#------------------------------------------------------------------------------
#$Date: 2016-02-18 14:25:00 +0200 (Thu, 18 Feb 2016) $
#$Revision: 176728 $
#$URL: svn://www.crystallography.net/cod/cif/8/10/17/8101730.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_8101730
loop_
_publ_author_name
'M.-J. Niu'
'D.-C. Li'
'J.-M. Dou'
'D.-Q. Wang'
_publ_section_title
;
Crystal structure of bis(μ-thiocyanato-N,S)bis[aqua(3-methylbenzo-
15-crown-5)sodium]bis(thiocyanato-S)platinum(II), [Na(C₁₅H₂₂O₅)
(H₂O)]₂[Pt(SCN)₄]
;
_journal_issue                   2
_journal_name_full
'Zeitschrift für Kristallographie - New Crystal Structures'
_journal_page_first              188
_journal_page_last               190
_journal_volume                  220
_journal_year                    2005
_chemical_formula_moiety         {Pt[Na(o-MeB15C5)(H~2~O)]~2~(SCN)~4~}
_chemical_formula_sum            'C34 H48 N4 Na2 O12 Pt S4'
_chemical_formula_weight         1074.02
_chemical_melting_point          428.1(10)
_chemical_name_systematic
; 
bis(μ-thiocyanato-N,S)bis[aqua-(3-methylbenzo-15-crown-5)sodium]bis
(thiocyanato-S)platinum(II)
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 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                 105.330(7)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   21.194(11)
_cell_length_b                   16.814(8)
_cell_length_c                   13.218(7)
_cell_measurement_reflns_used    7547
_cell_measurement_temperature    298(2)
_cell_measurement_theta_max      25.33
_cell_measurement_theta_min      2.423
_cell_volume                     4543(4)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SHELXTL'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      298(2)
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_device_type  'Bruker SMART CCD'
_diffrn_measurement_method       phi/omega
_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  0.0377
_diffrn_reflns_av_sigmaI/netI    0.0480
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -25
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_number            23358
_diffrn_reflns_theta_full        25.03
_diffrn_reflns_theta_max         25.03
_diffrn_reflns_theta_min         1.57
_exptl_absorpt_coefficient_mu    3.346
_exptl_absorpt_correction_T_max  0.4140
_exptl_absorpt_correction_T_min  0.3207
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   sadabs
_exptl_crystal_colour            orange
_exptl_crystal_density_diffrn    1.500
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             2064
_exptl_crystal_size_max          0.44
_exptl_crystal_size_mid          0.41
_exptl_crystal_size_min          0.32
_refine_diff_density_max         1.224
_refine_diff_density_min         -0.950
_refine_diff_density_rms         0.076
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.002
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     530
_refine_ls_number_reflns         7998
_refine_ls_number_restraints     6
_refine_ls_restrained_S_all      1.002
_refine_ls_R_factor_all          0.0605
_refine_ls_R_factor_gt           0.0319
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0305P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0635
_refine_ls_wR_factor_ref         0.0722
_reflns_number_gt                5610
_reflns_number_total             7998
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            1267-1470.cff
_cod_data_source_block           040223b
_cod_depositor_comments
;
The following automatic conversions were performed:

'_chemical_melting_point' value '154-156 C' was changed to
'428.1(10)' - it was converted from degrees Celsius(C) to Kelvins(K),
the average value was taken and precision was estimated.

Automatic conversion script
Id: cif_fix_values 1646 2011-03-28 12:23:43Z adriana 
;
_cod_original_sg_symbol_H-M      P2(1)/c
_cod_database_code               8101730
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'
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_Wyckoff_symbol
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt1 Pt 0.752219(9) 0.488202(10) 0.743896(14) 0.04245(7) Uani 1 4 e d . . .
Na1 Na 1.01867(9) 0.28295(10) 0.90759(13) 0.0471(5) Uani 1 4 e d . . .
Na2 Na 0.50124(9) 0.72008(9) 0.59330(12) 0.0446(4) Uani 1 4 e d . . .
N1 N 0.9309(2) 0.3623(3) 0.7980(3) 0.0692(13) Uani 1 4 e d . . .
