# Electronic Supplementary Material (ESI) for RSC Advances.
# This journal is © The Royal Society of Chemistry 2021

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
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data_1-DMA
_database_code_depnum_ccdc_archive 'CCDC 2084817'
loop_
_audit_author_name
_audit_author_address
'Yasuhiro Shigeta'
;Kanazawa University
Japan
;
_audit_update_record             
;
2021-05-20 deposited with the CCDC.	2021-09-29 downloaded from the CCDC.
;
_audit_creation_date             2021-02-24
_audit_creation_method           
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_shelx_SHELXL_version_number     2018/3
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C21 H24 Cl2 K N5 O2 Pt, C4 H9 N O'
_chemical_formula_sum            'C25 H33 Cl2 K N6 O3 Pt'
_chemical_formula_weight         770.66
_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 0.0181 0.0091 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.3639 0.7018 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
K K 0.3868 1.0657 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Pt Pt -4.5932 6.9264 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

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

_cell_length_a                   7.4967(2)
_cell_length_b                   10.2891(3)
_cell_length_c                   20.1177(5)
_cell_angle_alpha                79.8210(10)
_cell_angle_beta                 87.1710(10)
_cell_angle_gamma                74.1520(10)
_cell_volume                     1469.29(7)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    9992
_cell_measurement_temperature    90
_cell_measurement_theta_max      72.67
_cell_measurement_theta_min      4.47
_shelx_estimated_absorpt_T_max   0.581
_shelx_estimated_absorpt_T_min   0.085
_exptl_absorpt_coefficient_mu    12.183
_exptl_absorpt_correction_T_max  0.7536
_exptl_absorpt_correction_T_min  0.4769
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
'SADABS-2016/2 (Bruker,2016/2) was used for absorption correction. wR2(int) was 0.0940 before and 0.0390 after correction. The Ratio of minimum to maximum transmission is 0.6328. The λ/2 correction factor is Not present.'
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            'clear yellowish green'
_exptl_crystal_colour_lustre     clear
_exptl_crystal_colour_modifier   yellowish
_exptl_crystal_colour_primary    green
_exptl_crystal_density_diffrn    1.742
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       plate
_exptl_crystal_F_000             760
_exptl_crystal_size_max          0.4
_exptl_crystal_size_mid          0.1
_exptl_crystal_size_min          0.05
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0276
_diffrn_reflns_av_unetI/netI     0.0329
_diffrn_reflns_Laue_measured_fraction_full 0.983
_diffrn_reflns_Laue_measured_fraction_max 0.961
_diffrn_reflns_limit_h_max       8
_diffrn_reflns_limit_h_min       -6
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       24
_diffrn_reflns_limit_l_min       -24
_diffrn_reflns_number            12451
_diffrn_reflns_point_group_measured_fraction_full 0.983
_diffrn_reflns_point_group_measured_fraction_max 0.961
_diffrn_reflns_theta_full        67.679
_diffrn_reflns_theta_max         72.663
_diffrn_reflns_theta_min         2.231
_diffrn_ambient_temperature      90
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.983
_diffrn_measured_fraction_theta_max 0.961
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54178
_diffrn_source                   ?
_diffrn_standards_number         0
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                5358
_reflns_number_total             5622
_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       'SAINT V8.38A (?, 2016)'
_computing_data_collection       ?
_computing_data_reduction        'SAINT V8.38A (?, 2016)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2015)'
_computing_structure_solution    'ShelXT (Sheldrick, 2015)'
_refine_diff_density_max         1.968
_refine_diff_density_min         -1.402
_refine_diff_density_rms         0.109
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.051
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     415
_refine_ls_number_reflns         5622
_refine_ls_number_restraints     21
_refine_ls_R_factor_all          0.0270
_refine_ls_R_factor_gt           0.0251
_refine_ls_restrained_S_all      1.050
_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)+(0.0314P)²+2.5253P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0622
_refine_ls_wR_factor_ref         0.0633
_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, All C(H,H,H,H,H,H) groups
2. Restrained distances
 C20B-N5B
 1.36 with sigma of 0.02
 C20B-O2
 1.25 with sigma of 0.02
3. Rigid bond restraints
 O2
 with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.01
 N5A, C19A
 with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.01
 N5A, C20A
 with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.01
 C21A, C20A
 with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.01
 N5B, C21B
 with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.01
 C20A, N5A
 with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.01
 C20A, O2
 with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.01
 C20B, C18B
 with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.01
4. Uiso/Uaniso restraints and constraints
C20B \\sim C20A: within 1.7A with sigma of 0.04 and sigma for terminal atoms of
0.08
N5B \\sim N5A: within 1.7A with sigma of 0.04 and sigma for terminal atoms of
0.08
Uanis(N4B) = Uanis(N4A)
Uanis(C17A) = Uanis(C17B)
Uanis(N6A) = Uanis(N6B)
Uanis(C26) = Uanis(C24)
5. Others
 Fixed Sof: H16d(0.65) H16e(0.65) H16f(0.65) H16a(0.35) H16b(0.35) H16c(0.35)
 H14d(0.65) H14e(0.65) H14f(0.65) H14a(0.35) H14b(0.35) H14c(0.35) H25d(0.5)
 H25e(0.5) H25f(0.5) H25a(0.5) H25b(0.5) H25c(0.5) H15d(0.65) H15e(0.65)
 H15f(0.65) H15a(0.35) H15b(0.35) H15c(0.35) H23d(0.5) H23e(0.5) H23f(0.5)
 H23a(0.5) H23b(0.5) H23c(0.5) N4A(0.5) C17A(0.5) H22d(0.5) H22e(0.5) H22f(0.5)
 H22a(0.5) H22b(0.5) H22c(0.5) N6B(0.5) C24(0.5) N6A(0.5) C26(0.5) N4B(0.5)
 C17B(0.5) N5B(0.3) C21B(0.5) H21a(0.5) H21b(0.5) H21c(0.5) C19A(0.5) H19a(0.5)
 H19b(0.5) H19c(0.5) C18B(0.5) H18a(0.5) H18b(0.5) H18c(0.5) C19B(0.5)
 H19d(0.5) H19e(0.5) H19f(0.5) N5A(0.7) C20A(0.65) C20B(0.35) C21A(0.5)
 H21d(0.5) H21e(0.5) H21f(0.5) C18A(0.5) H18d(0.5) H18e(0.5) H18f(0.5)
6.a Aromatic/amide H refined with riding coordinates:
 C11(H11), C8(H8), C5(H5), C10(H10), C2(H2), C3(H3)
6.b Idealised Me refined as rotating group:
 C16(H16d,H16e,H16f), C16(H16a,H16b,H16c), C14(H14d,H14e,H14f), C14(H14a,H14b,
 H14c), C25(H25d,H25e,H25f), C25(H25a,H25b,H25c), C15(H15d,H15e,H15f), C15(H15a,
 H15b,H15c), C23(H23d,H23e,H23f), C23(H23a,H23b,H23c), C22(H22d,H22e,H22f),
 C22(H22a,H22b,H22c), C21B(H21a,H21b,H21c), C19A(H19a,H19b,H19c), C18B(H18a,
 H18b,H18c), C19B(H19d,H19e,H19f), C21A(H21d,H21e,H21f), C18A(H18d,H18e,H18f)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     dual
_atom_sites_solution_secondary   ?
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt1 Pt 0.85623(2) 0.37319(2) 0.26107(2) 0.01581(6) Uani 1 1 d . . . . .
Cl2 Cl 0.85309(13) 0.38604(10) -0.06517(4) 0.02875(18) Uani 1 1 d . . . . .
Cl1 Cl 0.28011(15) 0.95293(10) 0.12613(5) 0.0385(2) Uani 1 1 d . . . . .
O1 O 0.7795(4) 0.4111(3) 0.59374(13) 0.0354(7) Uani 1 1 d . . . . .
O2 O 0.6741(4) 0.7088(3) 0.48070(16) 0.0350(6) Uani 1 1 d D U . . .
N1 N 0.8757(4) 0.3729(3) 0.15812(14) 0.0178(5) Uani 1 1 d . . . . .
O3 O 0.5160(5) 0.7686(3) -0.04498(16) 0.0438(8) Uani 1 1 d . . . . .
C12 C 0.8209(5) 0.3906(4) 0.35571(18) 0.0217(7) Uani 1 1 d . . . . .
C1 C 0.6799(5) 0.5590(4) 0.22747(18) 0.0203(7) Uani 1 1 d . . . . .
N3 N 0.7986(5) 0.4028(4) 0.41206(16) 0.0301(7) Uani 1 1 d . . . . .
C11 C 0.9894(5) 0.2743(4) 0.12853(17) 0.0207(7) Uani 1 1 d . . . . .
H11 H 1.071984 0.199904 0.156110 0.025 Uiso 1 1 calc R . . . .
C8 C 0.7477(5) 0.4881(4) 0.04940(17) 0.0201(7) Uani 1 1 d . . . . .
H8 H 0.662540 0.561979 0.022512 0.024 Uiso 1 1 calc R . . . .
C6 C 0.6507(4) 0.5881(3) 0.15701(17) 0.0180(6) Uani 1 1 d . . . . .
C13 C 1.0371(5) 0.1856(4) 0.28567(17) 0.0233(7) Uani 1 1 d . . . . .
C7 C 0.7582(4) 0.4820(3) 0.11908(17) 0.0169(6) Uani 1 1 d . . . . .
C5 C 0.5309(5) 0.7094(4) 0.12431(19) 0.0221(7) Uani 1 1 d . . . . .
H5 H 0.514121 0.726544 0.076747 0.027 Uiso 1 1 calc R . . . .
C10 C 0.9913(5) 0.2765(4) 0.05974(18) 0.0233(7) Uani 1 1 d . . . . .
H10 H 1.076202 0.207247 0.039748 0.028 Uiso 1 1 calc R . . . .
N2 N 1.1458(5) 0.0809(3) 0.29680(18) 0.0344(8) Uani 1 1 d . . . . .
C4 C 0.4377(5) 0.8036(4) 0.1641(2) 0.0242(7) Uani 1 1 d . . . . .
C9 C 0.8641(5) 0.3840(4) 0.02067(17) 0.0204(7) Uani 1 1 d . . . . .
C2 C 0.5830(5) 0.6607(4) 0.26466(19) 0.0228(7) Uani 1 1 d . . . . .
H2 H 0.599721 0.645475 0.312185 0.027 Uiso 1 1 calc R . . . .
C3 C 0.4633(5) 0.7830(4) 0.2333(2) 0.0261(8) Uani 1 1 d . . . . .
