#------------------------------------------------------------------------------
#$Date: 2023-05-05 05:30:25 +0300 (Fri, 05 May 2023) $
#$Revision: 283328 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/71/24/7712438.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_7712438
loop_
_publ_author_name
'Stephens, Liam J.'
'Dallerba, Elena'
'Kelderman, Jenisi T. A.'
'Levina, Aviva'
'Werrett, Melissa V.'
'Lay, Peter A.'
'Massi, Massimiliano'
'Andrews, Philip C.'
_publ_section_title
;
 Synthesis and the photophysical and biological properties of tricarbonyl
 Re(I) diimine complexes bound to thiotetrazolato ligands.
;
_journal_issue                   15
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              4835
_journal_page_last               4848
_journal_paper_doi               10.1039/d2dt03237f
_journal_volume                  52
_journal_year                    2023
_chemical_formula_sum            'C90 H150 N6 Ni3.11 O22 Pt15.89'
_chemical_formula_weight         4950.72
_space_group_crystal_system      orthorhombic
_space_group_IT_number           59
_space_group_name_Hall           '-P 2ab 2a'
_space_group_name_H-M_alt        'P m m n :2'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2014/7
_audit_update_record
;
2023-01-29 deposited with the CCDC.	2023-02-28 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   17.067(4)
_cell_length_b                   20.438(5)
_cell_length_c                   16.797(4)
_cell_measurement_reflns_used    9867
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      26.4895
_cell_measurement_theta_min      2.3845
_cell_volume                     5859(2)
_computing_cell_refinement       'APEX2 (Bruker AXS, 2006)'
_computing_data_collection       'APEX2 (Bruker AXS, 2006)'
_computing_data_reduction        'SAINT (Bruker AXS, 2004)'
_computing_molecular_graphics    'SCHAKAL99 (Keller, 1999)'
_computing_publication_material  'XCIF (Bruker AXS, 2001)'
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_computing_structure_solution    'SHELXL-2014/7 (Sheldrick, 2014)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.992
_diffrn_measured_fraction_theta_max 0.992
_diffrn_measurement_device_type  'PHOTON2 area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0887
_diffrn_reflns_av_unetI/netI     0.0468
_diffrn_reflns_Laue_measured_fraction_full 0.992
_diffrn_reflns_Laue_measured_fraction_max 0.992
_diffrn_reflns_limit_h_max       20
_diffrn_reflns_limit_h_min       -20
_diffrn_reflns_limit_k_max       24
_diffrn_reflns_limit_k_min       -24
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            52911
_diffrn_reflns_point_group_measured_fraction_full 0.992
_diffrn_reflns_point_group_measured_fraction_max 0.992
_diffrn_reflns_theta_full        25.000
_diffrn_reflns_theta_max         25.000
_diffrn_reflns_theta_min         1.971
_diffrn_source                   'fine-focus sealed tube'
_exptl_absorpt_coefficient_mu    19.429
_exptl_absorpt_correction_T_max  0.0788
_exptl_absorpt_correction_T_min  0.0165
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details
;
 Data were corrected for Lorentz polarization and absorption
 effects (empirical absorption corrections SADABS).
 R(int) = 0.1914 (selected reflections only, before parameter refinement)
 R(int) = 0.1030(selected reflections only, after parameter refinement)
;
_exptl_crystal_colour            black
_exptl_crystal_density_diffrn    2.806
_exptl_crystal_description       prism
_exptl_crystal_F_000             4469
_exptl_crystal_size_max          0.180
_exptl_crystal_size_mid          0.160
_exptl_crystal_size_min          0.120
_refine_diff_density_max         5.642
_refine_diff_density_min         -2.750
_refine_diff_density_rms         0.664
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.128
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     202
_refine_ls_number_reflns         5476
_refine_ls_number_restraints     85
_refine_ls_restrained_S_all      1.120
_refine_ls_R_factor_all          0.1777
_refine_ls_R_factor_gt           0.1507
_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)+(0.1534P)²+1206.2792P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.3959
_refine_ls_wR_factor_ref         0.4267
_reflns_Friedel_coverage         0.000
_reflns_number_gt                3744
_reflns_number_total             5476
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d2dt03237f2.cif
_cod_data_source_block           Ni323Pt1577
_cod_depositor_comments
'Adding full bibliography for 7712436--7712441.cif.'
_cod_original_sg_symbol_H-M      'P m m n'
_cod_database_code               7712438
_shelx_shelxl_version_number     2014/7
_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.
;
_shelx_estimated_absorpt_t_min   0.128
_shelx_estimated_absorpt_t_max   0.204
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, -y+1/2, z'
'-x, y+1/2, -z'
'x+1/2, -y, -z'
'-x, -y, -z'
'x-1/2, y-1/2, -z'
'x, -y-1/2, z'
'-x-1/2, y, z'
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 0.32686(13) 0.2500 0.74974(15) 0.0492(7) Uani 1 2 d S T P . .
Pt2 Pt 0.2500 0.31989(11) 0.86699(16) 0.0553(7) Uani 1 2 d DS T P . .
Pt3 Pt 0.2500 0.2500 0.6046(2) 0.0600(10) Uani 1 4 d DS T P . .
Pt4 Pt 0.48215(15) 0.2500 0.75048(18) 0.0628(8) Uani 1 2 d DS T P . .
Pt5 Pt 0.2500 0.36347(12) 0.70461(17) 0.0605(8) Uani 1 2 d DS T P . .
Pt6 Pt 0.0928(2) 0.2500 0.6077(2) 0.0672(16) Uani 0.73(2) 2 d DS T P . .
Ni6 Ni 0.0928(2) 0.2500 0.6077(2) 0.0672(16) Uani 0.27(2) 2 d S T P . .
Pt7 Pt 0.40607(14) 0.31890(12) 0.86541(16) 0.0611(11) Uani 0.646(14) 1 d D . P .
.
Ni7 Ni 0.40607(14) 0.31890(12) 0.86541(16) 0.0611(11) Uani 0.354(14) 1 d . . P .
.
Pt8 Pt 0.40579(15) 0.36147(11) 0.70669(17) 0.0648(11) Uani 0.683(14) 1 d D . P .
.
Ni8 Ni 0.40579(15) 0.36147(11) 0.70669(17) 0.0648(11) Uani 0.317(14) 1 d . . P .
.
C1 C 0.002(3) 0.2500 0.553(5) 0.108(18) Uiso 1 2 d DS U P . .
