#------------------------------------------------------------------------------
#$Date: 2016-03-25 12:11:15 +0100 (vie 25 de mar de 2016) $
#$Revision: 179830 $
#$URL: svn://www.crystallography.net/cod/cif/7/01/26/7012637.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_7012637
loop_
_publ_author_name
'Failes, Timothy W.'
'Hall, Matthew D.'
'Hambley, Trevor W.'
_publ_section_title
;
 The first examples of platinum amine hydroxamate complexes: structures
 and biological activity
;
_journal_issue                   8
_journal_name_full               'Dalton Transactions'
_journal_page_first              1596
_journal_paper_doi               10.1039/b212553f
_journal_year                    2003
_chemical_formula_moiety         '[{Pt(R,R-chxn)}2-u-(bha-H)]NO3'
_chemical_formula_sum            'C19 H36 N6 O7 Pt2'
_chemical_formula_weight         850.70
_chemical_name_systematic
;
?
;
_space_group_IT_number           4
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  'P 2yb'
_symmetry_space_group_name_H-M   'P 1 21 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 99.141(6)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   7.704(3)
_cell_length_b                   23.505(8)
_cell_length_c                   15.251(5)
_cell_measurement_temperature    150(2)
_cell_volume                     2726.6(17)
_computing_cell_refinement       SMART
_computing_data_collection       SMART
_computing_data_reduction        SAINT
_computing_molecular_graphics    WINGX
_computing_publication_material  ORTEP
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    SHELXS-97
_diffrn_ambient_temperature      150(2)
_diffrn_measured_fraction_theta_full 0.949
_diffrn_measured_fraction_theta_max 0.949
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0563
_diffrn_reflns_av_sigmaI/netI    0.0542
_diffrn_reflns_limit_h_max       9
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_k_max       31
_diffrn_reflns_limit_k_min       -31
_diffrn_reflns_limit_l_max       20
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_number            24663
_diffrn_reflns_theta_full        28.31
_diffrn_reflns_theta_max         28.31
_diffrn_reflns_theta_min         1.35
_exptl_absorpt_coefficient_mu    10.296
_exptl_absorpt_correction_T_max  0.2326
_exptl_absorpt_correction_T_min  0.1045
_exptl_absorpt_correction_type   semi-empirical
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    2.062
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             1600
_exptl_crystal_size_max          0.4
_exptl_crystal_size_mid          0.3
_exptl_crystal_size_min          0.2
_refine_diff_density_max         4.890
_refine_diff_density_min         -1.452
_refine_diff_density_rms         0.265
_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   0.44(6)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.079
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     614
_refine_ls_number_reflns         6601
_refine_ls_number_restraints     97
_refine_ls_restrained_S_all      1.081
_refine_ls_R_factor_all          0.0860
_refine_ls_R_factor_gt           0.0563
_refine_ls_shift/su_max          0.056
_refine_ls_shift/su_mean         0.002
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0808P)²+21.2894P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1383
_refine_ls_wR_factor_ref         0.1587
_reflns_number_gt                5062
_reflns_number_total             6601
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b212553f.txt
_cod_data_source_block           twf32
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_cell_volume        2726.7(15)
_cod_original_sg_symbol_H-M      P2(1)
_cod_database_code               7012637
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C 0.277(3) 0.1626(10) 0.0794(15) 0.040(5) Uani 1 1 d . . .
C2 C 0.247(3) 0.1077(10) 0.029(2) 0.052(6) Uani 1 1 d . . .
C3 C 0.256(3) 0.0606(11) 0.0843(15) 0.044(5) Uani 1 1 d U . .
C4 C 0.230(4) 0.0080(11) 0.0392(17) 0.057(6) Uani 1 1 d . . .
H4 H 0.2315 -0.0252 0.0727 0.068 Uiso 1 1 calc R . .
C5 C 0.203(5) 0.0035(11) -0.0504(19) 0.072(9) Uani 1 1 d . . .
H5 H 0.1972 -0.0323 -0.0767 0.086 Uiso 1 1 calc R . .
C6 C 0.184(4) 0.0514(13) -0.103(2) 0.066(7) Uani 1 1 d . . .
H6 H 0.1521 0.0482 -0.1645 0.079 Uiso 1 1 calc R . .
C7 C 0.213(3) 0.1061(10) -0.0622(15) 0.044(5) Uani 1 1 d . . .
H7 H 0.2091 0.1392 -0.0959 0.053 Uiso 1 1 calc R . .
C8 C 0.367(4) 0.3916(10) 0.1038(19) 0.057(7) Uani 1 1 d . . .