H3 H 0.400315 0.850989 0.259017 0.031 Uiso 1 1 calc R . . . .
C16 C 0.6665(6) 0.5961(4) 0.6632(2) 0.0330(9) Uani 1 1 d . . . . .
H16D H 0.616316 0.654543 0.620742 0.050 Uiso 0.65 1 calc GR . . A 2
H16E H 0.750790 0.636773 0.682993 0.050 Uiso 0.65 1 calc GR . . A 2
H16F H 0.564469 0.588349 0.694757 0.050 Uiso 0.65 1 calc GR . . A 2
H16A H 0.536390 0.598308 0.672997 0.050 Uiso 0.35 1 calc GR . . B 1
H16B H 0.685103 0.612939 0.614251 0.050 Uiso 0.35 1 calc GR . . B 1
H16C H 0.698169 0.667222 0.683173 0.050 Uiso 0.35 1 calc GR . . B 1
C14 C 0.8422(8) 0.4112(7) 0.7691(2) 0.0578(16) Uani 1 1 d . . . . .
H14D H 0.711457 0.429514 0.782526 0.087 Uiso 0.65 1 calc GR . . C 2
H14E H 0.882538 0.495057 0.766034 0.087 Uiso 0.65 1 calc GR . . C 2
H14F H 0.917471 0.339140 0.802881 0.087 Uiso 0.65 1 calc GR . . C 2
H14A H 0.967535 0.348917 0.773602 0.087 Uiso 0.35 1 calc GR . . D 1
H14B H 0.753798 0.364131 0.792552 0.087 Uiso 0.35 1 calc GR . . D 1
H14C H 0.838362 0.492127 0.789178 0.087 Uiso 0.35 1 calc GR . . D 1
C25 C 0.5390(7) 0.7401(5) -0.1688(3) 0.0431(11) Uani 1 1 d . . . . .
H25D H 0.608373 0.796788 -0.197424 0.065 Uiso 0.5 1 calc GR . . E 2
H25E H 0.436266 0.732026 -0.194633 0.065 Uiso 0.5 1 calc GR . . E 2
H25F H 0.621577 0.648739 -0.153520 0.065 Uiso 0.5 1 calc GR . . E 2
H25A H 0.480506 0.685122 -0.191164 0.065 Uiso 0.5 1 calc GR . . F 1
H25B H 0.608369 0.682371 -0.129261 0.065 Uiso 0.5 1 calc GR . . F 1
H25C H 0.623847 0.777200 -0.200311 0.065 Uiso 0.5 1 calc GR . . F 1
C15 C 0.9762(7) 0.2316(5) 0.6885(3) 0.0514(13) Uani 1 1 d . . . . .
H15D H 1.104224 0.215621 0.703183 0.077 Uiso 0.65 1 calc GR . . G 2
H15E H 0.974481 0.230027 0.639988 0.077 Uiso 0.65 1 calc GR . . G 2
H15F H 0.923765 0.159602 0.713278 0.077 Uiso 0.65 1 calc GR . . G 2
H15A H 0.983063 0.160328 0.661232 0.077 Uiso 0.35 1 calc GR . . H 1
H15B H 0.927808 0.204522 0.733461 0.077 Uiso 0.35 1 calc GR . . H 1
H15C H 1.100274 0.243282 0.692825 0.077 Uiso 0.35 1 calc GR . . H 1
C23 C 0.2524(7) 0.9880(5) -0.0601(3) 0.0462(11) Uani 1 1 d . . . . .
H23D H 0.326817 1.050560 -0.055137 0.069 Uiso 0.5 1 calc GR . . I 2
H23E H 0.264420 0.918169 -0.019337 0.069 Uiso 0.5 1 calc GR . . I 2
H23F H 0.121961 1.039798 -0.066620 0.069 Uiso 0.5 1 calc GR . . I 2
H23A H 0.128234 0.975359 -0.063003 0.069 Uiso 0.5 1 calc GR . . J 1
H23B H 0.259874 1.072394 -0.090140 0.069 Uiso 0.5 1 calc GR . . J 1
H23C H 0.276364 0.994531 -0.013524 0.069 Uiso 0.5 1 calc GR . . J 1
N4A N 0.8655(10) 0.3655(8) 0.7021(3) 0.0320(11) Uani 0.5 1 d . . . K 2
C17A C 0.7693(11) 0.4575(9) 0.6500(4) 0.0245(11) Uani 0.5 1 d . . . K 2
C22 C 0.2571(9) 0.9716(7) -0.1907(3) 0.072(2) Uani 1 1 d . . . . .
H22D H 0.229405 0.896916 -0.208873 0.108 Uiso 0.5 1 calc GR . . L 2
H22E H 0.357067 1.000610 -0.217176 0.108 Uiso 0.5 1 calc GR . . L 2
H22F H 0.145968 1.049191 -0.193388 0.108 Uiso 0.5 1 calc GR . . L 2
H22A H 0.272016 1.058985 -0.182306 0.108 Uiso 0.5 1 calc GR . . M 1
H22B H 0.130674 0.966184 -0.178838 0.108 Uiso 0.5 1 calc GR . . M 1
H22C H 0.279708 0.965487 -0.238626 0.108 Uiso 0.5 1 calc GR . . M 1
N6B N 0.3171(10) 0.9223(8) -0.1179(4) 0.0331(11) Uani 0.5 1 d . . . N 2
C24 C 0.4609(12) 0.8078(9) -0.1066(5) 0.0301(13) Uani 0.5 1 d . . . N 2
K2 K 1.000000 0.500000 0.500000 0.0232(2) Uani 1 2 d S T P K .
K1 K 0.500000 0.500000 0.500000 0.0246(2) Uani 1 2 d S T P K .
N6A N 0.3970(10) 0.8522(8) -0.1474(4) 0.0331(11) Uani 0.5 1 d . . . N 1
C26 C 0.4020(12) 0.8615(9) -0.0821(5) 0.0301(13) Uani 0.5 1 d . . . N 1
N4B N 0.7900(10) 0.4564(8) 0.6932(4) 0.0320(11) Uani 0.5 1 d . . . K 1
C17B C 0.8421(11) 0.3721(9) 0.6529(4) 0.0245(11) Uani 0.5 1 d . . . K 1
N5B N 0.552(3) 0.9044(18) 0.4242(10) 0.057(4) Uani 0.3 1 d D U . K 2
C21B C 0.398(2) 0.8526(16) 0.4204(8) 0.058(4) Uani 0.5 1 d . U . K 2
H21A H 0.347981 0.832528 0.465801 0.087 Uiso 0.5 1 calc GR . . K 2
H21B H 0.436689 0.768346 0.400921 0.087 Uiso 0.5 1 calc GR . . K 2
H21C H 0.302649 0.920859 0.391795 0.087 Uiso 0.5 1 calc GR . . K 2
C19A C 0.7088(19) 1.0531(10) 0.4204(6) 0.052(3) Uani 0.5 1 d . U . K 1
H19A H 0.608038 1.082930 0.387260 0.077 Uiso 0.5 1 calc GR . . K 1
H19B H 0.826343 1.055714 0.397423 0.077 Uiso 0.5 1 calc GR . . K 1
H19C H 0.684381 1.114422 0.453911 0.077 Uiso 0.5 1 calc GR . . K 1
C18B C 0.872(2) 0.8824(17) 0.4672(10) 0.077(5) Uani 0.5 1 d . U . K 2
H18A H 0.845080 0.946470 0.499421 0.115 Uiso 0.5 1 calc GR . . K 2
H18B H 0.900154 0.929693 0.422921 0.115 Uiso 0.5 1 calc GR . . K 2
H18C H 0.978702 0.805349 0.483108 0.115 Uiso 0.5 1 calc GR . . K 2
C19B C 0.583(3) 1.0516(12) 0.3913(7) 0.082(5) Uani 0.5 1 d . . . K 2
H19D H 0.494691 1.094896 0.354442 0.123 Uiso 0.5 1 calc GR . . K 2
H19E H 0.709952 1.038946 0.373693 0.123 Uiso 0.5 1 calc GR . . K 2
H19F H 0.563940 1.110334 0.425905 0.123 Uiso 0.5 1 calc GR . . K 2
N5A N 0.7196(10) 0.9172(6) 0.4533(4) 0.059(2) Uani 0.7 1 d . U . K 1
C20A C 0.6169(13) 0.8300(8) 0.4480(4) 0.0258(16) Uani 0.65 1 d . U . K 1
C20B C 0.694(3) 0.8259(17) 0.4610(10) 0.051(5) Uani 0.35 1 d D U . K 2
C21A C 0.469(2) 0.8834(17) 0.3987(7) 0.052(4) Uani 0.5 1 d . U . K 1
H21D H 0.521229 0.906140 0.353951 0.077 Uiso 0.5 1 calc GR . . K 1
H21E H 0.382887 0.966106 0.411088 0.077 Uiso 0.5 1 calc GR . . K 1
H21F H 0.401917 0.814136 0.397700 0.077 Uiso 0.5 1 calc GR . . K 1
C18A C 0.8800(16) 0.8607(12) 0.5080(6) 0.038(2) Uani 0.5 1 d . . . K 1
H18D H 0.998072 0.825574 0.485581 0.057 Uiso 0.5 1 calc GR . . K 1
H18E H 0.852174 0.786588 0.540991 0.057 Uiso 0.5 1 calc GR . . K 1
H18F H 0.888767 0.934956 0.531052 0.057 Uiso 0.5 1 calc GR . . K 1


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Pt1 N1 2.070(3) . ?
Pt1 C12 1.942(4) . ?
Pt1 C1 2.028(4) . ?
Pt1 C13 2.027(4) . ?
Cl2 C9 1.729(3) . ?
Cl1 C4 1.739(4) . ?
O1 C17A 1.294(9) . ?
O1 K2 2.652(3) . ?
O1 K1 2.742(3) . ?
O1 C17B 1.257(8) . ?
O2 K2 2.769(3) . ?
O2 K1 2.767(3) . ?
O2 C20A 1.272(10) . ?
O2 C20B 1.247(16) . ?
N1 C11 1.342(4) . ?
N1 C7 1.367(4) . ?
O3 C24 1.286(9) . ?
O3 C26 1.251(9) . ?
C12 N3 1.162(5) . ?
C1 C6 1.411(5) . ?
C1 C2 1.410(5) . ?
N3 K2 2.850(3) . ?
N3 K1 2.855(3) . ?
C11 C10 1.380(5) . ?
C8 C7 1.397(5) . ?