N2 N 0.5876(2) 0.6400(3) 0.7038(3) 0.0710(13) Uani 1 4 e d . . .
N3 N 0.7939(2) 0.7141(3) 0.6820(3) 0.0771(14) Uani 1 4 e d . . .
N4 N 0.6882(3) 0.2775(3) 0.8212(4) 0.0796(15) Uani 1 4 e d . . .
O1 O 0.92308(16) 0.20201(17) 0.9228(2) 0.0519(8) Uani 1 4 e d . . .
O2 O 1.03901(15) 0.13649(17) 0.9682(2) 0.0502(8) Uani 1 4 e d . . .
O3 O 1.13300(16) 0.24864(19) 0.9963(2) 0.0596(9) Uani 1 4 e d . . .
O4 O 1.0803(2) 0.39741(19) 0.9946(3) 0.0717(11) Uani 1 4 e d . . .
O5 O 0.99124(17) 0.31194(19) 1.0741(2) 0.0569(9) Uani 1 4 e d . . .
O6 O 0.59292(14) 0.81210(16) 0.5815(2) 0.0459(8) Uani 1 4 e d . . .
O7 O 0.47189(14) 0.86421(16) 0.5372(2) 0.0455(8) Uani 1 4 e d . . .
O8 O 0.38578(16) 0.74372(18) 0.5017(2) 0.0553(9) Uani 1 4 e d . . .
O9 O 0.4502(2) 0.60099(18) 0.5021(3) 0.0664(10) Uani 1 4 e d . . .
O10 O 0.53490(17) 0.69694(17) 0.4298(2) 0.0510(8) Uani 1 4 e d . . .
O11 O 1.0646(2) 0.2632(2) 0.7677(3) 0.0680(10) Uani 1 4 e d D . .
O12 O 0.4548(2) 0.7370(2) 0.7320(3) 0.0616(9) Uani 1 4 e d D . .
S1 S 0.82621(7) 0.44144(9) 0.65705(10) 0.0673(4) Uani 1 4 e d . . .
S2 S 0.67768(7) 0.53371(8) 0.83024(10) 0.0614(4) Uani 1 4 e d . . .
S3 S 0.72219(6) 0.57627(7) 0.60258(9) 0.0526(3) Uani 1 4 e d . . .
S4 S 0.78227(7) 0.39865(8) 0.88301(11) 0.0635(4) Uani 1 4 e d . . .
C1 C 0.9289(2) 0.1266(3) 0.8828(4) 0.0495(12) Uani 1 4 e d . . .
C2 C 0.8747(3) 0.0898(3) 0.8176(4) 0.0671(15) Uani 1 4 e d . . .
C3 C 0.8849(3) 0.0162(3) 0.7753(5) 0.0791(18) Uani 1 4 e d . . .
H3 H 0.8496 -0.0098 0.7307 0.095 Uiso 1 4 e calc R . .
C4 C 0.9448(3) -0.0182(3) 0.7975(4) 0.0689(16) Uani 1 4 e d . . .
H4 H 0.9498 -0.0677 0.7690 0.083 Uiso 1 4 e calc R . .
C5 C 0.9986(3) 0.0193(3) 0.8621(4) 0.0565(13) Uani 1 4 e d . . .
H5 H 1.0398 -0.0042 0.8765 0.068 Uiso 1 4 e calc R . .
C6 C 0.9901(2) 0.0921(3) 0.9048(3) 0.0451(12) Uani 1 4 e d . . .
C7 C 1.1050(2) 0.1121(3) 0.9801(4) 0.0556(13) Uani 1 4 e d . . .
H7A H 1.1140 0.1078 0.9121 0.067 Uiso 1 4 e calc R . .
H7B H 1.1127 0.0606 1.0144 0.067 Uiso 1 4 e calc R . .
C8 C 1.1483(2) 0.1735(3) 1.0453(4) 0.0586(14) Uani 1 4 e d . . .
H8A H 1.1416 0.1748 1.1151 0.070 Uiso 1 4 e calc R . .
H8B H 1.1938 0.1607 1.0518 0.070 Uiso 1 4 e calc R . .
C9 C 1.1751(3) 0.3109(3) 1.0444(4) 0.0788(18) Uani 1 4 e d . . .
