#------------------------------------------------------------------------------
#$Date: 2018-09-24 09:49:13 +0300 (Mon, 24 Sep 2018) $
#$Revision: 211137 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/54/35/1543550.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_1543550
loop_
_publ_author_name
'Preshendren Govender'
'Fabio Edafe'
'Banothile C.E. Makhubela'
'Paul J. Dyson'
'Bruno Therrien'
'Gregory S. Smith'
_publ_section_title
;
 Neutral and cationic osmium(II)-arene metallodendrimers: Synthesis,
 characterisation and anticancer activity
;
_journal_name_full               'Inorganica Chimica Acta'
_journal_page_first              112
_journal_page_last               120
_journal_paper_doi               10.1016/j.ica.2013.05.025
_journal_volume                  409A
_journal_year                    2014
_chemical_formula_sum            'C20 H26 Cl N O Os'
_chemical_formula_weight         522.07
_space_group_IT_number           61
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2ac 2ab'
_symmetry_space_group_name_H-M   'P b c a'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            16
_cell_length_a                   12.8543(7)
_cell_length_b                   18.2467(9)
_cell_length_c                   32.5773(15)
_cell_measurement_reflns_used    40133
_cell_measurement_temperature    173(2)
_cell_measurement_theta_max      25.51
_cell_measurement_theta_min      2.52
_cell_volume                     7641.0(7)
_computing_cell_refinement
'SAINT (7.60a, Bruker AXS Inc., Madison, WI, USA, 2006)'
_computing_data_collection
'SAINT (7.60a, Bruker AXS Inc., Madison, WI, USA, 2006)'
_computing_data_reduction
'SAINT (7.60a, Bruker AXS Inc., Madison, WI, USA, 2006)'
_computing_molecular_graphics    'X-Seed (Barbour, 2001)'
_computing_publication_material  'SHELXL-97 (Sheldrick, 2001)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      173(2)
_diffrn_measured_fraction_theta_full 0.991
_diffrn_measured_fraction_theta_max 0.991
_diffrn_measurement_device_type  'Bruker Kappa Duo Apex II Diffractometer'
_diffrn_measurement_method       '0.5° φ scans and ω scans'
_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  0.0599
_diffrn_reflns_av_sigmaI/netI    0.0474
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       22
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -40
_diffrn_reflns_number            40133
_diffrn_reflns_theta_full        26.51
_diffrn_reflns_theta_max         26.51
_diffrn_reflns_theta_min         2.02
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    6.821
_exptl_absorpt_correction_T_max  0.6114
_exptl_absorpt_correction_T_min  0.4277
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS (Sheldrick, 1997)'
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.815
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       needle
_exptl_crystal_F_000             4064
_exptl_crystal_size_max          0.15
_exptl_crystal_size_mid          0.13
_exptl_crystal_size_min          0.08
_refine_diff_density_max         0.758
_refine_diff_density_min         -0.779
_refine_diff_density_rms         0.129
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.004
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     441
_refine_ls_number_reflns         7862
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.004
_refine_ls_R_factor_all          0.0487
_refine_ls_R_factor_gt           0.0289
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0139P)²+6.0751P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0504
_refine_ls_wR_factor_ref         0.0556
_reflns_number_gt                5977
_reflns_number_total             7862
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ICA-2014-409A-112-120-3.cif
_cod_data_source_block           3
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Orthorhombic' changed to
'orthorhombic' according to the built-in table from CIF Core
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_values 4624 2016-04-14 12:54:50Z antanas 

The following automatic conversions were performed:

'_journal_paper_doi' value 'doi:10.1016/j.ica.2013.05.025' was
changed to '10.1016/j.ica.2013.05.025'.

Automatic conversion script
Id: cif_fix_values 6433 2018-09-21 13:16:33Z andrius 
;
_cod_original_sg_symbol_H-M      Pbca
_cod_database_code               1543550
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, -y, z+1/2'
'x+1/2, -y+1/2, -z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, y, -z-1/2'
'-x-1/2, y-1/2, 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_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Os1A Os 0.508402(14) 0.727493(11) 0.448023(5) 0.02515(5) Uani 1 1 d . . .
Cl1A Cl 0.36109(10) 0.67024(8) 0.48188(4) 0.0412(3) Uani 1 1 d . . .