C8 C9 1.378(5) . ?
C6 C7 1.475(4) . ?
C6 C5 1.398(5) . ?
C13 N2 1.152(5) . ?
C5 C4 1.384(5) . ?
C10 C9 1.394(5) . ?
C4 C3 1.387(6) . ?
C2 C3 1.394(5) . ?
C16 C17A 1.488(10) . ?
C16 N4B 1.520(9) . ?
C14 N4A 1.492(9) . ?
C14 N4B 1.553(8) . ?
C25 C24 1.551(10) . ?
C25 N6A 1.452(9) . ?
C15 N4A 1.466(10) . ?
C15 C17B 1.589(10) . ?
C23 N6B 1.444(9) . ?
C23 C26 1.583(10) . ?
N4A C17A 1.367(10) . ?
C17A K2 3.423(7) . ?
C22 N6B 1.512(8) . ?
C22 N6A 1.542(9) . ?
N6B C24 1.356(12) . ?
K2 C17B 3.413(7) . ?
K2 C17B 3.413(7) 2_766 ?
K2 C20B 3.488(17) . ?
K2 C20B 3.488(17) 2_766 ?
N6A C26 1.336(12) . ?
N4B C17B 1.263(12) . ?
N5B C21B 1.41(2) . ?
N5B C19B 1.62(2) . ?
N5B C20B 1.314(16) . ?
C19A N5A 1.420(11) . ?
C18B C20B 1.61(3) . ?
N5A C20A 1.353(11) . ?
N5A C18A 1.586(14) . ?
C20A C21A 1.449(15) . ?

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
C12 Pt1 N1 174.49(12) . . ?
C12 Pt1 C1 94.24(14) . . ?
C12 Pt1 C13 91.02(14) . . ?
C1 Pt1 N1 80.26(12) . . ?
C13 Pt1 N1 94.49(12) . . ?
C13 Pt1 C1 174.75(13) . . ?
C17A O1 K2 115.9(4) . . ?
C17A O1 K1 122.7(4) . . ?
K2 O1 K1 88.03(8) . . ?
C17B O1 K2 117.1(4) . . ?
C17B O1 K1 153.6(4) . . ?
K1 O2 K2 85.23(8) . . ?
C20A O2 K2 138.8(5) . . ?
C20A O2 K1 128.6(4) . . ?
C20B O2 K2 115.2(9) . . ?
C20B O2 K1 157.8(10) . . ?
C11 N1 Pt1 125.2(2) . . ?
C11 N1 C7 119.4(3) . . ?
C7 N1 Pt1 115.4(2) . . ?
N3 C12 Pt1 179.1(3) . . ?
C6 C1 Pt1 114.4(2) . . ?
C2 C1 Pt1 129.0(3) . . ?
C2 C1 C6 116.6(3) . . ?
C12 N3 K2 131.5(3) . . ?
C12 N3 K1 138.5(3) . . ?
K2 N3 K1 82.15(8) . . ?
N1 C11 C10 122.8(3) . . ?
C9 C8 C7 118.3(3) . . ?
C1 C6 C7 115.5(3) . . ?
C5 C6 C1 123.1(3) . . ?
C5 C6 C7 121.5(3) . . ?
N2 C13 Pt1 176.3(4) . . ?
N1 C7 C8 120.8(3) . . ?
N1 C7 C6 114.1(3) . . ?
C8 C7 C6 125.1(3) . . ?
C4 C5 C6 117.3(3) . . ?
C11 C10 C9 117.5(3) . . ?
C5 C4 Cl1 118.9(3) . . ?
C5 C4 C3 122.6(3) . . ?
C3 C4 Cl1 118.4(3) . . ?
C8 C9 Cl2 119.8(3) . . ?
C8 C9 C10 121.1(3) . . ?
C10 C9 Cl2 119.1(3) . . ?
C3 C2 C1 121.6(3) . . ?
C4 C3 C2 118.8(3) . . ?
C15 N4A C14 125.9(6) . . ?
C17A N4A C14 115.6(7) . . ?
C17A N4A C15 118.4(7) . . ?
O1 C17A C16 127.6(6) . . ?
O1 C17A N4A 114.3(7) . . ?
O1 C17A K2 44.2(3) . . ?
C16 C17A K2 107.6(4) . . ?
N4A C17A C16 118.0(7) . . ?
N4A C17A K2 117.0(5) . . ?
C23 N6B C22 128.4(6) . . ?
C24 N6B C23 116.0(6) . . ?
C24 N6B C22 115.4(7) . . ?
O3 C24 C25 127.9(7) . . ?
O3 C24 N6B 115.4(8) . . ?
N6B C24 C25 116.8(7) . . ?
O1 K2 O1 180.00(9) . 2_766 ?
O1 K2 O2 102.31(9) . 2_766 ?
O1 K2 O2 77.69(9) . . ?
O1 K2 O2 102.31(9) 2_766 . ?
O1 K2 O2 77.70(9) 2_766 2_766 ?
O1 K2 N3 96.53(9) . 2_766 ?
O1 K2 N3 96.53(9) 2_766 . ?
O1 K2 N3 83.47(9) 2_766 2_766 ?
O1 K2 N3 83.47(9) . . ?
O1 K2 C17A 160.12(15) 2_766 . ?
O1 K2 C17A 160.12(15) . 2_766 ?
O1 K2 C17A 19.88(15) 2_766 2_766 ?
O1 K2 C17A 19.88(15) . . ?
O1 K2 C17B 19.14(14) . . ?
O1 K2 C17B 19.14(14) 2_766 2_766 ?
O1 K2 C17B 160.86(14) 2_766 . ?
O1 K2 C17B 160.86(14) . 2_766 ?
O1 K2 C20B 86.3(3) . 2_766 ?
O1 K2 C20B 93.7(3) 2_766 2_766 ?
O1 K2 C20B 93.7(3) . . ?
O1 K2 C20B 86.3(3) 2_766 . ?
O2 K2 O2 180.0 . 2_766 ?
O2 K2 N3 102.06(9) . 2_766 ?
O2 K2 N3 77.94(9) . . ?
O2 K2 N3 102.06(9) 2_766 . ?
O2 K2 N3 77.94(9) 2_766 2_766 ?
O2 K2 C17A 103.65(16) . 2_766 ?
O2 K2 C17A 76.35(16) 2_766 2_766 ?
O2 K2 C17A 76.35(16) . . ?
O2 K2 C17A 103.65(16) 2_766 . ?
O2 K2 C17B 89.78(16) . 2_766 ?
O2 K2 C17B 90.22(16) . . ?
O2 K2 C17B 89.78(16) 2_766 . ?
O2 K2 C17B 90.22(16) 2_766 2_766 ?
O2 K2 C20B 18.9(3) . . ?
O2 K2 C20B 161.1(3) . 2_766 ?
O2 K2 C20B 18.9(3) 2_766 2_766 ?
O2 K2 C20B 161.1(3) 2_766 . ?
N3 K2 N3 180.0 2_766 . ?
N3 K2 C17A 102.48(14) . . ?
N3 K2 C17A 77.52(14) . 2_766 ?
N3 K2 C17A 102.48(14) 2_766 2_766 ?
N3 K2 C17A 77.53(14) 2_766 . ?
N3 K2 C17B 79.75(14) . 2_766 ?
N3 K2 C17B 100.25(14) . . ?
N3 K2 C17B 100.25(14) 2_766 2_766 ?
N3 K2 C17B 79.75(14) 2_766 . ?
N3 K2 C20B 89.5(4) 2_766 2_766 ?
N3 K2 C20B 90.5(4) . 2_766 ?
N3 K2 C20B 89.5(4) . . ?
N3 K2 C20B 90.5(4) 2_766 . ?
C17A K2 C20B 91.9(3) 2_766 . ?
C17A K2 C20B 88.1(3) . . ?
C17B K2 C17A 15.00(18) 2_766 2_766 ?
C17B K2 C17A 165.00(18) . 2_766 ?
C17B K2 C17B 180.0 . 2_766 ?
C17B K2 C20B 102.9(3) 2_766 2_766 ?
C17B K2 C20B 77.1(3) . 2_766 ?
C20B K2 C20B 180.0 2_766 . ?
O1 K1 O1 180.0 . 2_666 ?
O1 K1 O2 76.27(9) . . ?
O1 K1 O2 76.27(9) 2_666 2_666 ?
O1 K1 O2 103.73(9) 2_666 . ?
O1 K1 O2 103.73(9) . 2_666 ?
O1 K1 N3 81.82(9) . . ?
O1 K1 N3 98.18(9) 2_666 . ?
O1 K1 N3 81.82(9) 2_666 2_666 ?
O1 K1 N3 98.18(9) . 2_666 ?
O1 K1 K2 134.99(6) . 1_455 ?
O1 K1 K2 134.99(6) 2_666 . ?
O1 K1 K2 45.01(6) . . ?
O1 K1 K2 45.01(6) 2_666 1_455 ?
O2 K1 O2 180.0 . 2_666 ?
O2 K1 N3 102.11(10) . 2_666 ?
O2 K1 N3 102.11(10) 2_666 . ?
O2 K1 N3 77.89(10) . . ?
O2 K1 N3 77.89(10) 2_666 2_666 ?
O2 K1 K2 47.41(6) 2_666 1_455 ?
O2 K1 K2 47.41(6) . . ?
O2 K1 K2 132.59(6) . 1_455 ?
O2 K1 K2 132.59(6) 2_666 . ?
N3 K1 N3 180.00(15) 2_666 . ?
N3 K1 K2 48.87(6) 2_666 1_455 ?
N3 K1 K2 131.13(6) . 1_455 ?
N3 K1 K2 131.13(6) 2_666 . ?
N3 K1 K2 48.87(6) . . ?
K2 K1 K2 180.0 1_455 . ?
C25 N6A C22 129.0(6) . . ?
C26 N6A C25 115.2(7) . . ?
C26 N6A C22 115.4(7) . . ?
O3 C26 C23 127.3(7) . . ?
O3 C26 N6A 117.9(8) . . ?
N6A C26 C23 114.7(7) . . ?
C16 N4B C14 124.1(6) . . ?
C17B N4B C16 115.8(6) . . ?
C17B N4B C14 120.0(7) . . ?
O1 C17B C15 131.7(7) . . ?
O1 C17B K2 43.8(3) . . ?
O1 C17B N4B 116.5(8) . . ?
C15 C17B K2 113.7(4) . . ?
N4B C17B C15 111.7(6) . . ?
N4B C17B K2 115.5(5) . . ?