H8 H 0.4951 0.3898 0.1178 0.069 Uiso 1 1 calc R . .
C9 C 0.292(4) 0.3893(10) 0.186(2) 0.062(7) Uani 1 1 d . . .
H9 H 0.1635 0.3915 0.1730 0.075 Uiso 1 1 calc R . .
C10 C 0.367(7) 0.4384(18) 0.259(3) 0.121(15) Uani 1 1 d U . .
H10A H 0.4936 0.4369 0.2744 0.145 Uiso 1 1 calc R . .
H10B H 0.3137 0.4357 0.3123 0.145 Uiso 1 1 calc R . .
C11 C 0.301(5) 0.4959(13) 0.201(3) 0.097(12) Uani 1 1 d . . .
H11A H 0.1744 0.4955 0.1854 0.117 Uiso 1 1 calc R . .
H11B H 0.3343 0.5294 0.2370 0.117 Uiso 1 1 calc R . .
C12 C 0.384(6) 0.4990(14) 0.117(3) 0.099(12) Uani 1 1 d U . .
H12A H 0.5110 0.4965 0.1309 0.119 Uiso 1 1 calc R . .
H12B H 0.3536 0.5346 0.0859 0.119 Uiso 1 1 calc R . .
C13 C 0.311(5) 0.4485(14) 0.058(3) 0.088(10) Uani 1 1 d . . .
H13A H 0.3545 0.4505 0.0016 0.106 Uiso 1 1 calc R . .
H13B H 0.1837 0.4508 0.0457 0.106 Uiso 1 1 calc R . .
C14 C 0.251(3) -0.0053(12) 0.3541(17) 0.056(7) Uani 1 1 d . . .
H14 H 0.1277 0.0053 0.3540 0.068 Uiso 1 1 calc R . .
C15 C 0.365(3) 0.0379(12) 0.4029(17) 0.056(7) Uani 1 1 d . . .
H15 H 0.4873 0.0268 0.4012 0.067 Uiso 1 1 calc R . .
C16 C 0.342(3) 0.0415(14) 0.4966(18) 0.066(8) Uani 1 1 d . . .
H16A H 0.2238 0.0541 0.5003 0.079 Uiso 1 1 calc R . .
H16B H 0.4237 0.0693 0.5269 0.079 Uiso 1 1 calc R . .
C17 C 0.375(4) -0.0169(17) 0.543(2) 0.079(9) Uani 1 1 d U . .
H17A H 0.3490 -0.0146 0.6025 0.095 Uiso 1 1 calc R . .
H17B H 0.4984 -0.0271 0.5461 0.095 Uiso 1 1 calc R . .
C18 C 0.257(5) -0.0640(13) 0.489(2) 0.079(10) Uani 1 1 d . . .
H18A H 0.2865 -0.1008 0.5165 0.095 Uiso 1 1 calc R . .
H18B H 0.1348 -0.0562 0.4921 0.095 Uiso 1 1 calc R . .
C19 C 0.284(4) -0.0657(12) 0.395(2) 0.068(8) Uani 1 1 d . . .
H19A H 0.2032 -0.0927 0.3622 0.082 Uiso 1 1 calc R . .
H19B H 0.4030 -0.0778 0.3913 0.082 Uiso 1 1 calc R . .
C20 C 0.209(3) 0.4662(9) 0.5818(16) 0.040(5) Uani 1 1 d . . .
C21 C 0.163(3) 0.5153(9) 0.5218(14) 0.038(4) Uani 1 1 d . . .
C22 C 0.174(3) 0.5691(13) 0.5675(19) 0.062(7) Uani 1 1 d . . .
C23 C 0.139(4) 0.6172(13) 0.511(3) 0.077(9) Uani 1 1 d . . .
H23 H 0.1425 0.6533 0.5364 0.092 Uiso 1 1 calc R . .
C24 C 0.099(4) 0.6119(12) 0.422(2) 0.062(7) Uani 1 1 d . . .
H24 H 0.0749 0.6443 0.3867 0.074 Uiso 1 1 calc R . .
C25 C 0.096(4) 0.5588(15) 0.381(2) 0.076(8) Uani 1 1 d . . .
H25 H 0.0721 0.5570 0.3194 0.092 Uiso 1 1 calc R . .
C26 C 0.125(4) 0.5088(13) 0.428(2) 0.070(8) Uani 1 1 d . . .
H26 H 0.1198 0.4735 0.4005 0.084 Uiso 1 1 calc R . .
C27 C 0.315(5) 0.2394(17) 0.661(2) 0.085(10) Uani 1 1 d U . .