C2 C 0.1698(12) 0.2500 0.5177(11) 0.105(18) Uiso 1 2 d DS U P . .
C3 C 0.3298(12) 0.4243(18) 0.657(3) 0.095(12) Uiso 1 1 d D U . . .
C4 C 0.497(2) 0.405(3) 0.694(4) 0.101(13) Uiso 1 1 d D U . . .
C5 C 0.5872(11) 0.2500 0.753(4) 0.057(10) Uiso 1 2 d DS U P . .
C6 C 0.497(2) 0.348(3) 0.906(4) 0.095(12) Uiso 1 1 d D U . . .
C7 C 0.3290(12) 0.363(3) 0.937(3) 0.095(12) Uiso 1 1 d D U . . .
O1 O -0.053(3) 0.2500 0.513(3) 0.111(17) Uiso 1 2 d DS U P . .
O2 O 0.167(3) 0.2500 0.4494(16) 0.103(17) Uiso 1 2 d DS U P . .
O3 O 0.337(2) 0.4796(15) 0.644(3) 0.094(11) Uiso 1 1 d D U . . .
O4 O 0.5559(19) 0.433(2) 0.699(3) 0.106(12) Uiso 1 1 d D U . . .
O5 O 0.6537(13) 0.2500 0.756(2) 0.047(8) Uiso 1 2 d DS U P . .
O6 O 0.5541(18) 0.366(2) 0.936(2) 0.098(11) Uiso 1 1 d D U . . .
O7 O 0.336(2) 0.394(2) 0.993(2) 0.094(11) Uiso 1 1 d D U . . .
N1 N 0.2500 0.577(3) 0.890(3) 0.104(10) Uiso 1 2 d DS U P . .
C101 C 0.2500 0.618(3) 0.962(3) 0.095(11) Uiso 1 2 d DS U P . .
H10A H 0.2033 0.6467 0.9598 0.114 Uiso 0.5 1 calc R U P . .
H10B H 0.2967 0.6467 0.9598 0.114 Uiso 0.5 1 calc R U P . .
C102 C 0.2500 0.583(3) 1.043(4) 0.091(12) Uiso 1 2 d DS U P . .
H10C H 0.2029 0.5549 1.0475 0.109 Uiso 0.5 1 calc R U P . .
H10D H 0.2971 0.5549 1.0475 0.109 Uiso 0.5 1 calc R U P . .
C103 C 0.2500 0.635(3) 1.108(4) 0.089(13) Uiso 1 2 d DS U P . .
H10E H 0.2971 0.6630 1.1039 0.107 Uiso 0.5 1 calc R U P . .
H10F H 0.2029 0.6630 1.1039 0.107 Uiso 0.5 1 calc R U P . .
C104 C 0.2500 0.598(4) 1.187(4) 0.095(18) Uiso 1 2 d DS U P . .
H10G H 0.2500 0.6293 1.2314 0.143 Uiso 1 2 calc DR U P . .
H10H H 0.2031 0.5704 1.1905 0.143 Uiso 0.5 1 calc DR U P . .
H10I H 0.2969 0.5704 1.1905 0.143 Uiso 0.5 1 calc R U P . .
C105 C 0.2500 0.630(3) 0.831(4) 0.113(12) Uiso 1 2 d DS U P . .
H10J H 0.2971 0.6574 0.8366 0.135 Uiso 0.5 1 calc R U P . .
H10K H 0.2029 0.6574 0.8366 0.135 Uiso 0.5 1 calc R U P . .
C106 C 0.2500 0.596(5) 0.750(3) 0.124(14) Uiso 1 2 d DS U P . .
H10L H 0.2031 0.5682 0.7448 0.148 Uiso 0.5 1 calc R U P . .
H10M H 0.2969 0.5682 0.7448 0.148 Uiso 0.5 1 calc R U P . .
C107 C 0.2500 0.647(3) 0.682(4) 0.133(16) Uiso 1 2 d DS U P . .
H10N H 0.2027 0.6749 0.6841 0.159 Uiso 0.5 1 calc R U P . .
H10O H 0.2973 0.6749 0.6841 0.159 Uiso 0.5 1 calc R U P . .
C108 C 0.2500 0.604(2) 0.608(3) 0.16(2) Uiso 1 2 d DS U P . .
H10P H 0.2500 0.6312 0.5600 0.234 Uiso 1 2 calc DR U P . .
H10Q H 0.2969 0.5759 0.6077 0.234 Uiso 0.5 1 calc R U P . .
H10R H 0.2031 0.5759 0.6077 0.234 Uiso 0.5 1 calc R U P . .
C109 C 0.183(3) 0.533(3) 0.879(5) 0.104(10) Uiso 1 1 d D U . . .
H10S H 0.1811 0.5021 0.9250 0.124 Uiso 1 1 calc R U . . .
H10T H 0.1919 0.5066 0.8306 0.124 Uiso 1 1 calc R U . . .
C110 C 0.105(3) 0.568(3) 0.873(5) 0.108(11) Uiso 1 1 d D U . . .
H11A H 0.1017 0.5920 0.8216 0.129 Uiso 1 1 calc R U . . .
H11B H 0.0986 0.5996 0.9167 0.129 Uiso 1 1 calc R U . . .
C111 C 0.041(3) 0.516(3) 0.877(4) 0.109(12) Uiso 1 1 d D U . . .
H11C H 0.0510 0.4827 0.8347 0.130 Uiso 1 1 calc R U . . .
H11D H 0.0442 0.4933 0.9287 0.130 Uiso 1 1 calc R U . . .
C112 C -0.042(3) 0.542(4) 0.866(4) 0.116(17) Uiso 1 1 d D U . . .
H11E H -0.0795 0.5059 0.8693 0.173 Uiso 1 1 calc R U . . .
H11F H -0.0532 0.5740 0.9080 0.173 Uiso 1 1 calc R U . . .
H11G H -0.0464 0.5633 0.8139 0.173 Uiso 1 1 calc R U . . .
N2 N 0.2500 0.447(5) 0.397(5) 0.171(14) Uiso 1 2 d DS U P . .
C201 C 0.2500 0.518(5) 0.387(8) 0.171(15) Uiso 1 2 d DS U P . .
H20A H 0.2035 0.5294 0.3542 0.206 Uiso 0.5 1 calc R U P . .
H20B H 0.2965 0.5294 0.3542 0.206 Uiso 0.5 1 calc R U P . .