C21B N5B C19B 129.8(17) . . ?
C20B N5B C21B 117.7(16) . . ?
C20B N5B C19B 112.5(16) . . ?
C19A N5A C18A 112.7(9) . . ?
C20A N5A C19A 132.2(10) . . ?
C20A N5A C18A 115.0(8) . . ?
O2 C20A N5A 116.4(8) . . ?
O2 C20A C21A 128.5(9) . . ?
N5A C20A C21A 114.6(11) . . ?
O2 C20B K2 45.9(7) . . ?
O2 C20B N5B 111.1(18) . . ?
O2 C20B C18B 129.4(16) . . ?
N5B C20B K2 146.5(15) . . ?
N5B C20B C18B 119.1(15) . . ?
C18B C20B K2 85.7(9) . . ?

_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_1-DMF
_database_code_depnum_ccdc_archive 'CCDC 2084818'
loop_
_audit_author_name
_audit_author_address
'Yasuhiro Shigeta'
;Kanazawa University
Japan
;
_audit_update_record             
;
2021-05-20 deposited with the CCDC.	2021-09-29 downloaded from the CCDC.
;
_audit_creation_date             2021-02-24
_audit_creation_method           
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_shelx_SHELXL_version_number     2018/3
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         '0.13(C122 H90 Cl16 K8 N30 O6 Pt8)'
_chemical_formula_sum            'C15.25 H11.25 Cl2 K N3.75 O0.75 Pt'
_chemical_formula_weight         564.12
_chemical_absolute_configuration ?
_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 0.0181 0.0091 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.3639 0.7018 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
K K 0.3868 1.0657 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Pt Pt -4.5932 6.9264 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_space_group_crystal_system      monoclinic
_space_group_IT_number           9
_space_group_name_H-M_alt        'C 1 c 1'
_space_group_name_Hall           'C -2yc'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'x, -y, z+1/2'
'x+1/2, y+1/2, z'
'x+1/2, -y+1/2, z+1/2'

_cell_length_a                   41.7895(9)
_cell_length_b                   8.5044(2)
_cell_length_c                   21.2104(4)
_cell_angle_alpha                90
_cell_angle_beta                 107.8370(10)
_cell_angle_gamma                90
_cell_volume                     7175.7(3)
_cell_formula_units_Z            16
_cell_measurement_reflns_used    9963
_cell_measurement_temperature    90
_cell_measurement_theta_max      72.43
_cell_measurement_theta_min      4.38
_shelx_estimated_absorpt_T_max   ?
_shelx_estimated_absorpt_T_min   ?
_exptl_absorpt_coefficient_mu    19.518
_exptl_absorpt_correction_T_max  0.7536
_exptl_absorpt_correction_T_min  0.3936
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
'SADABS-2016/2 (Bruker,2016/2) was used for absorption correction. wR2(int) was 0.1306 before and 0.0642 after correction. The Ratio of minimum to maximum transmission is 0.5223. The λ/2 correction factor is Not present.'
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            orange
_exptl_crystal_colour_lustre     .
_exptl_crystal_colour_modifier   .
_exptl_crystal_colour_primary    orange
_exptl_crystal_density_diffrn    2.089
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       needle
_exptl_crystal_F_000             4256
_exptl_crystal_size_max          0.5
_exptl_crystal_size_mid          0.02
_exptl_crystal_size_min          0.01
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0470
_diffrn_reflns_av_unetI/netI     0.0545
_diffrn_reflns_Laue_measured_fraction_full 0.992
_diffrn_reflns_Laue_measured_fraction_max 0.989
_diffrn_reflns_limit_h_max       51
_diffrn_reflns_limit_h_min       -51
_diffrn_reflns_limit_k_max       10
_diffrn_reflns_limit_k_min       -10
_diffrn_reflns_limit_l_max       23
_diffrn_reflns_limit_l_min       -26
_diffrn_reflns_number            27578
_diffrn_reflns_point_group_measured_fraction_full 0.807
_diffrn_reflns_point_group_measured_fraction_max 0.796
_diffrn_reflns_theta_full        67.679
_diffrn_reflns_theta_max         72.435
_diffrn_reflns_theta_min         2.221
_diffrn_ambient_temperature      90
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.992
_diffrn_measured_fraction_theta_max 0.989
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54178
_diffrn_source                   ?
_diffrn_standards_number         0
_reflns_Friedel_coverage         0.608
_reflns_Friedel_fraction_full    0.621
_reflns_Friedel_fraction_max     0.602
_reflns_number_gt                10471
_reflns_number_total             11342
_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       'SAINT V8.40A (?, 2016)'
_computing_data_collection       ?
_computing_data_reduction        'SAINT V8.40A (?, 2016)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2015)'
_computing_structure_solution    'ShelXT (Sheldrick, 2015)'
_refine_diff_density_max         0.811
_refine_diff_density_min         -0.849
_refine_diff_density_rms         0.173
_refine_ls_abs_structure_details 
;
 Flack x determined using 3576 quotients [(I+)-(I-)]/[(I+)+(I-)]
 (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259).
;
_refine_ls_abs_structure_Flack   0.419(11)
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.064
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     862
_refine_ls_number_reflns         11342
_refine_ls_number_restraints     27
_refine_ls_R_factor_all          0.0394
_refine_ls_R_factor_gt           0.0335
_refine_ls_restrained_S_all      1.062
_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)+(0.0372P)²+37.9969P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0793
_refine_ls_wR_factor_ref         0.0850
_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. Uiso/Uaniso restraints and constraints
Uanis(C12) \\sim Ueq: with sigma of 0.1 and sigma for terminal atoms of 0.2
Uanis(C39) \\sim Ueq: with sigma of 0.1 and sigma for terminal atoms of 0.2
3. Rigid body (RIGU) restrains
 C12, Pt1
 with sigma for 1-2 distances of 0.004 and sigma for 1-3 distances of 0.004
 N3, C12
 with sigma for 1-2 distances of 0.004 and sigma for 1-3 distances of 0.004
 C36, C35
 with sigma for 1-2 distances of 0.004 and sigma for 1-3 distances of 0.004
 C35, Cl6
 with sigma for 1-2 distances of 0.004 and sigma for 1-3 distances of 0.004
 C35, C34
 with sigma for 1-2 distances of 0.004 and sigma for 1-3 distances of 0.004
4.a Ternary CH refined with riding coordinates:
 C56(H56), C53(H53), C59(H59)
4.b Aromatic/amide H refined with riding coordinates:
 C29(H29), C24(H24), C10(H10), C37(H37), C42(H42), C49(H49), C5(H5), C34(H34),
 C3(H3), C31(H31), C41(H41), C47(H47), C36(H36), C21(H21), C2(H2), C8(H8),
 C18(H18), C11(H11), C16(H16), C15(H15), C28(H28), C44(H44), C23(H23), C50(H50)
4.c Idealised Me refined as rotating group:
 C58(H58a,H58b,H58c), C54(H54a,H54b,H54c), C57(H57a,H57b,H57c), C55(H55a,H55b,
 H55c), C61(H61a,H61b,H61c), C60(H60a,H60b,H60c)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     dual
_atom_sites_solution_secondary   ?
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt3 Pt 0.58972(2) 1.09222(6) 0.37764(2) 0.01284(12) Uani 1 1 d . . . . .
Pt4 Pt 0.60164(2) 0.84703(6) 0.50772(2) 0.01421(12) Uani 1 1 d . . . . .
Pt1 Pt 0.41454(2) 0.85176(6) 0.54589(2) 0.01330(12) Uani 1 1 d . U . . .
Pt2 Pt 0.39805(2) 0.11587(6) 0.41472(2) 0.01467(12) Uani 1 1 d . . . . .
K005 K 0.48477(7) 0.2138(3) 0.78660(13) 0.0169(5) Uani 1 1 d . . . . .
K006 K 0.51345(7) 0.1960(3) 0.63291(13) 0.0171(5) Uani 1 1 d . . . . .
K007 K 0.49961(7) 0.9791(3) 0.46034(15) 0.0172(5) Uani 1 1 d . . . . .
K008 K 0.50280(7) 0.4761(3) 0.46301(15) 0.0166(5) Uani 1 1 d . . . . .
Cl6 Cl 0.69063(9) 1.4953(4) 0.62055(18) 0.0325(8) Uani 1 1 d . U . . .
Cl2 Cl 0.31352(10) 0.4589(5) 0.30076(19) 0.0370(9) Uani 1 1 d . . . . .
Cl3 Cl 0.24638(9) -0.1405(5) 0.2600(2) 0.0338(9) Uani 1 1 d . . . . .
Cl4 Cl 0.29648(9) 0.4338(5) 0.5588(2) 0.0369(9) Uani 1 1 d . . . . .
Cl8 Cl 0.70285(9) 0.5193(5) 0.36395(19) 0.0358(9) Uani 1 1 d . . . . .
Cl7 Cl 0.75388(9) 1.1025(6) 0.6593(2) 0.0453(12) Uani 1 1 d . . . . .
Cl5 Cl 0.74299(9) 0.9833(5) 0.3648(2) 0.0371(9) Uani 1 1 d . . . . .
Cl1 Cl 0.26115(9) 0.9703(6) 0.5554(2) 0.0424(10) Uani 1 1 d . . . . .
O2 O 0.5457(2) 0.4440(10) 0.5894(5) 0.024(2) Uani 1 1 d . . . . .
N12 N 0.5591(3) 1.0253(14) 0.5810(6) 0.021(2) Uani 1 1 d . . . . .
N2 N 0.4829(3) 0.7305(14) 0.5252(6) 0.024(3) Uani 1 1 d . . . . .
N4 N 0.3685(3) 0.2267(14) 0.4615(5) 0.019(2) Uani 1 1 d . . . . .
N14 N 0.5913(3) 0.5451(15) 0.6667(5) 0.025(3) Uani 1 1 d . . . . .
C32 C 0.6622(4) 1.1228(16) 0.4127(8) 0.017(3) Uani 1 1 d . . . . .
C14 C 0.3524(3) 0.0342(17) 0.3570(6) 0.019(3) Uani 1 1 d . . . . .
O3 O 0.4812(2) 0.4048(11) 0.6872(5) 0.026(2) Uani 1 1 d . . . . .
N11 N 0.5326(2) 0.7207(12) 0.4119(5) 0.014(2) Uani 1 1 d . . . . .
N5 N 0.4683(3) 0.2437(12) 0.5066(5) 0.017(2) Uani 1 1 d . . . . .
C29 C 0.6760(4) 0.9375(18) 0.3173(7) 0.027(3) Uani 1 1 d . . . . .