H9A H 1.2185 0.3028 1.0349 0.095 Uiso 1 4 e calc R . .
H9B H 1.1785 0.3124 1.1190 0.095 Uiso 1 4 e calc R . .
C10 C 1.1469(3) 0.3866(3) 0.9941(4) 0.086(2) Uani 1 4 e d . . .
H10A H 1.1726 0.4307 1.0306 0.103 Uiso 1 4 e calc R . .
H10B H 1.1499 0.3872 0.9221 0.103 Uiso 1 4 e calc R . .
C11 C 1.0712(3) 0.4149(3) 1.0951(5) 0.085(2) Uani 1 4 e d . . .
H11A H 1.0805 0.4706 1.1119 0.103 Uiso 1 4 e calc R . .
H11B H 1.1006 0.3829 1.1484 0.103 Uiso 1 4 e calc R . .
C12 C 1.0013(3) 0.3964(3) 1.0920(4) 0.0806(19) Uani 1 4 e d . . .
H12A H 0.9926 0.4112 1.1580 0.097 Uiso 1 4 e calc R . .
H12B H 0.9720 0.4261 1.0361 0.097 Uiso 1 4 e calc R . .
C13 C 0.9257(3) 0.2873(3) 1.0669(4) 0.0661(16) Uani 1 4 e d . . .
H13A H 0.8951 0.3212 1.0181 0.079 Uiso 1 4 e calc R . .
H13B H 0.9168 0.2915 1.1350 0.079 Uiso 1 4 e calc R . .
C14 C 0.9180(3) 0.2027(3) 1.0296(4) 0.0605(14) Uani 1 4 e d . . .
H14A H 0.9519 0.1697 1.0735 0.073 Uiso 1 4 e calc R . .
H14B H 0.8758 0.1822 1.0326 0.073 Uiso 1 4 e calc R . .
C15 C 0.8076(3) 0.1299(4) 0.7924(6) 0.117(3) Uani 1 4 e d . . .
H15A H 0.7759 0.0961 0.7470 0.175 Uiso 1 4 e calc R . .
H15B H 0.8096 0.1798 0.7581 0.175 Uiso 1 4 e calc R . .
H15C H 0.7952 0.1389 0.8562 0.175 Uiso 1 4 e calc R . .
C16 C 0.5820(2) 0.8865(2) 0.6213(3) 0.0439(11) Uani 1 4 e d . . .
C17 C 0.6334(3) 0.9296(3) 0.6840(4) 0.0566(13) Uani 1 4 e d . . .
C18 C 0.6179(3) 1.0010(3) 0.7248(4) 0.0657(16) Uani 1 4 e d . . .
H18 H 0.6515 1.0313 0.7670 0.079 Uiso 1 4 e calc R . .
C19 C 0.5552(3) 1.0282(3) 0.7050(4) 0.0622(15) Uani 1 4 e d . . .
H19 H 0.5468 1.0764 0.7334 0.075 Uiso 1 4 e calc R . .
C20 C 0.5038(3) 0.9847(3) 0.6431(4) 0.0494(12) Uani 1 4 e d . . .
H20 H 0.4610 1.0029 0.6306 0.059 Uiso 1 4 e calc R . .
C21 C 0.5173(2) 0.9134(2) 0.5999(3) 0.0385(11) Uani 1 4 e d . . .
C22 C 0.4043(2) 0.8819(3) 0.5239(4) 0.0489(12) Uani 1 4 e d . . .
H22A H 0.3938 0.9337 0.4916 0.059 Uiso 1 4 e calc R . .
H22B H 0.3942 0.8824 0.5913 0.059 Uiso 1 4 e calc R . .
C23 C 0.3656(2) 0.8187(3) 0.4552(4) 0.0580(14) Uani 1 4 e d . . .
H23A H 0.3192 0.8264 0.4481 0.070 Uiso 1 4 e calc R . .
H23B H 0.3730 0.8213 0.3859 0.070 Uiso 1 4 e calc R . .
C24 C 0.3498(3) 0.6784(3) 0.4485(4) 0.0738(17) Uani 1 4 e d . . .
H24A H 0.3485 0.6802 0.3746 0.089 Uiso 1 4 e calc R . .
