 118.6 . . ?
C15 C16 H16 118.6 . . ?
N3 C17 H17A 109.5 . . ?
N3 C17 H17B 109.5 . . ?
N3 C17 H17C 109.5 . . ?
H17A C17 H17B 109.5 . . ?
H17A C17 H17C 109.5 . . ?
H17B C17 H17C 109.5 . . ?
O1 C18 N3 121.0(12) . . ?
O1 C18 N4 121.3(13) . . ?
N4 C18 N3 117.7(10) . . ?
N4 C19 H19A 109.5 . . ?
N4 C19 H19B 109.5 . . ?
N4 C19 H19C 109.5 . . ?
H19A C19 H19B 109.5 . . ?
H19A C19 H19C 109.5 . . ?
H19B C19 H19C 109.5 . . ?
C21 C20 N4 120.2(11) . . ?
C25 C20 N4 118.2(10) . . ?
C25 C20 C21 121.6(11) . . ?
C20 C21 H21 120.6 . . ?
C20 C21 C22 118.7(11) . . ?
C22 C21 H21 120.6 . . ?
C21 C22 C31 128.1(10) . . ?
C23 C22 C21 120.2(11) . . ?
C23 C22 C31 111.7(10) . . ?
C22 C23 Pt2 119.8(9) . . ?
C22 C23 C24 121.1(11) . . ?
C24 C23 Pt2 119.1(9) . . ?
C23 C24 C25 118.6(11) . . ?
C23 C24 C26 112.0(10) . . ?
C25 C24 C26 129.3(11) . . ?
C20 C25 C24 119.7(11) . . ?
C20 C25 H25 120.1 . . ?
C24 C25 H25 120.1 . . ?
N5 C26 C24 113.4(10) . . ?
N5 C26 C27 119.7(11) . . ?
C27 C26 C24 126.8(12) . . ?
C26 C27 H27 119.5 . . ?
C28 C27 C26 120.9(13) . . ?
C28 C27 H27 119.5 . . ?
C27 C28 H28 120.5 . . ?
C27 C28 C29 119.0(12) . . ?
C29 C28 H28 120.5 . . ?
C28 C29 H29 120.6 . . ?
C30 C29 C28 118.9(13) . . ?
C30 C29 H29 120.6 . . ?
N5 C30 C29 122.4(12) . . ?
N5 C30 H30 118.8 . . ?
C29 C30 H30 118.8 . . ?
N6 C31 C22 114.2(10) . . ?
N6 C31 C32 118.8(11) . . ?
C32 C31 C22 126.6(11) . . ?
C31 C32 H32 119.6 . . ?
C33 C32 C31 120.9(11) . . ?
C33 C32 H32 119.6 . . ?
C32 C33 H33 120.3 . . ?
C32 C33 C34 119.4(12) . . ?
C34 C33 H33 120.3 . . ?
C33 C34 H34 120.3 . . ?
C35 C34 C33 119.4(11) . . ?
C35 C34 H34 120.3 . . ?
N6 C35 C34 121.5(10) . . ?
N6 C35 H35 119.2 . . ?
C34 C35 H35 119.2 . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
Pt1 N1 C1 C2 177.4(11) . . . . ?
Pt1 N1 C5 C4 -178.0(9) . . . . ?
Pt1 N1 C5 C6 -1.7(11) . . . . ?
Pt1 N2 C12 C10 -2.6(13) . . . . ?
Pt1 N2 C12 C13 178.2(9) . . . . ?
Pt1 N2 C16 C15 -175.8(9) . . . . ?
Pt2 N5 C26 C24 0.7(12) . . . . ?
Pt2 N5 C26 C27 -178.7(9) . . . . ?
Pt2 N5 C30 C29 179.1(10) . . . . ?
Pt2 N6 C31 C22 1.4(12) . . . . ?
Pt2 N6 C31 C32 175.1(9) . . . . ?
Pt2 N6 C35 C34 -175.3(10) . . . . ?
Pt2 C23 C24 C25 176.1(8) . . . . ?
Pt2 C23 C24 C26 0.5(13) . . . . ?
N1 C1 C2 C3 1(2) . . . . ?
N1 C5 C6 C7 -171.9(11) . . . . ?
N1 C5 C6 C11 1.5(14) . . . . ?
N2 C12 C13 C14 -4.0(19) . . . . ?
N3 C8 C9 C10 171.8(11) . . . . ?
N4 C20 C21 C22 176.9(11) . . . . ?
N4 C20 C25 C24 -177.8(10) . . . . ?
N5 Pt2 C23 C22 179.6(10) . . . . ?
N5 Pt2 C23 C24 -0.1(9) . . . . ?
N5 C26 C27 C28 -2.1(19) . . . . ?
N6 Pt2 C23 C22 -0.6(9) . . . . ?
N6 Pt2 C23 C24 179.7(10) . . . . ?
N6 C31 C32 C33 3.3(19) . . . . ?
C1 N1 C5 C4 -0.1(16) . . . . ?
C1 N1 C5 C6 176.2(11) . . . . ?
C1 C2 C3 C4 -2(2) . . . . ?
C2 C3 C4 C5 2(2) . . . . ?