H29 H 0.680825 0.874117 0.285636 0.032 Uiso 1 1 calc R . . . .
C24 C 0.3791(4) 0.3215(18) 0.5144(7) 0.024(3) Uani 1 1 d . . . . .
H24 H 0.402179 0.336895 0.532303 0.028 Uiso 1 1 calc R . . . .
C10 C 0.3752(4) 0.5516(17) 0.3731(7) 0.024(3) Uani 1 1 d . . . . .
H10 H 0.383405 0.492788 0.344481 0.028 Uiso 1 1 calc R . . . .
N1 N 0.3850(3) 0.7191(14) 0.4668(5) 0.021(2) Uani 1 1 d . . . . .
N7 N 0.6190(3) 1.2285(14) 0.4529(5) 0.021(2) Uani 1 1 d . . . . .
O1 O 0.4602(3) 0.5261(11) 0.3392(5) 0.029(2) Uani 1 1 d . . . . .
C37 C 0.6079(3) 1.3229(15) 0.4943(7) 0.018(3) Uani 1 1 d . . . . .
H37 H 0.584807 1.330271 0.486871 0.021 Uiso 1 1 calc R . . . .
N10 N 0.6311(3) 0.7353(13) 0.4599(5) 0.018(2) Uani 1 1 d . . . . .
C20 C 0.3347(3) 0.1897(16) 0.4383(7) 0.020(3) Uani 1 1 d . . . . .
C39 C 0.5460(3) 1.1649(13) 0.3884(6) 0.011(2) Uani 1 1 d . U . . .
C42 C 0.6889(4) 1.074(2) 0.6501(8) 0.032(4) Uani 1 1 d . . . . .
H42 H 0.693607 1.138102 0.687419 0.039 Uiso 1 1 calc R . . . .
C49 C 0.6421(3) 0.5636(15) 0.3783(7) 0.018(3) Uani 1 1 d . . . . .
H49 H 0.634440 0.490866 0.344250 0.022 Uiso 1 1 calc R . . . .
C51 C 0.5764(3) 0.9616(15) 0.5562(7) 0.018(3) Uani 1 1 d . . . . .
C26 C 0.4423(3) 0.2013(14) 0.4740(6) 0.014(2) Uani 1 1 d . . . . .
C7 C 0.3511(3) 0.7295(14) 0.4579(7) 0.015(3) Uani 1 1 d . . . . .
N15 N 0.5143(3) 0.6230(14) 0.7177(6) 0.029(3) Uani 1 1 d . . . . .
C38 C 0.5667(3) 0.9487(15) 0.3061(7) 0.019(3) Uani 1 1 d . . . . .
C30 C 0.7013(4) 1.0167(18) 0.3647(7) 0.028(3) Uani 1 1 d . . . . .
C33 C 0.6529(3) 1.2285(15) 0.4611(6) 0.015(3) Uani 1 1 d . . . . .
N9 N 0.5523(3) 0.8624(13) 0.2643(6) 0.021(2) Uani 1 1 d . . . . .
C45 C 0.6743(4) 0.8749(18) 0.5416(7) 0.019(3) Uani 1 1 d . . . . .
C5 C 0.3086(4) 0.8420(18) 0.5076(8) 0.026(3) Uani 1 1 d . . . . .
H5 H 0.290928 0.790898 0.476938 0.031 Uiso 1 1 calc R . . . .
C52 C 0.5575(3) 0.7644(16) 0.4465(7) 0.021(3) Uani 1 1 d . . . . .
C34 C 0.6749(4) 1.3076(18) 0.5123(7) 0.024(3) Uani 1 1 d . U . . .
H34 H 0.697843 1.301480 0.518046 0.028 Uiso 1 1 calc R . . . .
C40 C 0.6476(3) 0.9242(17) 0.5636(6) 0.019(3) Uani 1 1 d . . . . .
N6 N 0.4412(3) -0.0602(15) 0.3398(6) 0.025(3) Uani 1 1 d . . . . .
N8 N 0.5218(3) 1.2139(14) 0.3966(6) 0.023(3) Uani 1 1 d . . . . .
C19 C 0.3260(4) 0.0816(18) 0.3800(9) 0.026(4) Uani 1 1 d . . . . .
C22 C 0.3247(4) 0.3522(15) 0.5204(8) 0.022(3) Uani 1 1 d . . . . .
C9 C 0.3417(4) 0.5576(19) 0.3662(7) 0.026(3) Uani 1 1 d . . . . .
N13 N 0.4173(3) 0.4308(16) 0.2540(6) 0.029(3) Uani 1 1 d . . . . .
C48 C 0.6761(4) 0.6050(18) 0.4015(8) 0.028(4) Uani 1 1 d . . . . .
C58 C 0.6045(4) 0.3969(18) 0.6940(7) 0.030(4) Uani 1 1 d . . . . .
H58A H 0.601686 0.385237 0.737018 0.045 Uiso 1 1 calc GR . . . .
H58B H 0.627938 0.391411 0.697794 0.045 Uiso 1 1 calc GR . . . .
H58C H 0.592649 0.314062 0.665526 0.045 Uiso 1 1 calc GR . . . .
C6 C 0.3424(4) 0.8218(19) 0.5075(8) 0.025(3) Uani 1 1 d . . . . .
C3 C 0.3286(4) 1.0100(17) 0.6041(7) 0.026(3) Uani 1 1 d . . . . .
H3 H 0.323926 1.067422 0.637574 0.032 Uiso 1 1 calc R . . . .
C31 C 0.6957(4) 1.1104(17) 0.4125(8) 0.025(3) Uani 1 1 d . . . . .
H31 H 0.713120 1.163126 0.443306 0.030 Uiso 1 1 calc R . . . .
C41 C 0.6557(4) 1.0204(19) 0.6183(7) 0.026(3) Uani 1 1 d . . . . .
H41 H 0.638593 1.051583 0.635219 0.031 Uiso 1 1 calc R . . . .
C47 C 0.6873(3) 0.7052(17) 0.4550(6) 0.020(3) Uani 1 1 d . . . . .
H47 H 0.710043 0.729452 0.470960 0.024 Uiso 1 1 calc R . . . .
C36 C 0.6285(4) 1.4068(19) 0.5456(7) 0.026(3) Uani 1 1 d . U . . .
H36 H 0.620012 1.468406 0.572981 0.031 Uiso 1 1 calc R . . . .
C21 C 0.3122(3) 0.2548(16) 0.4669(7) 0.025(3) Uani 1 1 d . . . . .
H21 H 0.289352 0.233425 0.450419 0.030 Uiso 1 1 calc R . . . .
C2 C 0.3614(3) 0.9937(17) 0.6034(7) 0.024(3) Uani 1 1 d . . . . .
H2 H 0.378609 1.045879 0.634773 0.028 Uiso 1 1 calc R . . . .
C56 C 0.5634(3) 0.5565(16) 0.6167(7) 0.023(3) Uani 1 1 d . . . . .
H56 H 0.548712 0.601570 0.640159 0.028 Uiso 1 1 calc R . . . .
C8 C 0.3283(4) 0.6444(17) 0.4061(8) 0.026(3) Uani 1 1 d . . . . .
H8 H 0.305257 0.647295 0.399578 0.031 Uiso 1 1 calc R . . . .
C54 C 0.4051(4) 0.5854(15) 0.2295(7) 0.027(3) Uani 1 1 d . . . . .
H54A H 0.413789 0.661848 0.263761 0.040 Uiso 1 1 calc GR . . . .
H54B H 0.381002 0.586131 0.216411 0.040 Uiso 1 1 calc GR . . . .
H54C H 0.412468 0.610649 0.192004 0.040 Uiso 1 1 calc GR . . . .
C25 C 0.4232(3) 0.0083(16) 0.3654(6) 0.020(3) Uani 1 1 d . . . . .
C18 C 0.2928(4) 0.032(2) 0.3502(7) 0.031(4) Uani 1 1 d . . . . .
H18 H 0.275416 0.063910 0.366056 0.037 Uiso 1 1 calc R . . . .
C17 C 0.2874(3) -0.0668(17) 0.2955(7) 0.026(3) Uani 1 1 d . . . . .
N3 N 0.4546(3) 1.0506(16) 0.6654(6) 0.027(3) Uani 1 1 d . U . . .
C53 C 0.4442(3) 0.4154(16) 0.3077(7) 0.021(3) Uani 1 1 d . . . . .
H53 H 0.460328 0.386969 0.284378 0.026 Uiso 1 1 calc R . . . .
C11 C 0.3967(4) 0.6382(15) 0.4254(7) 0.018(3) Uani 1 1 d . . . . .
H11 H 0.419706 0.638658 0.430983 0.021 Uiso 1 1 calc R . . . .
C27 C 0.6357(3) 1.0487(18) 0.3671(6) 0.018(3) Uani 1 1 d . . . . .
C16 C 0.3125(4) -0.110(2) 0.2718(8) 0.033(4) Uani 1 1 d . . . . .
H16 H 0.307502 -0.172591 0.234086 0.040 Uiso 1 1 calc R . . . .
C15 C 0.3452(4) -0.0645(18) 0.3016(7) 0.025(3) Uani 1 1 d . . . . .
H15 H 0.362216 -0.098766 0.285248 0.030 Uiso 1 1 calc R . . . .
C57 C 0.6100(4) 0.6846(18) 0.6967(8) 0.037(4) Uani 1 1 d . . . . .
H57A H 0.613217 0.683947 0.743483 0.055 Uiso 1 1 calc GR . . . .
H57B H 0.597701 0.776907 0.677315 0.055 Uiso 1 1 calc GR . . . .
H57C H 0.631531 0.684848 0.689092 0.055 Uiso 1 1 calc GR . . . .
C59 C 0.4873(3) 0.5475(17) 0.6806(7) 0.024(3) Uani 1 1 d . . . . .
H59 H 0.470504 0.608235 0.646993 0.028 Uiso 1 1 calc R . . . .
C13 C 0.4580(4) 0.7827(17) 0.5330(6) 0.022(3) Uani 1 1 d . . . . .
C4 C 0.3031(3) 0.9421(18) 0.5559(8) 0.026(3) Uani 1 1 d . . . . .
C35 C 0.6638(4) 1.3957(17) 0.5555(7) 0.024(3) Uani 1 1 d . U . . .
C1 C 0.3689(3) 0.8973(14) 0.5549(6) 0.016(3) Uani 1 1 d . . . . .
C43 C 0.7138(4) 1.0300(18) 0.6242(7) 0.026(3) Uani 1 1 d . . . . .