H27 H 0.2010 0.2315 0.6797 0.102 Uiso 1 1 calc R . .
C28 C 0.443(5) 0.2604(11) 0.7372(17) 0.081(10) Uani 1 1 d U . .
H28 H 0.5537 0.2672 0.7154 0.097 Uiso 1 1 calc R . .
C29 C 0.475(6) 0.2158(12) 0.806(2) 0.086(10) Uani 1 1 d . . .
H29A H 0.3756 0.2146 0.8381 0.104 Uiso 1 1 calc R . .
H29B H 0.5777 0.2265 0.8486 0.104 Uiso 1 1 calc R . .
C30 C 0.505(7) 0.157(2) 0.772(3) 0.123(15) Uani 1 1 d U . .
H30A H 0.6179 0.1559 0.7518 0.148 Uiso 1 1 calc R . .
H30B H 0.5098 0.1299 0.8207 0.148 Uiso 1 1 calc R . .
C31 C 0.371(6) 0.1370(16) 0.699(3) 0.101(12) Uani 1 1 d U . .
H31A H 0.2552 0.1368 0.7165 0.121 Uiso 1 1 calc R . .
H31B H 0.3979 0.0992 0.6797 0.121 Uiso 1 1 calc R . .
C32 C 0.385(7) 0.1863(15) 0.619(3) 0.103(12) Uani 1 1 d U . .
H32A H 0.5053 0.1916 0.6094 0.124 Uiso 1 1 calc R . .
H32B H 0.3119 0.1763 0.5636 0.124 Uiso 1 1 calc R . .
C33 C 0.252(3) 0.6599(12) 0.820(2) 0.063(7) Uani 1 1 d . . .
H33 H 0.3807 0.6578 0.8281 0.075 Uiso 1 1 calc R . .
C34 C 0.180(3) 0.6075(12) 0.871(2) 0.059(7) Uani 1 1 d . . .
H34 H 0.0517 0.6067 0.8568 0.070 Uiso 1 1 calc R . .
C35 C 0.235(4) 0.6173(16) 0.975(3) 0.085(11) Uani 1 1 d . . .
H35A H 0.1786 0.5885 1.0062 0.102 Uiso 1 1 calc R . .
H35B H 0.3608 0.6126 0.9903 0.102 Uiso 1 1 calc R . .
C36 C 0.182(4) 0.6774(15) 1.005(3) 0.084(11) Uani 1 1 d . . .
H36A H 0.0554 0.6791 1.0019 0.101 Uiso 1 1 calc R . .
H36B H 0.2346 0.6831 1.0667 0.101 Uiso 1 1 calc R . .
C37 C 0.241(5) 0.7254(14) 0.949(3) 0.094(11) Uani 1 1 d U . .
H37A H 0.3663 0.7310 0.9667 0.113 Uiso 1 1 calc R . .
H37B H 0.1828 0.7601 0.9624 0.113 Uiso 1 1 calc R . .
C38 C 0.203(4) 0.7160(15) 0.842(2) 0.083(10) Uani 1 1 d . . .
H38A H 0.0790 0.7219 0.8206 0.099 Uiso 1 1 calc R . .
H38B H 0.2691 0.7437 0.8138 0.099 Uiso 1 1 calc R . .
N1 N 0.290(3) 0.1552(8) 0.1645(13) 0.046(5) Uani 1 1 d . . .
N2 N 0.301(3) 0.3414(9) 0.0531(15) 0.053(5) Uani 1 1 d . . .
H2A H 0.3685 0.3346 0.0110 0.064 Uiso 1 1 calc R . .
H2B H 0.1906 0.3477 0.0258 0.064 Uiso 1 1 calc R . .
N3 N 0.345(4) 0.3342(12) 0.2307(19) 0.078(8) Uani 1 1 d . . .
H3A H 0.2800 0.3268 0.2732 0.094 Uiso 1 1 calc R . .
H3B H 0.4594 0.3353 0.2557 0.094 Uiso 1 1 calc R . .
N4 N 0.288(3) -0.0052(9) 0.2592(16) 0.059(6) Uani 1 1 d . . .
H4A H 0.2039 -0.0247 0.2240 0.070 Uiso 1 1 calc R . .
H4B H 0.3921 -0.0224 0.2571 0.070 Uiso 1 1 calc R . .
N5 N 0.332(3) 0.0929(10) 0.3545(12) 0.054(5) Uani 1 1 d . . .
H5A H 0.4238 0.1165 0.3700 0.064 Uiso 1 1 calc R . .
H5B H 0.2354 0.1095 0.3691 0.064 Uiso 1 1 calc R . .