H24B H 0.3053 0.6798 0.4550 0.089 Uiso 1 4 e calc R . .
C25 C 0.3834(3) 0.6039(3) 0.4975(4) 0.0786(19) Uani 1 4 e d . . .
H25A H 0.3784 0.5993 0.5681 0.094 Uiso 1 4 e calc R . .
H25B H 0.3619 0.5585 0.4577 0.094 Uiso 1 4 e calc R . .
C26 C 0.4648(3) 0.5850(3) 0.4042(4) 0.0777(19) Uani 1 4 e d . . .
H26A H 0.4341 0.6128 0.3478 0.093 Uiso 1 4 e calc R . .
H26B H 0.4612 0.5284 0.3893 0.093 Uiso 1 4 e calc R . .
C27 C 0.5327(3) 0.6126(3) 0.4118(4) 0.0736(18) Uani 1 4 e d . . .
H27A H 0.5634 0.5858 0.4692 0.088 Uiso 1 4 e calc R . .
H27B H 0.5445 0.6007 0.3473 0.088 Uiso 1 4 e calc R . .
C28 C 0.5981(3) 0.7298(3) 0.4382(4) 0.0593(14) Uani 1 4 e d . . .
H28A H 0.6078 0.7283 0.3705 0.071 Uiso 1 4 e calc R . .
H28B H 0.6311 0.6992 0.4877 0.071 Uiso 1 4 e calc R . .
C29 C 0.5983(2) 0.8139(3) 0.4750(4) 0.0513(13) Uani 1 4 e d . . .
H29A H 0.6385 0.8401 0.4721 0.062 Uiso 1 4 e calc R . .
H29B H 0.5617 0.8428 0.4306 0.062 Uiso 1 4 e calc R . .
C30 C 0.7026(3) 0.8986(4) 0.7057(5) 0.100(2) Uani 1 4 e d . . .
H30A H 0.7320 0.9354 0.7500 0.150 Uiso 1 4 e calc R . .
H30B H 0.7143 0.8927 0.6407 0.150 Uiso 1 4 e calc R . .
H30C H 0.7055 0.8479 0.7401 0.150 Uiso 1 4 e calc R . .
C31 C 0.8864(3) 0.3934(3) 0.7446(4) 0.0517(13) Uani 1 4 e d . . .
C32 C 0.6254(2) 0.5967(3) 0.7515(4) 0.0508(12) Uani 1 4 e d . . .
C33 C 0.7651(2) 0.6570(3) 0.6525(4) 0.0512(12) Uani 1 4 e d . . .
C34 C 0.7263(3) 0.3276(3) 0.8443(4) 0.0532(13) Uani 1 4 e d . . .
H31 H 1.0475(19) 0.245(3) 0.7025(17) 0.079(18) Uiso 1 4 e d D . .
H32 H 1.1071(8) 0.249(3) 0.786(3) 0.10(2) Uiso 1 4 e d D . .
H33 H 0.4115(6) 0.743(3) 0.717(3) 0.08(2) Uiso 1 4 e d D . .
H34 H 0.4760(17) 0.758(3) 0.794(2) 0.09(2) Uiso 1 4 e d 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'
Na Na 0.0362 0.0249 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 '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
S2 Pt1 S1 179.41(5) . . ?
S2 Pt1 S4 84.50(5) . . ?
S1 Pt1 S4 95.29(6) . . ?
S2 Pt1 S3 96.19(5) . . ?
S1 Pt1 S3 84.02(5) . . ?
S4 Pt1 S3 179.06(5) . . ?
O11 Na1 N1 91.12(15) . . ?
O11 Na1 O4 101.74(16) . . ?
N1 Na1 O4 94.48(16) . . ?
O11 Na1 O3 77.30(14) . . ?
N1 Na1 O3 155.89(15) . . ?
O4 Na1 O3 67.88(13) . . ?
O11 Na1 O5 169.07(16) . . ?
N1 Na1 O5 95.71(14) . . ?
O4 Na1 O5 69.29(13) . . ?
O3 Na1 O5 93.18(13) . . ?
O11 Na1 O1 120.32(14) . . ?
N1 Na1 O1 80.64(14) . . ?
O4 Na1 O1 137.62(15) . . ?