C202 C 0.2500 0.565(5) 0.457(8) 0.172(15) Uiso 1 2 d DS U P . .
H20C H 0.2968 0.5564 0.4905 0.207 Uiso 0.5 1 calc R U P . .
H20D H 0.2032 0.5564 0.4905 0.207 Uiso 0.5 1 calc R U P . .
C203 C 0.2500 0.638(6) 0.435(3) 0.174(16) Uiso 1 2 d DS U P . .
H20E H 0.2032 0.6589 0.4582 0.208 Uiso 0.5 1 calc R U P . .
H20F H 0.2968 0.6589 0.4582 0.208 Uiso 0.5 1 calc R U P . .
C204 C 0.2500 0.6511(4) 0.345(3) 0.179(18) Uiso 1 2 d DS U P . .
H20G H 0.2500 0.6984 0.3359 0.268 Uiso 1 2 calc DR U P . .
H20H H 0.2969 0.6316 0.3213 0.268 Uiso 0.5 1 calc R U P . .
H20I H 0.2031 0.6316 0.3213 0.268 Uiso 0.5 1 calc R U P . .
C205 C 0.1814(6) 0.429(6) 0.445(5) 0.172(15) Uiso 1 1 d D U . . .
H20J H 0.1804 0.4574 0.4928 0.207 Uiso 1 1 calc R U . . .
H20K H 0.1883 0.3835 0.4636 0.207 Uiso 1 1 calc DR U . . .
C206 C 0.102(3) 0.434(6) 0.404(5) 0.174(15) Uiso 1 1 d D U . . .
H20L H 0.1009 0.4054 0.3567 0.209 Uiso 1 1 calc R U . . .
H20M H 0.0925 0.4796 0.3868 0.209 Uiso 1 1 calc R U . . .
C207 C 0.039(5) 0.413(6) 0.464(4) 0.176(15) Uiso 1 1 d D U . . .
H20N H 0.0489 0.3681 0.4842 0.211 Uiso 1 1 calc R U . . .
H20O H 0.0353 0.4435 0.5092 0.211 Uiso 1 1 calc R U . . .
C208 C -0.036(3) 0.415(5) 0.413(6) 0.179(18) Uiso 1 1 d D U . . .
H20P H -0.0810 0.4017 0.4460 0.268 Uiso 1 1 calc R U . . .
H20Q H -0.0442 0.4592 0.3932 0.268 Uiso 1 1 calc R U . . .
H20R H -0.0307 0.3844 0.3683 0.268 Uiso 1 1 calc R U . . .
C209 C 0.2500 0.423(6) 0.315(7) 0.172(15) Uiso 1 2 d DS U P . .
H20S H 0.2968 0.4406 0.2871 0.206 Uiso 0.5 1 calc R U P . .
H20T H 0.2032 0.4406 0.2871 0.206 Uiso 0.5 1 calc R U P . .
C210 C 0.2500 0.349(6) 0.307(6) 0.173(15) Uiso 1 2 d DS U P . .
H21A H 0.2036 0.3330 0.3364 0.207 Uiso 0.5 1 calc R U P . .
H21B H 0.2964 0.3330 0.3364 0.207 Uiso 0.5 1 calc R U P . .
C211 C 0.2500 0.311(4) 0.228(7) 0.173(16) Uiso 1 2 d DS U P . .
H21C H 0.2967 0.2823 0.2268 0.208 Uiso 0.5 1 calc R U P . .
H21D H 0.2033 0.2823 0.2268 0.208 Uiso 0.5 1 calc R U P . .
C212 C 0.2500 0.352(7) 0.152(6) 0.173(18) Uiso 1 2 d DS U P . .
H21E H 0.2500 0.3230 0.1054 0.259 Uiso 1 2 calc R U P . .
H21F H 0.2031 0.3797 0.1508 0.259 Uiso 0.5 1 calc R U P . .
H21G H 0.2969 0.3797 0.1508 0.259 Uiso 0.5 1 calc R U P . .
N301 N 0.601(3) 0.2500 0.110(5) 0.089(16) Uiso 1 2 d DS U P . .
C302 C 0.534(3) 0.2500 0.106(5) 0.091(16) Uiso 1 2 d DS U P . .
C303 C 0.449(4) 0.2500 0.089(5) 0.091(18) Uiso 1 2 d DS U P . .
H30A H 0.4210 0.2708 0.1330 0.137 Uiso 0.5 1 calc R U P . .
H30B H 0.4306 0.2048 0.0826 0.137 Uiso 0.5 1 calc R U P . .
H30C H 0.4389 0.2744 0.0396 0.137 Uiso 0.5 1 calc R U P . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ni Ni 0.3393 1.1124 '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'
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
Pt1 Pt1 Pt4 179.73(8) 2 . ?
Pt1 Pt1 Ni8 119.40(7) 2 ? ?
Pt4 Pt1 Ni8 60.68(7) . ? ?
Pt1 Pt1 Pt8 119.40(7) 2 ? ?
Pt4 Pt1 Pt8 60.68(7) . ? ?
Ni8 Pt1 Pt8 0.0 ? ? ?
Pt1 Pt1 Pt8 119.40(7) 2 . ?
Pt4 Pt1 Pt8 60.68(7) . . ?
Ni8 Pt1 Pt8 112.3 ? . ?
Pt8 Pt1 Pt8 112.27(13) ? . ?
Pt1 Pt1 Ni6 119.87(9) 2 2 ?
Pt4 Pt1 Ni6 60.40(11) . 2 ?
Ni8 Pt1 Ni6 61.77(8) ? 2 ?
Pt8 Pt1 Ni6 61.77(8) ? 2 ?
Pt8 Pt1 Ni6 61.77(7) . 2 ?
Pt1 Pt1 Pt6 119.87(9) 2 2 ?
Pt4 Pt1 Pt6 60.40(11) . 2 ?
Ni8 Pt1 Pt6 61.77(8) ? 2 ?
Pt8 Pt1 Pt6 61.77(8) ? 2 ?
Pt8 Pt1 Pt6 61.77(7) . 2 ?
Ni6 Pt1 Pt6 0.0 2 2 ?
Pt1 Pt1 Ni7 119.40(7) 2 7_565 ?
Pt4 Pt1 Ni7 60.38(8) . 7_565 ?
Ni6 Pt1 Ni7 111.54(11) 2 7_565 ?
Pt6 Pt1 Ni7 111.54(11) 2 7_565 ?
Pt1 Pt1 Pt7 119.40(7) 2 7_565 ?