N6 N 0.767(3) 0.3560(12) 0.938(3) 0.106(13) Uani 1 1 d . . .
N7 N 0.243(2) 0.4797(8) 0.6651(13) 0.040(4) Uani 1 1 d . . .
N8 N 0.301(5) 0.2909(11) 0.5954(17) 0.101(11) Uani 1 1 d U . .
H8A H 0.2015 0.2878 0.5556 0.121 Uiso 1 1 calc R . .
H8B H 0.3926 0.2905 0.5657 0.121 Uiso 1 1 calc R . .
N9 N 0.383(4) 0.3160(9) 0.7688(15) 0.075(8) Uani 1 1 d . . .
H9A H 0.4719 0.3335 0.8038 0.090 Uiso 1 1 calc R . .
H9B H 0.2949 0.3105 0.8005 0.090 Uiso 1 1 calc R . .
N10 N 0.186(4) 0.6486(10) 0.729(2) 0.085(9) Uani 1 1 d . . .
H10C H 0.2426 0.6706 0.6941 0.102 Uiso 1 1 calc R . .
H10D H 0.0708 0.6577 0.7175 0.102 Uiso 1 1 calc R . .
N11 N 0.247(3) 0.5571(10) 0.8386(15) 0.060(6) Uani 1 1 d . . .
H11C H 0.1883 0.5268 0.8545 0.072 Uiso 1 1 calc R . .
H11D H 0.3616 0.5531 0.8617 0.072 Uiso 1 1 calc R . .
N12 N 0.163(8) 0.7771(16) 0.490(4) 0.167(19) Uani 1 1 d U . .
O1 O 0.318(3) 0.2062(8) 0.2165(11) 0.056(5) Uani 1 1 d . . .
O2 O 0.2760(19) 0.2120(7) 0.0396(10) 0.042(3) Uani 1 1 d . . .
O1W O 0.046(3) 0.4431(10) 0.8348(13) 0.069(5) Uani 1 1 d . . .
O3 O 0.613(3) 0.3625(11) 0.9598(18) 0.093(7) Uani 1 1 d . . .
O2W O 0.118(3) 0.2788(10) 0.8797(14) 0.078(6) Uani 1 1 d . . .
O4 O 0.783(4) 0.334(2) 0.8571(19) 0.149(17) Uani 1 1 d . . .
O3W O 0.127(4) 0.2047(11) 0.3610(19) 0.105(9) Uani 1 1 d . . .
O5 O 0.896(3) 0.3658(10) 0.992(2) 0.119(11) Uani 1 1 d . . .
O4W O 0.545(7) 0.2052(18) 0.360(2) 0.21(3) Uani 1 1 d . . .
O6 O 0.300(2) 0.4392(7) 0.7263(10) 0.046(4) Uani 1 1 d . . .
O7 O 0.219(2) 0.4130(8) 0.5556(11) 0.052(4) Uani 1 1 d . . .
O10 O 0.376(4) 0.7817(13) 0.503(2) 0.131(11) Uani 1 1 d U . .
O11 O 0.093(8) 0.793(5) 0.536(6) 0.36(5) Uani 1 1 d U . .
O12 O 0.160(6) 0.772(2) 0.398(4) 0.184(17) Uani 1 1 d U . .
Pt1 Pt 0.29609(12) 0.07730(3) 0.21441(6) 0.0462(2) Uani 1 1 d . . .
Pt2 Pt 0.30578(12) 0.27314(4) 0.13292(6) 0.0476(2) Uani 1 1 d . . .
Pt3 Pt 0.21812(11) 0.56233(3) 0.69723(6) 0.0486(2) Uani 1 1 d . . .
Pt4 Pt 0.29772(14) 0.36445(4) 0.66173(6) 0.0538(3) Uani 1 1 d . . .
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'
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
N1 C1 O2 125(2) . . ?
N1 C1 C2 112(2) . . ?
O2 C1 C2 122(2) . . ?
C7 C2 C3 126(2) . . ?
C7 C2 C1 122(2) . . ?
C3 C2 C1 112(2) . . ?
C2 C3 C4 114(2) . . ?
C2 C3 Pt1 115.8(17) . . ?
C4 C3 Pt1 130.0(19) . . ?
C5 C4 C3 123(2) . . ?
C4 C5 C6 121(3) . . ?
C5 C6 C7 119(3) . . ?
C2 C7 C6 117(2) . . ?
N2 C8 C9 106(2) . . ?
N2 C8 C13 114(2) . . ?
C9 C8 C13 108(2) . . ?
C8 C9 N3 108(2) . . ?