O3 Na1 O1 123.47(12) . . ?
O5 Na1 O1 69.39(12) . . ?
O11 Na1 O2 92.26(13) . . ?
N1 Na1 O2 138.09(15) . . ?
O4 Na1 O2 125.46(13) . . ?
O3 Na1 O2 64.41(11) . . ?
O5 Na1 O2 88.34(11) . . ?
O1 Na1 O2 61.85(11) . . ?
O12 Na2 N2 90.15(15) . . ?
O12 Na2 O9 105.45(16) . . ?
N2 Na2 O9 90.43(16) . . ?
O12 Na2 O8 78.12(14) . . ?
N2 Na2 O8 151.73(15) . . ?
O9 Na2 O8 68.62(13) . . ?
O12 Na2 O10 171.78(15) . . ?
N2 Na2 O10 95.31(14) . . ?
O9 Na2 O10 68.44(12) . . ?
O8 Na2 O10 94.26(12) . . ?
O12 Na2 O6 117.99(14) . . ?
N2 Na2 O6 84.64(15) . . ?
O9 Na2 O6 136.23(14) . . ?
O8 Na2 O6 123.59(12) . . ?
O10 Na2 O6 68.78(11) . . ?
O12 Na2 O7 89.51(13) . . ?
N2 Na2 O7 141.82(15) . . ?
O9 Na2 O7 126.27(13) . . ?
O8 Na2 O7 64.58(10) . . ?
O10 Na2 O7 89.99(11) . . ?
O6 Na2 O7 62.20(10) . . ?
C31 N1 Na1 173.8(5) . . ?
C32 N2 Na2 174.0(5) . . ?
C1 O1 C14 114.6(3) . . ?
C1 O1 Na1 108.2(3) . . ?
C14 O1 Na1 110.3(3) . . ?
C6 O2 C7 118.2(4) . . ?
C6 O2 Na1 107.0(2) . . ?
C7 O2 Na1 112.7(3) . . ?
C9 O3 C8 114.4(4) . . ?
C9 O3 Na1 117.7(3) . . ?
C8 O3 Na1 120.2(3) . . ?
C11 O4 C10 114.2(5) . . ?
C11 O4 Na1 114.6(3) . . ?
C10 O4 Na1 107.7(3) . . ?
C13 O5 C12 113.2(4) . . ?
C13 O5 Na1 109.7(3) . . ?
C12 O5 Na1 106.3(3) . . ?
C16 O6 C29 114.3(3) . . ?
C16 O6 Na2 108.5(3) . . ?
C29 O6 Na2 109.5(2) . . ?
C21 O7 C22 118.1(3) . . ?
C21 O7 Na2 108.5(2) . . ?
C22 O7 Na2 113.0(2) . . ?
C24 O8 C23 114.5(4) . . ?
C24 O8 Na2 117.0(3) . . ?
C23 O8 Na2 120.3(3) . . ?
C25 O9 C26 115.1(4) . . ?
C25 O9 Na2 107.7(3) . . ?
C26 O9 Na2 115.3(3) . . ?
C28 O10 C27 112.6(4) . . ?
C28 O10 Na2 110.6(2) . . ?
C27 O10 Na2 107.2(3) . . ?
C31 S1 Pt1 108.14(18) . . ?
C32 S2 Pt1 109.15(17) . . ?
C33 S3 Pt1 101.24(17) . . ?
C34 S4 Pt1 101.37(17) . . ?
C6 C1 C2 121.4(5) . . ?
C6 C1 O1 118.4(4) . . ?
C2 C1 O1 120.1(5) . . ?
C1 C2 C3 117.0(5) . . ?
C1 C2 C15 120.6(5) . . ?
C3 C2 C15 122.4(5) . . ?
C4 C3 C2 121.8(6) . . ?
C3 C4 C5 120.7(5) . . ?
C6 C5 C4 118.8(5) . . ?
O2 C6 C5 125.1(4) . . ?
O2 C6 C1 114.6(4) . . ?
C5 C6 C1 120.3(5) . . ?
O2 C7 C8 107.4(4) . . ?
O3 C8 C7 108.7(4) . . ?
O3 C9 C10 107.6(4) . . ?
O4 C10 C9 112.9(5) . . ?