Pt4 Pt1 Pt7 60.38(8) . 7_565 ?
Ni6 Pt1 Pt7 111.54(11) 2 7_565 ?
Pt6 Pt1 Pt7 111.54(11) 2 7_565 ?
Ni7 Pt1 Pt7 0.0 7_565 7_565 ?
Pt1 Pt1 Pt7 119.40(7) 2 . ?
Pt4 Pt1 Pt7 60.39(8) . . ?
Pt8 Pt1 Pt7 61.34(8) . . ?
Ni6 Pt1 Pt7 111.54(11) 2 . ?
Pt6 Pt1 Pt7 111.54(11) 2 . ?
Ni7 Pt1 Pt7 61.5 7_565 . ?
Pt7 Pt1 Pt7 61.50(12) 7_565 . ?
C7 Pt2 C7 85.0(11) 8_655 . ?
C7 Pt2 Pt7 133.2(6) 8_655 . ?
C7 Pt2 Pt7 48.2(6) . . ?
C7 Pt2 Ni7 48.2(6) 8_655 8_655 ?
C7 Pt2 Ni7 133.2(6) . 8_655 ?
Pt7 Pt2 Ni7 178.6 . 8_655 ?
C7 Pt2 Pt7 48.2(6) 8_655 8_655 ?
C7 Pt2 Pt7 133.2(6) . 8_655 ?
Pt7 Pt2 Pt7 178.56(15) . 8_655 ?
Ni7 Pt2 Pt7 0.0 8_655 8_655 ?
C7 Pt2 Pt1 109.2(6) 8_655 2 ?
C7 Pt2 Pt1 165.8(6) . 2 ?
Pt7 Pt2 Pt1 117.61(10) . 2 ?
Ni7 Pt2 Pt1 60.95(8) 8_655 2 ?
Pt7 Pt2 Pt1 60.95(8) 8_655 2 ?
C7 Pt2 Pt1 165.8(6) 8_655 . ?
C7 Pt2 Pt1 109.2(6) . . ?
Pt7 Pt2 Pt1 60.95(8) . . ?
Ni7 Pt2 Pt1 117.61(10) 8_655 . ?
Pt7 Pt2 Pt1 117.61(10) 8_655 . ?
Pt1 Pt2 Pt1 56.67(10) 2 . ?
C7 Pt2 Pt2 115.9(18) 8_655 2 ?
C7 Pt2 Pt2 115.9(18) . 2 ?
Pt7 Pt2 Pt2 89.56(7) . 2 ?
Ni7 Pt2 Pt2 89.56(7) 8_655 2 ?
Pt7 Pt2 Pt2 89.56(7) 8_655 2 ?
Pt1 Pt2 Pt2 58.88(5) 2 2 ?
Pt1 Pt2 Pt2 58.88(5) . 2 ?
C7 Pt2 Pt5 115.4(18) 8_655 . ?
C7 Pt2 Pt5 115.4(18) . . ?
Pt7 Pt2 Pt5 89.59(8) . . ?
Ni7 Pt2 Pt5 89.59(8) 8_655 . ?
Pt7 Pt2 Pt5 89.59(8) 8_655 . ?
Pt1 Pt2 Pt5 58.88(8) 2 . ?
Pt1 Pt2 Pt5 58.88(8) . . ?
Pt2 Pt2 Pt5 108.09(7) 2 . ?
C2 Pt3 C2 86.3(12) . 2 ?
C2 Pt3 Ni6 134.2(6) . 2 ?
C2 Pt3 Ni6 48.0(6) 2 2 ?
C2 Pt3 Pt6 134.2(6) . 2 ?
C2 Pt3 Pt6 48.0(6) 2 2 ?
Ni6 Pt3 Pt6 0.0 2 2 ?
C2 Pt3 Pt6 48.0(6) . . ?
C2 Pt3 Pt6 134.2(6) 2 . ?
Ni6 Pt3 Pt6 177.8 2 . ?
Pt6 Pt3 Pt6 177.8(2) 2 . ?
C2 Pt3 Pt1 108.6(6) . 2 ?
C2 Pt3 Pt1 165.2(6) 2 2 ?
Ni6 Pt3 Pt1 117.20(15) 2 2 ?
Pt6 Pt3 Pt1 117.20(15) 2 2 ?
Pt6 Pt3 Pt1 60.62(10) . 2 ?
C2 Pt3 Pt1 165.2(6) . . ?
C2 Pt3 Pt1 108.6(6) 2 . ?
Ni6 Pt3 Pt1 60.62(10) 2 . ?
Pt6 Pt3 Pt1 60.62(10) 2 . ?
Pt6 Pt3 Pt1 117.20(15) . . ?
Pt1 Pt3 Pt1 56.58(12) 2 . ?
C2 Pt3 Pt5 115.3(3) . . ?
C2 Pt3 Pt5 115.3(3) 2 . ?
Ni6 Pt3 Pt5 89.36(7) 2 . ?
Pt6 Pt3 Pt5 89.36(7) 2 . ?
Pt6 Pt3 Pt5 89.36(7) . . ?
Pt1 Pt3 Pt5 58.91(8) 2 . ?
Pt1 Pt3 Pt5 58.91(8) . . ?
C2 Pt3 Pt5 115.3(3) . 2 ?
C2 Pt3 Pt5 115.3(3) 2 2 ?
Ni6 Pt3 Pt5 89.36(7) 2 2 ?
Pt6 Pt3 Pt5 89.36(7) 2 2 ?
Pt6 Pt3 Pt5 89.36(7) . 2 ?
Pt1 Pt3 Pt5 58.91(8) 2 2 ?
Pt1 Pt3 Pt5 58.91(8) . 2 ?
Pt5 Pt3 Pt5 108.19(16) . 2 ?
C5 Pt4 Pt1 179(2) . . ?
C5 Pt4 Ni6 120(2) . 2 ?
Pt1 Pt4 Ni6 61.64(11) . 2 ?
C5 Pt4 Pt6 120(2) . 2 ?
Pt1 Pt4 Pt6 61.64(11) . 2 ?
Ni6 Pt4 Pt6 0.0 2 2 ?
C5 Pt4 Ni7 117.3(18) . 7_565 ?
Pt1 Pt4 Ni7 61.70(8) . 7_565 ?
Ni6 Pt4 Ni7 113.67(12) 2 7_565 ?
Pt6 Pt4 Ni7 113.67(12) 2 7_565 ?