C8 C9 C10 114(3) . . ?
N3 C9 C10 105(3) . . ?
C9 C10 C11 100(3) . . ?
C12 C11 C10 111(3) . . ?
C11 C12 C13 107(3) . . ?
C12 C13 C8 111(3) . . ?
C15 C14 N4 107(2) . . ?
C15 C14 C19 112(2) . . ?
N4 C14 C19 110(2) . . ?
C14 C15 C16 112(2) . . ?
C14 C15 N5 108(2) . . ?
C16 C15 N5 113(2) . . ?
C15 C16 C17 111(3) . . ?
C16 C17 C18 111(2) . . ?
C19 C18 C17 111(3) . . ?
C18 C19 C14 109(3) . . ?
N7 C20 O7 121(2) . . ?
N7 C20 C21 114.0(19) . . ?
O7 C20 C21 125(2) . . ?
C26 C21 C22 124(2) . . ?
C26 C21 C20 122(2) . . ?
C22 C21 C20 113(2) . . ?
C23 C22 C21 115(3) . . ?
C23 C22 Pt3 131(3) . . ?
C21 C22 Pt3 113.8(18) . . ?
C24 C23 C22 122(3) . . ?
C23 C24 C25 121(3) . . ?
C26 C25 C24 123(3) . . ?
C25 C26 C21 115(3) . . ?
C28 C27 C32 111(3) . . ?
C28 C27 N8 102(3) . . ?
C32 C27 N8 111(3) . . ?
C27 C28 C29 110(3) . . ?
C27 C28 N9 110(3) . . ?
C29 C28 N9 115(2) . . ?
C28 C29 C30 115(3) . . ?
C31 C30 C29 115(4) . . ?
C30 C31 C32 102(3) . . ?
C27 C32 C31 101(3) . . ?
N10 C33 C38 110(3) . . ?
N10 C33 C34 104(2) . . ?
C38 C33 C34 118(3) . . ?
N11 C34 C35 115(3) . . ?
N11 C34 C33 107(2) . . ?
C35 C34 C33 108(2) . . ?
C36 C35 C34 113(3) . . ?
C37 C36 C35 113(3) . . ?
C36 C37 C38 116(3) . . ?
C33 C38 C37 111(3) . . ?
C1 N1 O1 114.9(18) . . ?
C1 N1 Pt1 120.2(15) . . ?
O1 N1 Pt1 124.6(14) . . ?
C8 N2 Pt2 110.7(17) . . ?
C9 N3 Pt2 106.3(18) . . ?
C14 N4 Pt1 109.7(16) . . ?
C15 N5 Pt1 109.3(16) . . ?
O5 N6 O3 119(4) . . ?
O5 N6 O4 121(3) . . ?
O3 N6 O4 120(3) . . ?
C20 N7 O6 119.8(18) . . ?
C20 N7 Pt3 117.5(15) . . ?
O6 N7 Pt3 122.7(14) . . ?
C27 N8 Pt4 110.4(19) . . ?
C28 N9 Pt4 108.1(16) . . ?
C33 N10 Pt3 111.3(19) . . ?
C34 N11 Pt3 109(2) . . ?
O11 N12 O12 142(7) . . ?
O11 N12 O10 122(6) . . ?
O12 N12 O10 89(5) . . ?
N1 O1 Pt2 108.4(12) . . ?
C1 O2 Pt2 108.2(14) . . ?
N7 O6 Pt4 107.4(12) . . ?
C20 O7 Pt4 108.8(14) . . ?
N1 Pt1 C3 79.0(9) . . ?
N1 Pt1 N4 176.0(10) . . ?
C3 Pt1 N4 97.8(10) . . ?
N1 Pt1 N5 102.5(8) . . ?
C3 Pt1 N5 177.9(9) . . ?
N4 Pt1 N5 80.6(9) . . ?
O2 Pt2 N2 98.8(7) . . ?
O2 Pt2 O1 83.0(7) . . ?
N2 Pt2 O1 177.8(9) . . ?
O2 Pt2 N3 177.7(10) . . ?
N2 Pt2 N3 82.4(11) . . ?
O1 Pt2 N3 95.8(9) . . ?
C22 Pt3 N7 80.9(10) . . ?
C22 Pt3 N10 98.2(12) . . ?
N7 Pt3 N10 178.6(9) . . ?
C22 Pt3 N11 175.8(9) . . ?
N7 Pt3 N11 101.0(9) . . ?
N10 Pt3 N11 79.8(11) . . ?
O7 Pt4 N8 96.3(10) . . ?
O7 Pt4 N9 178.7(10) . . ?