O4 C11 C12 107.9(5) . . ?
O5 C12 C11 108.0(5) . . ?
O5 C13 C14 108.4(4) . . ?
O1 C14 C13 107.4(4) . . ?
C17 C16 C21 121.7(4) . . ?
C17 C16 O6 120.6(4) . . ?
C21 C16 O6 117.6(4) . . ?
C16 C17 C18 117.1(5) . . ?
C16 C17 C30 120.2(5) . . ?
C18 C17 C30 122.7(5) . . ?
C19 C18 C17 122.1(5) . . ?
C18 C19 C20 120.7(5) . . ?
C19 C20 C21 118.8(5) . . ?
O7 C21 C20 125.5(4) . . ?
O7 C21 C16 114.9(4) . . ?
C20 C21 C16 119.6(4) . . ?
O7 C22 C23 107.4(4) . . ?
O8 C23 C22 108.3(4) . . ?
O8 C24 C25 107.6(4) . . ?
O9 C25 C24 114.0(4) . . ?
O9 C26 C27 108.4(4) . . ?
O10 C27 C26 107.8(5) . . ?
O10 C28 C29 108.3(4) . . ?
O6 C29 C28 107.7(4) . . ?
N1 C31 S1 173.6(5) . . ?
N2 C32 S2 175.0(5) . . ?
N3 C33 S3 176.7(5) . . ?
N4 C34 S4 177.6(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 S2 2.3102(15) . ?
Pt1 S1 2.3124(15) . ?
Pt1 S4 2.3313(15) . ?
Pt1 S3 2.3363(14) . ?
Na1 O11 2.330(4) . ?
Na1 N1 2.432(5) . ?
Na1 O4 2.437(4) . ?
Na1 O3 2.465(4) . ?
Na1 O5 2.469(4) . ?
Na1 O1 2.492(4) . ?
Na1 O2 2.590(4) . ?
Na2 O12 2.315(4) . ?
Na2 N2 2.425(5) . ?
Na2 O9 2.438(4) . ?
Na2 O8 2.459(4) . ?
Na2 O10 2.479(4) . ?
Na2 O6 2.521(4) . ?
Na2 O7 2.562(3) . ?
N1 C31 1.144(6) . ?
N2 C32 1.140(5) . ?
N3 C33 1.148(6) . ?
N4 C34 1.150(6) . ?
O1 C1 1.391(5) . ?
O1 C14 1.444(5) . ?
O2 C6 1.370(5) . ?
O2 C7 1.427(5) . ?
O3 C9 1.412(6) . ?
O3 C8 1.417(5) . ?
O4 C11 1.422(6) . ?
O4 C10 1.426(7) . ?
O5 C13 1.427(6) . ?
O5 C12 1.446(6) . ?
O6 C16 1.400(5) . ?
O6 C29 1.441(5) . ?
O7 C21 1.370(5) . ?
O7 C22 1.428(5) . ?
O8 C24 1.414(5) . ?
O8 C23 1.419(5) . ?
O9 C25 1.401(6) . ?
O9 C26 1.434(6) . ?
O10 C28 1.426(6) . ?
O10 C27 1.437(5) . ?
S1 C31 1.685(5) . ?
S2 C32 1.681(5) . ?
S3 C33 1.671(5) . ?
S4 C34 1.666(6) . ?
C1 C6 1.381(6) . ?
C1 C2 1.385(7) . ?
C2 C3 1.398(7) . ?
C2 C15 1.529(7) . ?
C3 C4 1.356(8) . ?
C4 C5 1.383(8) . ?
C5 C6 1.380(6) . ?
C7 C8 1.495(6) . ?
C9 C10 1.486(7) . ?
C11 C12 1.504(8) . ?
C13 C14 1.501(6) . ?
C16 C17 1.386(6) . ?
C16 C21 1.398(6) . ?
C17 C18 1.392(6) . ?
C17 C30 1.512(7) . ?
C18 C19 1.364(8) . ?
C19 C20 1.386(7) . ?
C20 C21 1.390(6) . ?
C22 C23 1.494(6) . ?
C24 C25 1.500(7) . ?
C26 C27 1.491(7) . ?
C28 C29 1.494(6) . ?