O1A O 0.3965(3) 0.80083(18) 0.42810(10) 0.0340(8) Uani 1 1 d . . .
N1A N 0.5218(3) 0.7896(2) 0.50191(11) 0.0319(10) Uani 1 1 d . . .
C1A C 0.3595(4) 0.8585(3) 0.44646(15) 0.0312(11) Uani 1 1 d . . .
C2A C 0.2796(4) 0.8986(3) 0.42671(16) 0.0353(12) Uani 1 1 d . . .
H2A H 0.2527 0.8813 0.4013 0.042 Uiso 1 1 calc R . .
C3A C 0.2402(4) 0.9617(3) 0.44329(17) 0.0445(14) Uani 1 1 d . . .
H3A H 0.1860 0.9870 0.4294 0.053 Uiso 1 1 calc R . .
C4A C 0.2780(5) 0.9893(3) 0.48011(18) 0.0482(15) Uani 1 1 d . . .
H4A H 0.2511 1.0336 0.4911 0.058 Uiso 1 1 calc R . .
C5A C 0.3541(4) 0.9521(3) 0.50020(17) 0.0423(14) Uani 1 1 d . . .
H5A H 0.3796 0.9708 0.5255 0.051 Uiso 1 1 calc R . .
C6A C 0.3960(4) 0.8865(3) 0.48454(15) 0.0346(13) Uani 1 1 d . . .
C7A C 0.4741(4) 0.8507(3) 0.50850(15) 0.0395(14) Uani 1 1 d . . .
H7A H 0.4938 0.8756 0.5329 0.047 Uiso 1 1 calc R . .
C8A C 0.5942(4) 0.7656(3) 0.53443(15) 0.0411(14) Uani 1 1 d . . .
H8A1 H 0.6153 0.8086 0.5510 0.049 Uiso 1 1 calc R . .
H8A2 H 0.6576 0.7449 0.5216 0.049 Uiso 1 1 calc R . .
C9A C 0.5457(5) 0.7091(4) 0.56210(18) 0.0555(17) Uani 1 1 d . . .
H9A1 H 0.5998 0.6890 0.5806 0.067 Uiso 1 1 calc R . .
H9A2 H 0.5188 0.6682 0.5451 0.067 Uiso 1 1 calc R . .
C10A C 0.4576(5) 0.7399(4) 0.58782(19) 0.068(2) Uani 1 1 d . . .
H10A H 0.4851 0.7768 0.6068 0.103 Uiso 1 1 calc R . .
H10B H 0.4250 0.7002 0.6035 0.103 Uiso 1 1 calc R . .
H10C H 0.4057 0.7625 0.5698 0.103 Uiso 1 1 calc R . .
C11A C 0.5490(5) 0.5470(3) 0.45270(17) 0.0483(15) Uani 1 1 d . . .
H11A H 0.5623 0.5482 0.4823 0.072 Uiso 1 1 calc R . .
H11B H 0.5918 0.5087 0.4400 0.072 Uiso 1 1 calc R . .
H11C H 0.4753 0.5365 0.4478 0.072 Uiso 1 1 calc R . .
C12A C 0.5761(4) 0.6197(3) 0.43438(15) 0.0320(12) Uani 1 1 d . . .
C13A C 0.6526(4) 0.6644(3) 0.45291(14) 0.0285(11) Uani 1 1 d . . .
H13A H 0.6910 0.6464 0.4757 0.034 Uiso 1 1 calc R . .
C14A C 0.6725(4) 0.7357(3) 0.43781(13) 0.0289(11) Uani 1 1 d . . .
H14A H 0.7223 0.7654 0.4515 0.035 Uiso 1 1 calc R . .
C15A C 0.6208(4) 0.7645(3) 0.40310(14) 0.0285(11) Uani 1 1 d . . .
C16A C 0.5470(4) 0.7171(3) 0.38405(14) 0.0310(12) Uani 1 1 d . . .
H16A H 0.5110 0.7344 0.3605 0.037 Uiso 1 1 calc R . .
C17A C 0.5249(4) 0.6463(3) 0.39823(14) 0.0322(12) Uani 1 1 d . . .
H17A H 0.4765 0.6162 0.3840 0.039 Uiso 1 1 calc R . .
C18A C 0.6351(4) 0.8417(3) 0.38709(16) 0.0413(14) Uani 1 1 d . . .