C5 Pt4 Pt7 117.3(18) . 7_565 ?
Pt1 Pt4 Pt7 61.70(8) . 7_565 ?
Ni6 Pt4 Pt7 113.67(12) 2 7_565 ?
Pt6 Pt4 Pt7 113.67(12) 2 7_565 ?
Ni7 Pt4 Pt7 0.0 7_565 7_565 ?
C5 Pt4 Pt7 117.3(18) . . ?
Pt1 Pt4 Pt7 61.70(8) . . ?
Ni6 Pt4 Pt7 113.67(11) 2 . ?
Pt6 Pt4 Pt7 113.67(11) 2 . ?
Ni7 Pt4 Pt7 62.4 7_565 . ?
Pt7 Pt4 Pt7 62.37(12) 7_565 . ?
C5 Pt4 Ni8 119.0(6) . ? ?
Pt1 Pt4 Ni8 61.35(7) . ? ?
Ni6 Pt4 Ni8 62.41(8) 2 ? ?
Pt6 Pt4 Ni8 62.41(8) 2 ? ?
C5 Pt4 Pt8 119.0(6) . ? ?
Pt1 Pt4 Pt8 61.35(7) . ? ?
Ni6 Pt4 Pt8 62.41(8) 2 ? ?
Pt6 Pt4 Pt8 62.41(8) 2 ? ?
Ni8 Pt4 Pt8 0.0 ? ? ?
C5 Pt4 Pt8 119.0(7) . . ?
Pt1 Pt4 Pt8 61.35(7) . . ?
Ni6 Pt4 Pt8 62.41(8) 2 . ?
Pt6 Pt4 Pt8 62.41(8) 2 . ?
Ni7 Pt4 Pt8 113.33(11) 7_565 . ?
Pt7 Pt4 Pt8 113.33(11) 7_565 . ?
Pt7 Pt4 Pt8 62.00(9) . . ?
Ni8 Pt4 Pt8 113.4 ? . ?
Pt8 Pt4 Pt8 113.40(15) ? . ?
C3 Pt5 C3 85.4(11) . 8_655 ?
C3 Pt5 Ni8 133.8(6) . 8_655 ?
C3 Pt5 Ni8 48.5(6) 8_655 8_655 ?
C3 Pt5 Pt8 133.8(6) . 8_655 ?
C3 Pt5 Pt8 48.5(6) 8_655 8_655 ?
Ni8 Pt5 Pt8 0.0 8_655 8_655 ?
C3 Pt5 Pt8 48.5(6) . . ?
C3 Pt5 Pt8 133.8(6) 8_655 . ?
Ni8 Pt5 Pt8 177.7 8_655 . ?
Pt8 Pt5 Pt8 177.68(15) 8_655 . ?
C3 Pt5 Pt1 161.4(14) . 2 ?
C3 Pt5 Pt1 107.8(7) 8_655 2 ?
Ni8 Pt5 Pt1 60.67(7) 8_655 2 ?
Pt8 Pt5 Pt1 60.67(7) 8_655 2 ?
Pt8 Pt5 Pt1 117.19(10) . 2 ?
C3 Pt5 Pt1 107.8(7) . . ?
C3 Pt5 Pt1 161.4(14) 8_655 . ?
Ni8 Pt5 Pt1 117.19(10) 8_655 . ?
Pt8 Pt5 Pt1 117.19(10) 8_655 . ?
Pt8 Pt5 Pt1 60.67(7) . . ?
Pt1 Pt5 Pt1 56.53(9) 2 . ?
C3 Pt5 Pt3 105.6(18) . . ?
C3 Pt5 Pt3 105.6(18) 8_655 . ?
Ni8 Pt5 Pt3 89.73(7) 8_655 . ?
Pt8 Pt5 Pt3 89.73(7) 8_655 . ?
Pt8 Pt5 Pt3 89.73(7) . . ?
Pt1 Pt5 Pt3 58.83(8) 2 . ?
Pt1 Pt5 Pt3 58.83(8) . . ?
C3 Pt5 Pt2 124.7(15) . . ?
C3 Pt5 Pt2 124.7(15) 8_655 . ?
Ni8 Pt5 Pt2 89.01(8) 8_655 . ?
Pt8 Pt5 Pt2 89.01(8) 8_655 . ?
Pt8 Pt5 Pt2 89.01(8) . . ?
Pt1 Pt5 Pt2 58.67(8) 2 . ?
Pt1 Pt5 Pt2 58.67(8) . . ?
Pt3 Pt5 Pt2 107.82(11) . . ?
C1 Pt6 C2 100(3) . . ?
C1 Pt6 Pt3 148(3) . . ?
C2 Pt6 Pt3 47.9(6) . . ?
C1 Pt6 Pt4 93(3) . 2 ?
C2 Pt6 Pt4 167.1(6) . 2 ?
Pt3 Pt6 Pt4 119.18(16) . 2 ?
C1 Pt6 Pt1 151(3) . 2 ?
C2 Pt6 Pt1 109.1(6) . 2 ?
Pt3 Pt6 Pt1 61.22(12) . 2 ?
Pt4 Pt6 Pt1 57.96(11) 2 2 ?
C1 Pt6 Ni8 107.9(18) . 8_655 ?
C2 Pt6 Ni8 116.1(3) . 8_655 ?
Pt3 Pt6 Ni8 90.17(11) . 8_655 ?
Pt4 Pt6 Ni8 58.92(9) 2 8_655 ?
Pt1 Pt6 Ni8 58.98(8) 2 8_655 ?
C1 Pt6 Pt8 107.9(18) . 8_655 ?
C2 Pt6 Pt8 116.1(3) . 8_655 ?
Pt3 Pt6 Pt8 90.17(11) . 8_655 ?
Pt4 Pt6 Pt8 58.92(9) 2 8_655 ?
Pt1 Pt6 Pt8 58.98(8) 2 8_655 ?
Ni8 Pt6 Pt8 0.0 8_655 8_655 ?
C1 Pt6 Pt8 107.9(18) . 2 ?
C2 Pt6 Pt8 116.1(3) . 2 ?
Pt3 Pt6 Pt8 90.17(11) . 2 ?
Pt4 Pt6 Pt8 58.92(9) 2 2 ?
Pt1 Pt6 Pt8 58.98(8) 2 2 ?
Ni8 Pt6 Pt8 107.7 8_655 2 ?
Pt8 Pt6 Pt8 107.74(16) 8_655 2 ?