C3 C4 C5 N1 -0.8(18) . . . . ?
C3 C4 C5 C6 -176.5(12) . . . . ?
C4 C5 C6 C7 4(2) . . . . ?
C4 C5 C6 C11 177.4(11) . . . . ?
C5 N1 C1 C2 0(2) . . . . ?
C5 C6 C7 C8 172.3(11) . . . . ?
C5 C6 C11 Pt1 -0.6(13) . . . . ?
C5 C6 C11 C10 -178.4(11) . . . . ?
C6 C7 C8 N3 -171.0(10) . . . . ?
C6 C7 C8 C9 5.1(18) . . . . ?
C7 C6 C11 Pt1 173.8(8) . . . . ?
C7 C6 C11 C10 -4.1(17) . . . . ?
C7 C8 C9 C10 -4.2(18) . . . . ?
C8 N3 C18 O1 154.1(12) . . . . ?
C8 N3 C18 N4 -25.2(17) . . . . ?
C8 C9 C10 C11 -0.7(17) . . . . ?
C8 C9 C10 C12 -170.2(12) . . . . ?
C9 C10 C11 Pt1 -172.9(9) . . . . ?
C9 C10 C11 C6 5.0(18) . . . . ?
C9 C10 C12 N2 172.8(12) . . . . ?
C9 C10 C12 C13 -8(2) . . . . ?
C10 C12 C13 C14 176.9(13) . . . . ?
C11 C6 C7 C8 -1.0(16) . . . . ?
C11 C10 C12 N2 2.7(15) . . . . ?
C11 C10 C12 C13 -178.1(12) . . . . ?
C12 N2 C16 C15 -2.8(18) . . . . ?
C12 C10 C11 Pt1 -1.6(14) . . . . ?
C12 C10 C11 C6 176.2(11) . . . . ?
C12 C13 C14 C15 2(2) . . . . ?
C13 C14 C15 C16 0(2) . . . . ?
C14 C15 C16 N2 1(2) . . . . ?
C16 N2 C12 C10 -176.5(10) . . . . ?
C16 N2 C12 C13 4.3(16) . . . . ?
C17 N3 C8 C7 -84.0(15) . . . . ?
C17 N3 C8 C9 99.9(14) . . . . ?
C17 N3 C18 O1 -2.0(18) . . . . ?
C17 N3 C18 N4 178.7(12) . . . . ?
C18 N3 C8 C7 120.0(13) . . . . ?
C18 N3 C8 C9 -56.1(16) . . . . ?
C18 N4 C20 C21 -57.3(17) . . . . ?
C18 N4 C20 C25 121.3(13) . . . . ?
C19 N4 C18 O1 -7.3(18) . . . . ?
C19 N4 C18 N3 172.0(11) . . . . ?
C19 N4 C20 C21 107.0(13) . . . . ?
C19 N4 C20 C25 -74.4(14) . . . . ?
C20 N4 C18 O1 156.6(12) . . . . ?
C20 N4 C18 N3 -24.1(17) . . . . ?
C20 C21 C22 C23 -0.1(17) . . . . ?
C20 C21 C22 C31 -178.2(11) . . . . ?
C21 C20 C25 C24 0.8(17) . . . . ?
C21 C22 C23 Pt2 -176.9(9) . . . . ?
C21 C22 C23 C24 2.8(18) . . . . ?
C21 C22 C31 N6 176.4(11) . . . . ?
C21 C22 C31 C32 3(2) . . . . ?
C22 C23 C24 C25 -3.7(17) . . . . ?
C22 C23 C24 C26 -179.2(11) . . . . ?
C22 C31 C32 C33 176.2(12) . . . . ?
C23 C22 C31 N6 -1.9(14) . . . . ?
C23 C22 C31 C32 -175.0(12) . . . . ?
C23 C24 C25 C20 1.9(17) . . . . ?
C23 C24 C26 N5 -0.8(14) . . . . ?
C23 C24 C26 C27 178.6(12) . . . . ?
C24 C26 C27 C28 178.5(12) . . . . ?
C25 C20 C21 C22 -1.7(17) . . . . ?
C25 C24 C26 N5 -175.8(11) . . . . ?
C25 C24 C26 C27 4(2) . . . . ?
C26 N5 C30 C29 0.5(18) . . . . ?
C26 C24 C25 C20 176.6(11) . . . . ?
C26 C27 C28 C29 4(2) . . . . ?
C27 C28 C29 C30 -3(2) . . . . ?
C28 C29 C30 N5 1(2) . . . . ?
C30 N5 C26 C24 179.5(10) . . . . ?
C30 N5 C26 C27 0.1(17) . . . . ?
C31 N6 C35 C34 3.8(19) . . . . ?
C31 C22 C23 Pt2 1.5(14) . . . . ?
C31 C22 C23 C24 -178.8(11) . . . . ?
C31 C32 C33 C34 -2(2) . . . . ?
C32 C33 C34 C35 2(2) . . . . ?
C33 C34 C35 N6 -3(2) . . . . ?
C35 N6 C31 C22 -177.8(11) . . . . ?
C35 N6 C31 C32 -4.1(17) . . . . ?

_olex2_submission_special_instructions 'No special instructions were received'