N8 Pt4 N9 83.9(11) . . ?
O7 Pt4 O6 82.8(7) . . ?
N8 Pt4 O6 178.4(12) . . ?
N9 Pt4 O6 96.9(8) . . ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
C1 N1 1.30(3) . ?
C1 O2 1.31(3) . ?
C1 C2 1.51(3) . ?
C2 C7 1.37(4) . ?
C2 C3 1.39(4) . ?
C3 C4 1.41(4) . ?
C3 Pt1 2.00(2) . ?
C4 C5 1.35(4) . ?
C5 C6 1.38(4) . ?
C6 C7 1.43(4) . ?
C8 N2 1.46(3) . ?
C8 C9 1.47(4) . ?
C8 C13 1.54(4) . ?
C9 N3 1.49(4) . ?
C9 C10 1.64(5) . ?
C10 C11 1.65(6) . ?
C11 C12 1.53(5) . ?
C12 C13 1.54(5) . ?
C14 C15 1.47(4) . ?
C14 N4 1.52(3) . ?
C14 C19 1.56(3) . ?
C15 C16 1.47(4) . ?
C15 N5 1.49(3) . ?
C16 C17 1.54(4) . ?
C17 C18 1.57(5) . ?
C18 C19 1.49(4) . ?
C20 N7 1.30(3) . ?
C20 O7 1.32(3) . ?
C20 C21 1.48(3) . ?
C21 C26 1.42(4) . ?
C21 C22 1.44(4) . ?
C22 C23 1.42(4) . ?
C22 Pt3 1.96(3) . ?
C23 C24 1.36(5) . ?
C24 C25 1.39(4) . ?
C25 C26 1.38(4) . ?
C27 C28 1.48(5) . ?
C27 C32 1.54(5) . ?
C27 N8 1.57(5) . ?
C28 C29 1.48(4) . ?
C28 N9 1.49(3) . ?
C29 C30 1.52(5) . ?
C30 C31 1.46(6) . ?
C31 C32 1.70(6) . ?
C33 N10 1.43(4) . ?
C33 C38 1.43(4) . ?
C33 C34 1.60(4) . ?
C34 N11 1.41(3) . ?
C34 C35 1.59(5) . ?
C35 C36 1.56(4) . ?
C36 C37 1.53(5) . ?
C37 C38 1.62(6) . ?
N1 O1 1.43(3) . ?
N1 Pt1 1.98(2) . ?
N2 Pt2 2.01(2) . ?
N3 Pt2 2.06(3) . ?
N4 Pt1 2.06(2) . ?
N5 Pt1 2.142(19) . ?
N6 O5 1.21(4) . ?
N6 O3 1.29(3) . ?
N6 O4 1.36(5) . ?
N7 O6 1.36(2) . ?
N7 Pt3 2.020(19) . ?
N8 Pt4 2.00(2) . ?
N9 Pt4 2.01(2) . ?
N10 Pt3 2.11(2) . ?
N11 Pt3 2.14(2) . ?
N12 O11 1.02(8) . ?
N12 O12 1.40(7) . ?
N12 O10 1.62(7) . ?
O1 Pt2 2.018(18) . ?
O2 Pt2 2.010(16) . ?
O6 Pt4 2.014(17) . ?
O7 Pt4 1.994(19) . ?
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
N1 C1 C2 C7 174(2) . . . . ?
O2 C1 C2 C7 -2(3) . . . . ?
N1 C1 C2 C3 -5(3) . . . . ?
O2 C1 C2 C3 179(2) . . . . ?
C7 C2 C3 C4 1(3) . . . . ?
C1 C2 C3 C4 -180(2) . . . . ?
C7 C2 C3 Pt1 -177.1(19) . . . . ?
C1 C2 C3 Pt1 2(2) . . . . ?
C2 C3 C4 C5 2(4) . . . . ?
Pt1 C3 C4 C5 179(2) . . . . ?
C3 C4 C5 C6 -6(5) . . . . ?
C4 C5 C6 C7 7(5) . . . . ?
C3 C2 C7 C6 0(4) . . . . ?
C1 C2 C7 C6 -179(2) . . . . ?
C5 C6 C7 C2 -4(4) . . . . ?
N2 C8 C9 N3 57(3) . . . . ?
C13 C8 C9 N3 180(3) . . . . ?
N2 C8 C9 C10 173(3) . . . . ?
C13 C8 C9 C10 -63(4) . . . . ?
C8 C9 C10 C11 61(4) . . . . ?
N3 C9 C10 C11 179(3) . . . . ?
C9 C10 C11 C12 -61(4) . . . . ?