C1 Pt6 Ni8 107.9(18) . 2 ?
C2 Pt6 Ni8 116.1(3) . 2 ?
Pt3 Pt6 Ni8 90.17(11) . 2 ?
Pt4 Pt6 Ni8 58.92(9) 2 2 ?
Pt1 Pt6 Ni8 58.98(8) 2 2 ?
Ni8 Pt6 Ni8 107.74(16) 8_655 2 ?
Pt8 Pt6 Ni8 107.74(16) 8_655 2 ?
Pt8 Pt6 Ni8 0.00(12) 2 2 ?
C6 Pt7 C7 101(2) . . ?
C6 Pt7 Pt2 149(2) . . ?
C7 Pt7 Pt2 48.1(6) . . ?
C6 Pt7 Pt4 91(2) . . ?
C7 Pt7 Pt4 167.3(6) . . ?
Pt2 Pt7 Pt4 119.24(12) . . ?
C6 Pt7 Pt1 149(2) . . ?
C7 Pt7 Pt1 109.4(6) . . ?
Pt2 Pt7 Pt1 61.32(9) . . ?
Pt4 Pt7 Pt1 57.92(9) . . ?
C6 Pt7 Pt8 105(2) . . ?
C7 Pt7 Pt8 115.8(18) . . ?
Pt2 Pt7 Pt8 90.31(11) . . ?
Pt4 Pt7 Pt8 59.12(9) . . ?
Pt1 Pt7 Pt8 59.15(8) . . ?
C6 Pt7 Ni7 109(2) . 7_565 ?
C7 Pt7 Ni7 116.5(18) . 7_565 ?
Pt2 Pt7 Ni7 90.44(7) . 7_565 ?
Pt4 Pt7 Ni7 58.81(6) . 7_565 ?
Pt1 Pt7 Ni7 59.25(6) . 7_565 ?
Pt8 Pt7 Ni7 108.07(7) . 7_565 ?
C6 Pt7 Pt7 109(2) . 7_565 ?
C7 Pt7 Pt7 116.5(18) . 7_565 ?
Pt2 Pt7 Pt7 90.44(7) . 7_565 ?
Pt4 Pt7 Pt7 58.81(6) . 7_565 ?
Pt1 Pt7 Pt7 59.25(6) . 7_565 ?
Pt8 Pt7 Pt7 108.07(7) . 7_565 ?
Ni7 Pt7 Pt7 0.0 7_565 7_565 ?
C4 Pt8 C3 101(2) . . ?
C4 Pt8 Pt5 149(2) . . ?
C3 Pt8 Pt5 48.5(6) . . ?
C4 Pt8 Pt4 92(2) . . ?
C3 Pt8 Pt4 163.0(15) . . ?
Pt5 Pt8 Pt4 119.63(11) . . ?
C4 Pt8 Pt1 150(2) . . ?
C3 Pt8 Pt1 108.9(7) . . ?
Pt5 Pt8 Pt1 61.66(8) . . ?
Pt4 Pt8 Pt1 57.97(8) . . ?
C4 Pt8 Pt7 105(2) . . ?
C3 Pt8 Pt7 126.4(16) . . ?
Pt5 Pt8 Pt7 91.09(10) . . ?
Pt4 Pt8 Pt7 58.89(9) . . ?
Pt1 Pt8 Pt7 59.51(9) . . ?
C4 Pt8 Ni6 109(2) . 2 ?
C3 Pt8 Ni6 106.2(19) . 2 ?
Pt5 Pt8 Ni6 90.74(12) . 2 ?
Pt4 Pt8 Ni6 58.67(10) . 2 ?
Pt1 Pt8 Ni6 59.25(9) . 2 ?
Pt7 Pt8 Ni6 108.05(11) . 2 ?
C4 Pt8 Pt6 109(2) . 2 ?
C3 Pt8 Pt6 106.2(19) . 2 ?
Pt5 Pt8 Pt6 90.74(12) . 2 ?
Pt4 Pt8 Pt6 58.67(10) . 2 ?
Pt1 Pt8 Pt6 59.25(9) . 2 ?
Pt7 Pt8 Pt6 108.05(11) . 2 ?
Ni6 Pt8 Pt6 0.0 2 2 ?
O1 C1 Pt6 175(10) . . ?
O2 C2 Pt3 139(3) . . ?
O2 C2 Pt6 136(3) . . ?
Pt3 C2 Pt6 84.2(7) . . ?
O3 C3 Pt8 130(3) . . ?
O3 C3 Pt5 139(3) . . ?
Pt8 C3 Pt5 83.0(7) . . ?
O4 C4 Pt8 170(6) . . ?
O5 C5 Pt4 179(6) . . ?
O6 C6 Pt7 176(6) . . ?
O7 C7 Pt2 143(3) . . ?
O7 C7 Pt7 133(3) . . ?
Pt2 C7 Pt7 83.7(7) . . ?
C109 N1 C109 102(5) 8_655 . ?
C109 N1 C101 117(4) 8_655 . ?
C109 N1 C101 117(4) . . ?
C109 N1 C105 111(3) 8_655 . ?
C109 N1 C105 111(3) . . ?
C101 N1 C105 98(5) . . ?
N1 C101 C102 117(5) . . ?
N1 C101 H10A 108.0 . . ?
C102 C101 H10A 108.0 . . ?
N1 C101 H10B 108.0 . . ?
C102 C101 H10B 108.0 . . ?
H10A C101 H10B 107.2 . . ?
C103 C102 C101 108(5) . . ?
C103 C102 H10C 110.1 . . ?
C101 C102 H10C 110.1 . . ?
C103 C102 H10D 110.1 . . ?
C101 C102 H10D 110.1 . . ?
H10C C102 H10D 108.4 . . ?
C104 C103 C102 106(6) . . ?
C104 C103 H10E 110.5 . . ?
C102 C103 H10E 110.5 . . ?
C104 C103 H10F 110.5 . . ?
C102 C103 H10F 110.5 . . ?
H10E C103 H10F 108.7 . . ?
C103 C104 H10G 109.5 . . ?
C103 C104 H10H 109.5 . . ?
H10G C104 H10H 109.5 . . ?
C103 C104 H10I 109.5 . . ?
H10G C104 H10I 109.5 . . ?
H10H C104 H10I 109.5 . . ?
N1 C105 C106 106.6(19) . . ?
N1 C105 H10J 110.4 . . ?
C106 C105 H10J 110.4 . . ?
N1 C105 H10K 110.4 . . ?