C12 C 0.4396(3) 0.9819(17) 0.6216(6) 0.022(3) Uani 1 1 d . U . . .
C28 C 0.6439(3) 0.9562(16) 0.3190(7) 0.020(3) Uani 1 1 d . . . . .
H28 H 0.626567 0.905748 0.287053 0.024 Uiso 1 1 calc R . . . .
C55 C 0.4006(4) 0.299(2) 0.2142(9) 0.043(4) Uani 1 1 d . . . . .
H55A H 0.377250 0.300194 0.211291 0.064 Uiso 1 1 calc GR . . . .
H55B H 0.410704 0.203030 0.234335 0.064 Uiso 1 1 calc GR . . . .
H55C H 0.402838 0.307851 0.170607 0.064 Uiso 1 1 calc GR . . . .
C44 C 0.7070(4) 0.9203(19) 0.5714(7) 0.027(3) Uani 1 1 d . . . . .
H44 H 0.724359 0.879951 0.557201 0.032 Uiso 1 1 calc R . . . .
C46 C 0.6656(3) 0.7698(19) 0.4849(6) 0.025(3) Uani 1 1 d . . . . .
C23 C 0.3583(4) 0.3980(18) 0.5441(8) 0.028(3) Uani 1 1 d . . . . .
H23 H 0.365998 0.473296 0.577075 0.034 Uiso 1 1 calc R . . . .
C61 C 0.5381(4) 0.5424(15) 0.7733(7) 0.024(3) Uani 1 1 d . . . . .
H61A H 0.528033 0.527559 0.807997 0.036 Uiso 1 1 calc GR . . . .
H61B H 0.558074 0.604587 0.789598 0.036 Uiso 1 1 calc GR . . . .
H61C H 0.543690 0.441951 0.758946 0.036 Uiso 1 1 calc GR . . . .
C50 C 0.6198(4) 0.6344(17) 0.4076(7) 0.023(3) Uani 1 1 d . . . . .
H50 H 0.596951 0.612284 0.391214 0.028 Uiso 1 1 calc R . . . .
C60 C 0.5196(4) 0.7910(18) 0.7089(8) 0.039(4) Uani 1 1 d . . . . .
H60A H 0.504579 0.825385 0.667177 0.058 Uiso 1 1 calc GR . . . .
H60B H 0.542390 0.808246 0.709655 0.058 Uiso 1 1 calc GR . . . .
H60C H 0.515186 0.849334 0.744111 0.058 Uiso 1 1 calc GR . . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Pt3 N7 2.047(11) . ?
Pt3 C39 2.006(12) . ?
Pt3 C38 1.955(14) . ?
Pt3 C27 2.035(12) . ?
Pt4 N10 2.053(11) . ?
Pt4 C51 1.947(14) . ?
Pt4 C52 2.028(15) . ?
Pt4 C40 2.034(13) . ?
Pt1 N1 2.084(11) . ?
Pt1 C13 2.008(15) . ?
Pt1 C1 2.012(13) . ?
Pt1 C12 1.967(14) . ?
Pt2 N4 2.039(11) . ?
Pt2 C14 2.048(12) . ?
Pt2 C26 2.025(12) . ?
Pt2 C25 1.925(15) . ?
K005 K006 3.805(3) . ?
K005 K007 3.906(4) 2_565 ?
K005 K008 4.449(4) 2_565 ?
K005 O3 2.630(9) . ?
K005 N11 2.848(10) 2_565 ?
K005 O1 2.810(11) 2_565 ?
K005 N9 3.069(12) 2_565 ?
K005 N6 2.748(12) 2 ?
K005 N3 2.852(12) 1_545 ?
K006 K007 3.980(4) 1_545 ?
K006 K008 4.228(4) . ?
K006 O2 2.806(10) . ?
K006 N12 2.872(12) 1_545 ?
K006 O3 2.692(10) . ?
K006 N5 2.794(11) . ?
K006 N9 2.806(12) 2_565 ?
K006 N3 3.015(12) 1_545 ?
K006 C59 3.440(15) . ?
K006 C12 3.526(14) 1_545 ?
K007 N12 2.998(11) . ?
K007 N2 2.726(12) . ?
K007 N11 2.941(11) . ?
K007 N5 2.921(11) 1_565 ?
K007 C39 3.225(12) . ?
K007 C51 3.233(13) . ?
K007 C26 3.135(12) 1_565 ?
K007 C52 3.116(13) . ?
K007 N6 2.962(12) 1_565 ?
K007 N8 2.730(12) . ?
K007 C25 3.222(12) 1_565 ?
K007 C13 3.134(14) . ?
K008 O2 2.745(10) . ?
K008 N2 2.790(12) . ?
K008 N11 2.806(11) . ?
K008 N5 2.768(11) . ?
K008 O1 2.718(10) . ?
K008 C26 3.504(13) . ?
K008 C52 3.444(15) . ?
K008 N8 2.876(12) 1_545 ?
K008 C56 3.530(14) . ?
K008 C53 3.489(13) . ?
Cl6 C35 1.712(13) . ?
Cl2 C9 1.737(14) . ?
Cl3 C17 1.762(14) . ?
Cl4 C22 1.769(15) . ?
Cl8 C48 1.723(16) . ?
Cl7 C43 1.726(14) . ?
Cl5 C30 1.763(15) . ?
Cl1 C4 1.765(14) . ?
O2 C56 1.240(16) . ?
N12 C51 1.150(18) . ?
N2 C13 1.188(18) . ?
N4 C24 1.341(18) . ?
N4 C20 1.382(16) . ?
N14 C58 1.425(19) . ?
N14 C56 1.317(17) . ?
N14 C57 1.455(19) . ?
C32 C33 1.502(19) . ?
C32 C31 1.407(19) . ?
C32 C27 1.379(19) . ?
C14 C19 1.40(2) . ?
C14 C15 1.400(19) . ?
O3 C59 1.257(17) . ?
N11 C52 1.138(17) . ?
N5 C26 1.153(16) . ?
C29 C30 1.39(2) . ?
C29 C28 1.37(2) . ?
C24 C23 1.39(2) . ?
C10 C9 1.36(2) . ?
C10 C11 1.403(19) . ?
N1 C7 1.373(16) . ?
N1 C11 1.322(18) . ?
N7 C37 1.371(17) . ?
N7 C33 1.375(16) . ?
O1 C53 1.226(16) . ?
C37 C36 1.366(19) . ?
N10 C46 1.406(17) . ?
N10 C50 1.367(18) . ?
C20 C19 1.49(2) . ?
C20 C21 1.379(19) . ?
C39 N8 1.155(17) . ?
C42 C41 1.42(2) . ?
C42 C43 1.37(2) . ?
C49 C48 1.40(2) . ?
C49 C50 1.405(19) . ?
C7 C6 1.45(2) . ?
C7 C8 1.414(19) . ?
N15 C59 1.328(18) . ?
N15 C61 1.459(17) . ?
N15 C60 1.466(18) . ?
C38 N9 1.168(17) . ?
C30 C31 1.37(2) . ?
C33 C34 1.37(2) . ?
C45 C40 1.396(19) . ?
C45 C44 1.38(2) . ?
C45 C46 1.45(2) . ?
C5 C6 1.42(2) . ?
C5 C4 1.40(2) . ?
C34 C35 1.37(2) . ?
C40 C41 1.37(2) . ?
N6 C25 1.206(18) . ?
C19 C18 1.40(2) . ?
C22 C21 1.37(2) . ?
C22 C23 1.39(2) . ?
C9 C8 1.37(2) . ?
N13 C54 1.448(18) . ?
N13 C53 1.339(17) . ?
N13 C55 1.444(19) . ?
C48 C47 1.38(2) . ?
C6 C1 1.40(2) . ?
C3 C2 1.383(19) . ?
C3 C4 1.36(2) . ?
C47 C46 1.371(19) . ?
C36 C35 1.43(2) . ?
C2 C1 1.423(19) . ?
C18 C17 1.40(2) . ?
C17 C16 1.35(2) . ?
N3 C12 1.114(18) . ?
C27 C28 1.411(19) . ?
C16 C15 1.37(2) . ?
C43 C44 1.42(2) . ?

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
C39 Pt3 N7 94.8(4) . . ?
C39 Pt3 C27 172.5(5) . . ?
C38 Pt3 N7 173.1(5) . . ?
C38 Pt3 C39 91.9(5) . . ?
C38 Pt3 C27 93.3(5) . . ?
C27 Pt3 N7 80.2(5) . . ?
C51 Pt4 N10 176.1(5) . . ?
C51 Pt4 C52 88.7(5) . . ?
C51 Pt4 C40 95.7(5) . . ?
C52 Pt4 N10 95.1(5) . . ?
C52 Pt4 C40 175.4(5) . . ?
C40 Pt4 N10 80.4(5) . . ?
C13 Pt1 N1 94.0(5) . . ?
C13 Pt1 C1 173.6(5) . . ?
C1 Pt1 N1 80.6(5) . . ?
C12 Pt1 N1 176.2(5) . . ?
C12 Pt1 C13 89.8(5) . . ?
C12 Pt1 C1 95.6(5) . . ?
N4 Pt2 C14 81.6(5) . . ?
C26 Pt2 N4 96.1(5) . . ?
C26 Pt2 C14 177.7(5) . . ?
C25 Pt2 N4 175.9(5) . . ?
C25 Pt2 C14 94.4(5) . . ?
C25 Pt2 C26 87.8(5) . . ?
K006 K005 K007 142.28(9) . 2_565 ?
K006 K005 K008 136.66(9) . 2_565 ?
K007 K005 K008 61.21(7) 2_565 2_565 ?
O3 K005 K006 45.0(2) . . ?
O3 K005 K007 165.9(2) . 2_565 ?
O3 K005 K008 105.2(2) . 2_565 ?
O3 K005 N11 118.6(3) . 2_565 ?
O3 K005 O1 83.9(3) . 2_565 ?
O3 K005 N9 80.6(3) . 2_565 ?
O3 K005 N6 137.8(4) . 2 ?
O3 K005 N3 71.1(3) . 1_545 ?
N11 K005 K006 119.5(2) 2_565 . ?
N11 K005 K007 48.6(2) 2_565 2_565 ?
N11 K005 K008 37.8(2) 2_565 2_565 ?
N11 K005 N9 76.7(3) 2_565 2_565 ?
N11 K005 N3 157.8(4) 2_565 1_545 ?
O1 K005 K006 128.4(2) 2_565 . ?