C10 C11 C12 C13 65(4) . . . . ?
C11 C12 C13 C8 -63(4) . . . . ?
N2 C8 C13 C12 179(3) . . . . ?
C9 C8 C13 C12 62(4) . . . . ?
N4 C14 C15 C16 -179.4(19) . . . . ?
C19 C14 C15 C16 -59(3) . . . . ?
N4 C14 C15 N5 55(2) . . . . ?
C19 C14 C15 N5 175.8(19) . . . . ?
C14 C15 C16 C17 57(3) . . . . ?
N5 C15 C16 C17 179(2) . . . . ?
C15 C16 C17 C18 -54(3) . . . . ?
C16 C17 C18 C19 55(3) . . . . ?
C17 C18 C19 C14 -55(3) . . . . ?
C15 C14 C19 C18 58(3) . . . . ?
N4 C14 C19 C18 176(3) . . . . ?
N7 C20 C21 C26 179(2) . . . . ?
O7 C20 C21 C26 0(3) . . . . ?
N7 C20 C21 C22 3(3) . . . . ?
O7 C20 C21 C22 -176.0(19) . . . . ?
C26 C21 C22 C23 1(3) . . . . ?
C20 C21 C22 C23 177(2) . . . . ?
C26 C21 C22 Pt3 177.2(19) . . . . ?
C20 C21 C22 Pt3 -7(2) . . . . ?
C21 C22 C23 C24 0(4) . . . . ?
Pt3 C22 C23 C24 -175(2) . . . . ?
C22 C23 C24 C25 -1(5) . . . . ?
C23 C24 C25 C26 2(5) . . . . ?
C24 C25 C26 C21 -1(4) . . . . ?
C22 C21 C26 C25 0(4) . . . . ?
C20 C21 C26 C25 -176(2) . . . . ?
C32 C27 C28 C29 -61(4) . . . . ?
N8 C27 C28 C29 -179(3) . . . . ?
C32 C27 C28 N9 172(3) . . . . ?
N8 C27 C28 N9 54(3) . . . . ?
C27 C28 C29 C30 45(5) . . . . ?
N9 C28 C29 C30 170(4) . . . . ?
C28 C29 C30 C31 -51(6) . . . . ?
C29 C30 C31 C32 60(5) . . . . ?
C28 C27 C32 C31 71(4) . . . . ?
N8 C27 C32 C31 -176(3) . . . . ?
C30 C31 C32 C27 -68(4) . . . . ?
N10 C33 C34 N11 59(3) . . . . ?
C38 C33 C34 N11 -179(2) . . . . ?
N10 C33 C34 C35 -176(2) . . . . ?
C38 C33 C34 C35 -55(3) . . . . ?
N11 C34 C35 C36 171(2) . . . . ?
C33 C34 C35 C36 51(3) . . . . ?
C34 C35 C36 C37 -50(3) . . . . ?
C35 C36 C37 C38 46(4) . . . . ?
N10 C33 C38 C37 168(3) . . . . ?
C34 C33 C38 C37 50(3) . . . . ?
C36 C37 C38 C33 -45(4) . . . . ?
O2 C1 N1 O1 -4(3) . . . . ?
C2 C1 N1 O1 -179.5(18) . . . . ?
O2 C1 N1 Pt1 -178.2(16) . . . . ?
C2 C1 N1 Pt1 6(2) . . . . ?
C9 C8 N2 Pt2 -41(3) . . . . ?
C13 C8 N2 Pt2 -160(2) . . . . ?
C8 C9 N3 Pt2 -45(3) . . . . ?
C10 C9 N3 Pt2 -167(2) . . . . ?
C15 C14 N4 Pt1 -46(2) . . . . ?
C19 C14 N4 Pt1 -168.0(18) . . . . ?
C14 C15 N5 Pt1 -39(2) . . . . ?
C16 C15 N5 Pt1 -163.8(18) . . . . ?
O7 C20 N7 O6 4(3) . . . . ?
C21 C20 N7 O6 -175.1(16) . . . . ?
O7 C20 N7 Pt3 -178.7(14) . . . . ?
C21 C20 N7 Pt3 3(2) . . . . ?
C28 C27 N8 Pt4 -40(3) . . . . ?
C32 C27 N8 Pt4 -159(3) . . . . ?
C27 C28 N9 Pt4 -44(3) . . . . ?
C29 C28 N9 Pt4 -168(3) . . . . ?
C38 C33 N10 Pt3 -171(2) . . . . ?
C34 C33 N10 Pt3 -44(3) . . . . ?
C35 C34 N11 Pt3 -165.3(18) . . . . ?