C106 C105 H10K 110.4 . . ?
H10J C105 H10K 108.6 . . ?
C105 C106 C107 111(5) . . ?
C105 C106 H10L 109.4 . . ?
C107 C106 H10L 109.4 . . ?
C105 C106 H10M 109.4 . . ?
C107 C106 H10M 109.4 . . ?
H10L C106 H10M 108.0 . . ?
C108 C107 C106 102.4(18) . . ?
C108 C107 H10N 111.3 . . ?
C106 C107 H10N 111.3 . . ?
C108 C107 H10O 111.3 . . ?
C106 C107 H10O 111.3 . . ?
H10N C107 H10O 109.2 . . ?
C107 C108 H10P 109.5 . . ?
C107 C108 H10Q 109.5 . . ?
H10P C108 H10Q 109.5 . . ?
C107 C108 H10R 109.5 . . ?
H10P C108 H10R 109.5 . . ?
H10Q C108 H10R 109.5 . . ?
N1 C109 C110 114(3) . . ?
N1 C109 H10S 108.8 . . ?
C110 C109 H10S 108.8 . . ?
N1 C109 H10T 108.8 . . ?
C110 C109 H10T 108.8 . . ?
H10S C109 H10T 107.7 . . ?
C109 C110 C111 107(4) . . ?
C109 C110 H11A 110.3 . . ?
C111 C110 H11A 110.3 . . ?
C109 C110 H11B 110.3 . . ?
C111 C110 H11B 110.3 . . ?
H11A C110 H11B 108.5 . . ?
C112 C111 C110 114(5) . . ?
C112 C111 H11C 108.7 . . ?
C110 C111 H11C 108.7 . . ?
C112 C111 H11D 108.7 . . ?
C110 C111 H11D 108.7 . . ?
H11C C111 H11D 107.6 . . ?
C111 C112 H11E 109.5 . . ?
C111 C112 H11F 109.5 . . ?
H11E C112 H11F 109.5 . . ?
C111 C112 H11G 109.5 . . ?
H11E C112 H11G 109.5 . . ?
H11F C112 H11G 109.5 . . ?
C209 N2 C205 116(7) . . ?
C209 N2 C205 116(7) . 8_655 ?
C205 N2 C205 106(2) . 8_655 ?
C209 N2 C201 103(8) . . ?
C205 N2 C201 108(8) . . ?
C205 N2 C201 108(8) 8_655 . ?
N2 C201 C202 122(10) . . ?
N2 C201 H20A 106.8 . . ?
C202 C201 H20A 106.8 . . ?
N2 C201 H20B 106.8 . . ?
C202 C201 H20B 106.8 . . ?
H20A C201 H20B 106.6 . . ?
C201 C202 C203 114(10) . . ?
C201 C202 H20C 108.7 . . ?
C203 C202 H20C 108.7 . . ?
C201 C202 H20D 108.7 . . ?
C203 C202 H20D 108.7 . . ?
H20C C202 H20D 107.6 . . ?
C204 C203 C202 115(9) . . ?
C204 C203 H20E 108.6 . . ?
C202 C203 H20E 108.6 . . ?
C204 C203 H20F 108.6 . . ?
C202 C203 H20F 108.6 . . ?
H20E C203 H20F 107.6 . . ?
C203 C204 H20G 109.5 . . ?
C203 C204 H20H 109.5 . . ?
H20G C204 H20H 109.5 . . ?
C203 C204 H20I 109.5 . . ?
H20G C204 H20I 109.5 . . ?
H20H C204 H20I 109.5 . . ?
N2 C205 C206 116(4) . . ?
N2 C205 H20J 108.2 . . ?
C206 C205 H20J 108.2 . . ?
N2 C205 H20K 108.2 . . ?
C206 C205 H20K 108.2 . . ?
H20J C205 H20K 107.3 . . ?
C205 C206 C207 108(6) . . ?
C205 C206 H20L 110.1 . . ?
C207 C206 H20L 110.1 . . ?
C205 C206 H20M 110.1 . . ?
C207 C206 H20M 110.1 . . ?
H20L C206 H20M 108.4 . . ?
C208 C207 C206 102.5(18) . . ?
C208 C207 H20N 111.3 . . ?
C206 C207 H20N 111.3 . . ?
C208 C207 H20O 111.3 . . ?
C206 C207 H20O 111.3 . . ?
H20N C207 H20O 109.2 . . ?
C207 C208 H20P 109.5 . . ?
C207 C208 H20Q 109.5 . . ?
H20P C208 H20Q 109.5 . . ?
C207 C208 H20R 109.5 . . ?
H20P C208 H20R 109.5 . . ?
H20Q C208 H20R 109.5 . . ?
N2 C209 C210 115(10) . . ?
N2 C209 H20S 108.6 . . ?
C210 C209 H20S 108.6 . . ?
N2 C209 H20T 108.6 . . ?
C210 C209 H20T 108.6 . . ?
H20S C209 H20T 107.6 . . ?
C209 C210 C211 125(7) . . ?
C209 C210 H21A 106.0 . . ?
C211 C210 H21A 106.0 . . ?
C209 C210 H21B 106.0 . . ?
C211 C210 H21B 106.0 . . ?
H21A C210 H21B 106.3 . . ?
C212 C211 C210 116(2) . . ?
C212 C211 H21C 108.2 . . ?
C210 C211 H21C 108.2 . . ?
C212 C211 H21D 108.2 . . ?
C210 C211 H21D 108.2 . . ?
H21C C211 H21D 107.3 . . ?
C211 C212 H21E 109.5 . . ?
C211 C212 H21F 109.5 . . ?
H21E C212 H21F 109.5 . . ?
C211 C212 H21G 109.5 . . ?
H21E C212 H21G 109.5 . . ?
H21F C212 H21G 109.5 . . ?
N301 C302 C303 172(10) . . ?
C302 C303 H30A 109.5 . . ?
C302 C303 H30B 109.5 . . ?
H30A C303 H30B 109.5 . . ?
C302 C303 H30C 109.5 . . ?
H30A C303 H30C 109.5 . . ?
H30B C303 H30C 109.5 . . ?
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 Pt1 2.624(4) 2 ?
Pt1 Pt4 2.650(3) . ?
Pt1 Ni8 2.744(3) ? ?
Pt1 Pt8 2.744(3) ? ?
Pt1 Pt8 2.744(3) . ?
Pt1 Ni6 2.752(4) 2 ?