O1 K005 K007 85.9(2) 2_565 2_565 ?
O1 K005 K008 35.7(2) 2_565 2_565 ?
O1 K005 N11 73.3(3) 2_565 2_565 ?
O1 K005 N9 133.9(3) 2_565 2_565 ?
O1 K005 N3 128.8(3) 2_565 1_545 ?
N9 K005 K006 46.7(2) 2_565 . ?
N9 K005 K007 99.7(2) 2_565 2_565 ?
N9 K005 K008 109.2(2) 2_565 2_565 ?
N6 K005 K006 139.0(3) 2 . ?
N6 K005 K007 49.2(3) 2 2_565 ?
N6 K005 K008 84.2(3) 2 2_565 ?
N6 K005 N11 94.2(3) 2 2_565 ?
N6 K005 O1 80.9(4) 2 2_565 ?
N6 K005 N9 135.9(4) 2 2_565 ?
N6 K005 N3 88.5(4) 2 1_545 ?
N3 K005 K006 51.5(2) 1_545 . ?
N3 K005 K007 123.0(3) 1_545 2_565 ?
N3 K005 K008 163.8(3) 1_545 2_565 ?
N3 K005 N9 86.1(3) 1_545 2_565 ?
K005 K006 K007 144.20(9) . 1_545 ?
K005 K006 K008 136.83(9) . . ?
K007 K006 K008 61.94(7) 1_545 . ?
O2 K006 K005 124.1(2) . . ?
O2 K006 K007 89.7(2) . 1_545 ?
O2 K006 K008 39.9(2) . . ?
O2 K006 N12 79.2(3) . 1_545 ?
O2 K006 N3 153.0(3) . 1_545 ?
O2 K006 C59 70.8(3) . . ?
O2 K006 C12 149.7(3) . 1_545 ?
N12 K006 K005 140.3(3) 1_545 . ?
N12 K006 K007 48.7(2) 1_545 1_545 ?
N12 K006 K008 82.4(3) 1_545 . ?
N12 K006 N3 124.4(4) 1_545 1_545 ?
N12 K006 C59 149.4(3) 1_545 . ?
N12 K006 C12 112.5(3) 1_545 1_545 ?
O3 K006 K005 43.7(2) . . ?
O3 K006 K007 138.4(2) . 1_545 ?
O3 K006 K008 93.3(2) . . ?
O3 K006 O2 89.9(3) . . ?
O3 K006 N12 167.5(3) . 1_545 ?
O3 K006 N5 91.9(3) . . ?
O3 K006 N9 84.6(3) . 2_565 ?
O3 K006 N3 67.8(3) . 1_545 ?
O3 K006 C59 19.1(3) . . ?
O3 K006 C12 80.0(3) . 1_545 ?
N5 K006 K005 121.2(2) . . ?
N5 K006 K007 47.2(2) . 1_545 ?
N5 K006 K008 40.3(2) . . ?
N5 K006 O2 80.1(3) . . ?
N5 K006 N12 92.2(3) . 1_545 ?
N5 K006 N9 173.3(4) . 2_565 ?
N5 K006 N3 85.4(3) . 1_545 ?
N5 K006 C59 88.5(3) . . ?
N5 K006 C12 71.9(3) . 1_545 ?
N9 K006 K005 52.7(3) 2_565 . ?
N9 K006 K007 135.1(3) 2_565 1_545 ?
N9 K006 K008 145.5(3) 2_565 . ?
N9 K006 O2 105.6(3) 2_565 . ?
N9 K006 N12 92.4(3) 2_565 1_545 ?
N9 K006 N3 87.9(3) 2_565 1_545 ?
N9 K006 C59 90.1(3) 2_565 . ?
N9 K006 C12 101.8(3) 2_565 1_545 ?
N3 K006 K005 47.7(2) 1_545 . ?
N3 K006 K007 97.0(2) 1_545 1_545 ?
N3 K006 K008 123.1(3) 1_545 . ?
N3 K006 C59 86.2(3) 1_545 . ?
N3 K006 C12 17.5(3) 1_545 1_545 ?
C59 K006 K005 60.1(2) . . ?
C59 K006 K007 134.7(2) . 1_545 ?
C59 K006 K008 78.5(2) . . ?
C59 K006 C12 96.8(3) . 1_545 ?
C12 K006 K005 65.2(2) 1_545 . ?
C12 K006 K007 79.6(2) 1_545 1_545 ?
C12 K006 K008 111.8(2) 1_545 . ?
N12 K007 C39 83.0(3) . . ?
N12 K007 C51 20.8(3) . . ?
N12 K007 C26 107.4(3) . 1_565 ?
N12 K007 C52 72.1(4) . . ?
N12 K007 C25 158.1(4) . 1_565 ?
N12 K007 C13 95.1(3) . . ?
N2 K007 N12 86.8(3) . . ?
N2 K007 N11 79.4(3) . . ?
N2 K007 N5 102.6(3) . 1_565 ?
N2 K007 C39 154.5(3) . . ?
N2 K007 C51 90.3(3) . . ?
N2 K007 C26 95.7(3) . 1_565 ?
N2 K007 C52 85.4(4) . . ?
N2 K007 N6 94.5(4) . 1_565 ?
N2 K007 N8 174.7(4) . . ?
N2 K007 C25 91.0(3) . 1_565 ?
N2 K007 C13 22.0(4) . . ?
N11 K007 N12 92.4(3) . . ?
N11 K007 C39 77.7(3) . . ?
N11 K007 C51 72.8(3) . . ?
N11 K007 C26 159.4(3) . 1_565 ?
N11 K007 C52 21.4(3) . . ?
N11 K007 N6 88.0(3) . 1_565 ?
N11 K007 C25 108.7(3) . 1_565 ?
N11 K007 C13 99.4(4) . . ?
N5 K007 N12 87.2(3) 1_565 . ?
N5 K007 N11 178.0(3) 1_565 . ?
N5 K007 C39 100.3(3) 1_565 . ?
N5 K007 C51 106.5(3) 1_565 . ?
N5 K007 C26 21.6(3) 1_565 1_565 ?
N5 K007 C52 157.5(4) 1_565 . ?
N5 K007 N6 92.4(3) 1_565 1_565 ?
N5 K007 C25 71.9(3) 1_565 1_565 ?
N5 K007 C13 82.7(4) 1_565 . ?
C39 K007 C51 72.3(3) . . ?
C26 K007 C39 109.6(3) 1_565 . ?
C26 K007 C51 127.5(4) 1_565 . ?
C26 K007 C25 51.1(4) 1_565 1_565 ?
C52 K007 C39 69.2(3) . . ?
C52 K007 C51 51.9(4) . . ?
C52 K007 C26 178.8(4) . 1_565 ?
C52 K007 C25 129.5(4) . 1_565 ?
C52 K007 C13 107.3(4) . . ?
N6 K007 N12 178.7(4) 1_565 . ?
N6 K007 C39 95.9(3) 1_565 . ?
N6 K007 C51 159.0(3) 1_565 . ?
N6 K007 C26 72.3(3) 1_565 1_565 ?
N6 K007 C52 108.1(4) 1_565 . ?
N6 K007 C25 22.0(3) 1_565 1_565 ?
N6 K007 C13 86.0(3) 1_565 . ?
N8 K007 N12 90.5(3) . . ?
N8 K007 N11 96.1(3) . . ?
N8 K007 N5 81.9(3) . 1_565 ?
N8 K007 C39 20.2(3) . . ?
N8 K007 C51 85.6(3) . . ?
N8 K007 C26 89.4(4) . 1_565 ?
N8 K007 C52 89.4(4) . . ?
N8 K007 N6 88.3(3) . 1_565 ?
N8 K007 C25 93.2(3) . 1_565 ?
N8 K007 C13 163.2(4) . . ?
C25 K007 C39 106.9(3) 1_565 . ?
C25 K007 C51 178.2(4) 1_565 . ?
C13 K007 C39 176.4(4) . . ?
C13 K007 C51 105.0(4) . . ?
C13 K007 C26 73.8(4) . 1_565 ?
C13 K007 C25 75.9(3) . 1_565 ?
K006 K008 K007 56.15(7) . 1_545 ?
O2 K008 K006 40.9(2) . . ?
O2 K008 K007 85.5(2) . 1_545 ?
O2 K008 N2 79.3(3) . . ?
O2 K008 N11 102.5(3) . . ?
O2 K008 N5 81.6(3) . . ?
O2 K008 C26 97.9(3) . . ?
O2 K008 C52 85.1(3) . . ?
O2 K008 N8 101.9(3) . 1_545 ?
O2 K008 C56 17.7(3) . . ?
O2 K008 C53 165.3(3) . . ?
N2 K008 K006 90.2(2) . . ?
N2 K008 K007 140.3(3) . 1_545 ?
N2 K008 N11 80.7(3) . . ?
N2 K008 C26 99.2(3) . . ?
N2 K008 C52 78.4(3) . . ?
N2 K008 N8 178.7(4) . 1_545 ?
N2 K008 C56 69.3(3) . . ?
N2 K008 C53 109.7(3) . . ?
N11 K008 K006 143.5(2) . . ?
N11 K008 K007 138.7(2) . 1_545 ?
N11 K008 C26 159.2(3) . . ?
N11 K008 C52 17.4(3) . . ?
N11 K008 N8 99.4(3) . 1_545 ?
N11 K008 C56 86.3(3) . . ?
N11 K008 C53 90.6(3) . . ?
N5 K008 K006 40.8(2) . . ?
N5 K008 K007 43.4(2) . 1_545 ?
N5 K008 N2 97.7(3) . . ?
N5 K008 N11 175.2(4) . . ?
N5 K008 C26 16.4(3) . . ?
N5 K008 C52 166.6(3) . . ?
N5 K008 N8 82.0(3) . 1_545 ?
N5 K008 C56 97.5(3) . . ?
N5 K008 C53 85.6(3) . . ?
O1 K008 K006 141.1(2) . . ?
O1 K008 K007 97.8(2) . 1_545 ?
O1 K008 O2 176.6(3) . . ?
O1 K008 N2 97.7(3) . . ?
O1 K008 N11 75.4(3) . . ?
O1 K008 N5 100.4(3) . . ?
O1 K008 C26 84.0(3) . . ?
O1 K008 C52 92.8(3) . . ?
O1 K008 N8 81.1(3) . 1_545 ?
O1 K008 C56 159.2(3) . . ?
O1 K008 C53 17.8(3) . . ?
C26 K008 K006 57.1(2) . . ?
C26 K008 K007 46.68(19) . 1_545 ?