C33 C34 N11 Pt3 -45(2) . . . . ?
C1 N1 O1 Pt2 4(2) . . . . ?
Pt1 N1 O1 Pt2 178.1(11) . . . . ?
N1 C1 O2 Pt2 2(3) . . . . ?
C2 C1 O2 Pt2 176.4(16) . . . . ?
C20 N7 O6 Pt4 -4(2) . . . . ?
Pt3 N7 O6 Pt4 179.0(8) . . . . ?
N7 C20 O7 Pt4 -2(2) . . . . ?
C21 C20 O7 Pt4 177.0(15) . . . . ?
C1 N1 Pt1 C3 -4.2(17) . . . . ?
O1 N1 Pt1 C3 -177.6(19) . . . . ?
C1 N1 Pt1 N4 -42(13) . . . . ?
O1 N1 Pt1 N4 144(11) . . . . ?
C1 N1 Pt1 N5 177.3(17) . . . . ?
O1 N1 Pt1 N5 3.8(19) . . . . ?
C2 C3 Pt1 N1 0.6(17) . . . . ?
C4 C3 Pt1 N1 -177(2) . . . . ?
C2 C3 Pt1 N4 178.1(17) . . . . ?
C4 C3 Pt1 N4 0(2) . . . . ?
C2 C3 Pt1 N5 139(25) . . . . ?
C4 C3 Pt1 N5 -39(26) . . . . ?
C14 N4 Pt1 N1 -122(12) . . . . ?
C14 N4 Pt1 C3 -160.0(17) . . . . ?
C14 N4 Pt1 N5 18.6(16) . . . . ?
C15 N5 Pt1 N1 -171.9(16) . . . . ?
C15 N5 Pt1 C3 50(26) . . . . ?
C15 N5 Pt1 N4 10.7(16) . . . . ?
C1 O2 Pt2 N2 179.6(14) . . . . ?
C1 O2 Pt2 O1 1.0(13) . . . . ?
C1 O2 Pt2 N3 58(26) . . . . ?
C8 N2 Pt2 O2 -165.0(17) . . . . ?
C8 N2 Pt2 O1 -24(23) . . . . ?
C8 N2 Pt2 N3 13.1(18) . . . . ?
N1 O1 Pt2 O2 -2.8(13) . . . . ?
N1 O1 Pt2 N2 -144(22) . . . . ?
N1 O1 Pt2 N3 179.1(16) . . . . ?
C9 N3 Pt2 O2 139(24) . . . . ?
C9 N3 Pt2 N2 17(2) . . . . ?
C9 N3 Pt2 O1 -164(2) . . . . ?
C23 C22 Pt3 N7 -179(3) . . . . ?
C21 C22 Pt3 N7 6.3(15) . . . . ?
C23 C22 Pt3 N10 3(3) . . . . ?
C21 C22 Pt3 N10 -172.6(16) . . . . ?
C23 C22 Pt3 N11 64(16) . . . . ?
C21 C22 Pt3 N11 -111(15) . . . . ?
C20 N7 Pt3 C22 -5.1(15) . . . . ?
O6 N7 Pt3 C22 172.4(16) . . . . ?
C20 N7 Pt3 N10 47(46) . . . . ?
O6 N7 Pt3 N10 -135(45) . . . . ?
C20 N7 Pt3 N11 171.1(14) . . . . ?
O6 N7 Pt3 N11 -11.4(15) . . . . ?
C33 N10 Pt3 C22 -166(2) . . . . ?
C33 N10 Pt3 N7 142(44) . . . . ?
C33 N10 Pt3 N11 18(2) . . . . ?
C34 N11 Pt3 C22 -45(16) . . . . ?
C34 N11 Pt3 N7 -162.0(14) . . . . ?
C34 N11 Pt3 N10 16.8(15) . . . . ?
C20 O7 Pt4 N8 -178.9(17) . . . . ?
C20 O7 Pt4 N9 -79(37) . . . . ?
C20 O7 Pt4 O6 -0.3(13) . . . . ?
C27 N8 Pt4 O7 -167(2) . . . . ?
C27 N8 Pt4 N9 15(3) . . . . ?
C27 N8 Pt4 O6 134(38) . . . . ?
C28 N9 Pt4 O7 -85(37) . . . . ?
C28 N9 Pt4 N8 15(3) . . . . ?
C28 N9 Pt4 O6 -164(2) . . . . ?
N7 O6 Pt4 O7 2.0(12) . . . . ?
N7 O6 Pt4 N8 61(40) . . . . ?
N7 O6 Pt4 N9 -179.3(14) . . . . ?