Pt1 Pt6 2.752(4) 2 ?
Pt1 Ni7 2.754(3) 7_565 ?
Pt1 Pt7 2.754(3) 7_565 ?
Pt1 Pt7 2.754(3) . ?
Pt2 C7 1.995(19) 8_655 ?
Pt2 C7 1.995(19) . ?
Pt2 Pt7 2.664(2) . ?
Pt2 Ni7 2.664(2) 8_655 ?
Pt2 Pt7 2.664(2) 8_655 ?
Pt2 Pt1 2.764(3) 2 ?
Pt2 Pt2 2.857(5) 2 ?
Pt2 Pt5 2.869(4) . ?
Pt3 C2 2.00(2) . ?
Pt3 C2 2.00(2) 2 ?
Pt3 Ni6 2.683(4) 2 ?
Pt3 Pt6 2.683(4) 2 ?
Pt3 Pt6 2.683(4) . ?
Pt3 Pt1 2.768(4) 2 ?
Pt3 Pt5 2.863(3) . ?
Pt3 Pt5 2.863(3) 2 ?
Pt4 C5 1.793(18) . ?
Pt4 Ni6 2.719(5) 2 ?
Pt4 Pt6 2.719(5) 2 ?
Pt4 Ni7 2.719(3) 7_565 ?
Pt4 Pt7 2.719(3) 7_565 ?
Pt4 Pt7 2.719(3) . ?
Pt4 Ni8 2.726(3) ? ?
Pt4 Pt8 2.726(3) ? ?
Pt4 Pt8 2.726(3) . ?
Pt5 C3 2.008(19) . ?
Pt5 C3 2.008(19) 8_655 ?
Pt5 Ni8 2.659(3) 8_655 ?
Pt5 Pt8 2.659(3) 8_655 ?
Pt5 Pt8 2.659(3) . ?
Pt5 Pt1 2.770(3) 2 ?
Pt6 C1 1.80(2) . ?
Pt6 C2 2.00(2) . ?
Pt6 Pt4 2.719(5) 2 ?
Pt6 Pt1 2.752(4) 2 ?
Pt6 Ni8 2.821(3) 8_655 ?
Pt6 Pt8 2.821(3) 8_655 ?
Pt6 Pt8 2.821(3) 2 ?
Pt6 Ni8 2.821(3) 2 ?
Pt7 C6 1.798(19) . ?
Pt7 C7 1.998(19) . ?
Pt7 Pt8 2.804(4) . ?
Pt7 Ni7 2.816(5) 7_565 ?
Pt7 Pt7 2.816(5) 7_565 ?
Pt8 C4 1.804(19) . ?
Pt8 C3 2.005(19) . ?
Pt8 Ni6 2.821(3) 2 ?
Pt8 Pt6 2.821(3) 2 ?
C1 O1 1.15(2) . ?
C2 O2 1.15(2) . ?
C3 O3 1.159(19) . ?
C4 O4 1.157(19) . ?
C5 O5 1.136(18) . ?
C6 O6 1.155(19) . ?
C7 O7 1.147(19) . ?
N1 C109 1.47(2) 8_655 ?
N1 C109 1.47(2) . ?
N1 C101 1.47(2) . ?
N1 C105 1.47(2) . ?
C101 C102 1.53(2) . ?
C101 H10A 0.9900 . ?
C101 H10B 0.9900 . ?
C102 C103 1.53(2) . ?
C102 H10C 0.9900 . ?
C102 H10D 0.9900 . ?
C103 C104 1.53(2) . ?
C103 H10E 0.9900 . ?
C103 H10F 0.9900 . ?
C104 H10G 0.9800 . ?
C104 H10H 0.9800 . ?
C104 H10I 0.9800 . ?
C105 C106 1.52(2) . ?
C105 H10J 0.9900 . ?
C105 H10K 0.9900 . ?
C106 C107 1.53(2) . ?
C106 H10L 0.9900 . ?
C106 H10M 0.9900 . ?
C107 C108 1.53(2) . ?
C107 H10N 0.9900 . ?
C107 H10O 0.9900 . ?
C108 H10P 0.9800 . ?
C108 H10Q 0.9800 . ?
C108 H10R 0.9800 . ?
C109 C110 1.52(2) . ?
C109 H10S 0.9900 . ?
C109 H10T 0.9900 . ?
C110 C111 1.53(2) . ?
C110 H11A 0.9900 . ?
C110 H11B 0.9900 . ?
C111 C112 1.52(2) . ?
C111 H11C 0.9900 . ?
C111 H11D 0.9900 . ?
C112 H11E 0.9800 . ?
C112 H11F 0.9800 . ?
C112 H11G 0.9800 . ?
N2 C209 1.47(2) . ?
N2 C205 1.47(2) . ?
N2 C205 1.47(2) 8_655 ?
N2 C201 1.47(2) . ?
C201 C202 1.52(2) . ?
C201 H20A 0.9900 . ?
C201 H20B 0.9900 . ?
C202 C203 1.53(2) . ?
C202 H20C 0.9900 . ?
C202 H20D 0.9900 . ?
C203 C204 1.52(2) . ?
C203 H20E 0.9900 . ?
C203 H20F 0.9900 . ?
C204 H20G 0.9800 . ?
C204 H20H 0.9800 . ?
C204 H20I 0.9800 . ?
C205 C206 1.52(2) . ?
C205 H20J 0.9900 . ?
C205 H20K 0.9900 . ?
C206 C207 1.54(2) . ?
C206 H20L 0.9900 . ?
C206 H20M 0.9900 . ?
C207 C208 1.53(2) . ?
C207 H20N 0.9900 . ?
C207 H20O 0.9900 . ?
C208 H20P 0.9800 . ?
C208 H20Q 0.9800 . ?
C208 H20R 0.9800 . ?
C209 C210 1.53(2) . ?
C209 H20S 0.9900 . ?
C209 H20T 0.9900 . ?
C210 C211 1.53(2) . ?
C210 H21A 0.9900 . ?
C210 H21B 0.9900 . ?
C211 C212 1.53(2) . ?
C211 H21C 0.9900 . ?
C211 H21D 0.9900 . ?
C212 H21E 0.9800 . ?
C212 H21F 0.9800 . ?
C212 H21G 0.9800 . ?
N301 C302 1.14(2) . ?
C302 C303 1.49(2) . ?
C303 H30A 0.9800 . ?
C303 H30B 0.9800 . ?
C303 H30C 0.9800 . ?