C26 K008 C56 113.4(3) . . ?
C52 K008 K006 126.0(2) . . ?
C52 K008 K007 136.9(2) . 1_545 ?
C52 K008 C26 175.8(3) . . ?
C52 K008 C56 69.2(3) . . ?
C52 K008 C53 107.8(3) . . ?
N8 K008 K006 90.5(2) 1_545 . ?
N8 K008 K007 39.7(2) 1_545 1_545 ?
N8 K008 C26 80.2(3) 1_545 . ?
N8 K008 C52 102.1(3) 1_545 . ?
N8 K008 C56 112.0(3) 1_545 . ?
N8 K008 C53 69.0(3) 1_545 . ?
C56 K008 K006 57.6(2) . . ?
C56 K008 K007 102.5(2) . 1_545 ?
C53 K008 K006 125.6(2) . . ?
C53 K008 K007 80.2(2) . 1_545 ?
C53 K008 C26 69.6(3) . . ?
C53 K008 C56 176.9(3) . . ?
K008 O2 K006 99.2(3) . . ?
C56 O2 K006 134.9(9) . . ?
C56 O2 K008 119.9(8) . . ?
K006 N12 K007 85.4(3) 1_565 . ?
C51 N12 K006 175.5(11) . 1_565 ?
C51 N12 K007 91.2(9) . . ?
K007 N2 K008 101.8(4) . . ?
C13 N2 K007 98.7(9) . . ?
C13 N2 K008 139.0(10) . . ?
C24 N4 Pt2 126.1(9) . . ?
C24 N4 C20 118.5(11) . . ?
C20 N4 Pt2 115.3(9) . . ?
C58 N14 C57 117.1(11) . . ?
C56 N14 C58 121.9(13) . . ?
C56 N14 C57 121.1(13) . . ?
C31 C32 C33 120.8(13) . . ?
C27 C32 C33 115.7(12) . . ?
C27 C32 C31 123.4(14) . . ?
C19 C14 Pt2 112.6(10) . . ?
C19 C14 C15 118.5(13) . . ?
C15 C14 Pt2 128.8(10) . . ?
K005 O3 K006 91.3(3) . . ?
C59 O3 K005 136.2(9) . . ?
C59 O3 K006 116.4(8) . . ?
K005 N11 K007 84.8(3) 2_564 . ?
K008 N11 K005 103.8(3) . 2_564 ?
K008 N11 K007 96.2(3) . . ?
C52 N11 K005 141.2(10) . 2_564 ?
C52 N11 K007 88.0(8) . . ?
C52 N11 K008 114.9(9) . . ?
K006 N5 K007 88.2(3) . 1_545 ?
K008 N5 K006 99.0(3) . . ?
K008 N5 K007 96.0(4) . 1_545 ?
C26 N5 K006 140.0(10) . . ?
C26 N5 K007 89.7(8) . 1_545 ?
C26 N5 K008 121.0(10) . . ?
C28 C29 C30 117.5(14) . . ?
N4 C24 C23 124.6(14) . . ?
C9 C10 C11 117.0(14) . . ?
C7 N1 Pt1 114.0(8) . . ?
C11 N1 Pt1 124.6(9) . . ?
C11 N1 C7 121.3(11) . . ?
C37 N7 Pt3 126.3(9) . . ?
C37 N7 C33 117.2(11) . . ?
C33 N7 Pt3 116.5(9) . . ?
K008 O1 K005 107.2(3) . 2_564 ?
C53 O1 K005 126.3(9) . 2_564 ?
C53 O1 K008 119.5(9) . . ?
C36 C37 N7 124.1(13) . . ?
C46 N10 Pt4 114.7(9) . . ?
C50 N10 Pt4 125.5(9) . . ?
C50 N10 C46 119.8(12) . . ?
N4 C20 C19 113.5(12) . . ?
C21 C20 N4 120.6(12) . . ?
C21 C20 C19 125.9(13) . . ?
Pt3 C39 K007 127.1(5) . . ?
N8 C39 Pt3 176.1(11) . . ?
N8 C39 K007 54.9(8) . . ?
C43 C42 C41 118.2(14) . . ?
C48 C49 C50 118.4(13) . . ?
Pt4 C51 K007 106.6(5) . . ?
N12 C51 Pt4 174.4(11) . . ?
N12 C51 K007 68.0(8) . . ?
Pt2 C26 K007 107.7(5) . 1_545 ?
Pt2 C26 K008 137.6(5) . . ?
K007 C26 K008 78.9(3) 1_545 . ?
N5 C26 Pt2 176.5(11) . . ?
N5 C26 K007 68.7(8) . 1_545 ?
N5 C26 K008 42.7(8) . . ?
N1 C7 C6 114.5(12) . . ?
N1 C7 C8 119.7(12) . . ?
C8 C7 C6 125.7(13) . . ?
C59 N15 C61 119.7(12) . . ?
C59 N15 C60 122.0(13) . . ?
C61 N15 C60 118.0(12) . . ?
N9 C38 Pt3 177.9(12) . . ?
C29 C30 Cl5 117.1(11) . . ?
C31 C30 Cl5 119.1(11) . . ?
C31 C30 C29 123.6(14) . . ?
N7 C33 C32 112.7(11) . . ?
C34 C33 C32 126.0(12) . . ?
C34 C33 N7 121.1(12) . . ?
K006 N9 K005 80.6(3) 2_564 2_564 ?
C38 N9 K005 107.6(9) . 2_564 ?
C38 N9 K006 150.8(10) . 2_564 ?
C40 C45 C46 116.0(13) . . ?
C44 C45 C40 123.1(14) . . ?
C44 C45 C46 120.9(13) . . ?
C4 C5 C6 117.4(14) . . ?
Pt4 C52 K007 108.4(5) . . ?
Pt4 C52 K008 133.1(5) . . ?
K007 C52 K008 81.3(3) . . ?
N11 C52 Pt4 178.8(12) . . ?
N11 C52 K007 70.6(8) . . ?
N11 C52 K008 47.7(8) . . ?
C33 C34 C35 121.2(14) . . ?
C45 C40 Pt4 114.6(10) . . ?
C41 C40 Pt4 128.8(10) . . ?
C41 C40 C45 116.6(13) . . ?
K005 N6 K007 86.2(3) 2_554 1_545 ?
C25 N6 K005 177.5(11) . 2_554 ?
C25 N6 K007 91.2(9) . 1_545 ?
K007 N8 K008 97.9(4) . 1_565 ?
C39 N8 K007 104.8(9) . . ?
C39 N8 K008 137.7(9) . 1_565 ?
C14 C19 C20 116.7(14) . . ?
C14 C19 C18 122.3(15) . . ?
C18 C19 C20 120.9(14) . . ?
C21 C22 Cl4 118.6(11) . . ?
C21 C22 C23 123.6(14) . . ?
C23 C22 Cl4 117.6(12) . . ?
C10 C9 Cl2 119.3(12) . . ?
C10 C9 C8 123.8(14) . . ?
C8 C9 Cl2 116.8(12) . . ?
C53 N13 C54 120.4(13) . . ?
C53 N13 C55 123.4(13) . . ?
C55 N13 C54 116.0(12) . . ?
C49 C48 Cl8 117.6(12) . . ?
C47 C48 Cl8 122.4(12) . . ?
C47 C48 C49 119.9(14) . . ?
C5 C6 C7 122.5(15) . . ?
C1 C6 C7 116.9(13) . . ?
C1 C6 C5 120.5(14) . . ?
C4 C3 C2 120.1(13) . . ?
C30 C31 C32 116.3(14) . . ?
C40 C41 C42 122.9(14) . . ?
C46 C47 C48 121.4(13) . . ?
C37 C36 C35 117.1(13) . . ?
C22 C21 C20 117.9(13) . . ?
C3 C2 C1 120.3(13) . . ?
O2 C56 K008 42.4(7) . . ?
O2 C56 N14 125.1(13) . . ?
N14 C56 K008 159.6(10) . . ?
C9 C8 C7 116.8(14) . . ?
Pt2 C25 K007 107.3(5) . 1_545 ?
N6 C25 Pt2 174.0(11) . . ?
N6 C25 K007 66.8(8) . 1_545 ?
C17 C18 C19 116.3(14) . . ?
C18 C17 Cl3 117.4(11) . . ?
C16 C17 Cl3 120.6(12) . . ?
C16 C17 C18 121.9(14) . . ?
K005 N3 K006 80.8(3) 1_565 1_565 ?
C12 N3 K005 171.0(11) . 1_565 ?
C12 N3 K006 108.2(10) . 1_565 ?
O1 C53 K008 42.7(7) . . ?
O1 C53 N13 124.2(13) . . ?
N13 C53 K008 162.2(10) . . ?
N1 C11 C10 121.2(13) . . ?
C32 C27 Pt3 115.0(10) . . ?
C32 C27 C28 116.3(12) . . ?
C28 C27 Pt3 128.8(9) . . ?
C17 C16 C15 122.0(15) . . ?
C16 C15 C14 118.9(14) . . ?
O3 C59 K006 44.5(7) . . ?
O3 C59 N15 124.5(14) . . ?
N15 C59 K006 107.7(9) . . ?
Pt1 C13 K007 124.9(6) . . ?
N2 C13 Pt1 175.1(12) . . ?
N2 C13 K007 59.3(8) . . ?
C5 C4 Cl1 117.6(11) . . ?
C3 C4 Cl1 119.7(11) . . ?
C3 C4 C5 122.6(13) . . ?
C34 C35 Cl6 122.4(12) . . ?
C34 C35 C36 119.0(13) . . ?
C36 C35 Cl6 118.6(11) . . ?
C6 C1 Pt1 113.9(10) . . ?
C6 C1 C2 118.8(13) . . ?
C2 C1 Pt1 127.2(10) . . ?
C42 C43 Cl7 119.0(12) . . ?
C42 C43 C44 120.5(14) . . ?
C44 C43 Cl7 120.4(11) . . ?
Pt1 C12 K006 125.6(5) . 1_565 ?
N3 C12 Pt1 177.3(14) . . ?
N3 C12 K006 54.3(8) . 1_565 ?
C29 C28 C27 122.8(13) . . ?
C45 C44 C43 118.4(14) . . ?
N10 C46 C45 114.0(12) . . ?
C47 C46 N10 119.2(12) . . ?
C47 C46 C45 126.7(13) . . ?
C24 C23 C22 114.1(14) . . ?
N10 C50 C49 121.1(13) . . ?

_olex2_submission_special_instructions 'No special instructions were received'