H18A H 0.5641 0.8624 0.3824 0.050 Uiso 1 1 calc R . .
C19A C 0.6900(5) 0.8921(3) 0.41709(19) 0.0594(18) Uani 1 1 d . . .
H19A H 0.7616 0.8751 0.4212 0.089 Uiso 1 1 calc R . .
H19B H 0.6530 0.8917 0.4434 0.089 Uiso 1 1 calc R . .
H19C H 0.6910 0.9420 0.4060 0.089 Uiso 1 1 calc R . .
C20A C 0.6896(5) 0.8401(4) 0.34575(18) 0.067(2) Uani 1 1 d . . .
H20A H 0.7026 0.8903 0.3365 0.100 Uiso 1 1 calc R . .
H20B H 0.6454 0.8149 0.3257 0.100 Uiso 1 1 calc R . .
H20C H 0.7558 0.8139 0.3484 0.100 Uiso 1 1 calc R . .
Cl1B Cl 0.42347(10) 0.68368(8) 0.27753(4) 0.0388(3) Uani 1 1 d . . .
O1B O 0.3653(3) 0.55873(18) 0.33379(9) 0.0328(8) Uani 1 1 d . . .
N1B N 0.2574(3) 0.5709(2) 0.25643(11) 0.0331(10) Uani 1 1 d . . .
C1B C 0.4114(4) 0.5035(3) 0.31587(15) 0.0329(12) Uani 1 1 d . . .
C2B C 0.4828(4) 0.4615(3) 0.33851(17) 0.0466(15) Uani 1 1 d . . .
H2B H 0.4959 0.4744 0.3663 0.056 Uiso 1 1 calc R . .
C3B C 0.5338(5) 0.4031(3) 0.3221(2) 0.0592(18) Uani 1 1 d . . .
H3B H 0.5819 0.3767 0.3386 0.071 Uiso 1 1 calc R . .
C4B C 0.5169(5) 0.3813(3) 0.2819(2) 0.0606(19) Uani 1 1 d . . .
H4B H 0.5539 0.3412 0.2704 0.073 Uiso 1 1 calc R . .
C5B C 0.4456(5) 0.4193(3) 0.25951(18) 0.0490(16) Uani 1 1 d . . .
H5B H 0.4312 0.4035 0.2323 0.059 Uiso 1 1 calc R . .
C6B C 0.3917(4) 0.4814(3) 0.27501(16) 0.0345(12) Uani 1 1 d . . .
C7B C 0.3138(4) 0.5139(3) 0.24962(15) 0.0379(13) Uani 1 1 d . . .
H7B H 0.3019 0.4901 0.2241 0.045 Uiso 1 1 calc R . .
C8B C 0.1812(4) 0.5890(4) 0.22351(15) 0.0468(16) Uani 1 1 d . . .
H8B1 H 0.1133 0.6010 0.2361 0.056 Uiso 1 1 calc R . .
H8B2 H 0.1714 0.5457 0.2056 0.056 Uiso 1 1 calc R . .
C9B C 0.2167(5) 0.6523(4) 0.19809(17) 0.065(2) Uani 1 1 d . . .
H9B1 H 0.2421 0.6916 0.2165 0.079 Uiso 1 1 calc R . .
H9B2 H 0.1565 0.6719 0.1826 0.079 Uiso 1 1 calc R . .
C10B C 0.3019(6) 0.6329(5) 0.1682(2) 0.089(3) Uani 1 1 d . . .
H10D H 0.3610 0.6120 0.1831 0.134 Uiso 1 1 calc R . .
H10E H 0.3243 0.6771 0.1536 0.134 Uiso 1 1 calc R . .
H10F H 0.2757 0.5969 0.1484 0.134 Uiso 1 1 calc R . .
C11B C 0.2608(5) 0.8188(3) 0.30797(19) 0.0552(16) Uani 1 1 d . . .
H11D H 0.2606 0.8197 0.2779 0.083 Uiso 1 1 calc R . .
H11E H 0.3324 0.8229 0.3180 0.083 Uiso 1 1 calc R . .
H11F H 0.2197 0.8600 0.3184 0.083 Uiso 1 1 calc R . .
C12B C 0.2142(4) 0.7480(3) 0.32269(16) 0.0344(13) Uani 1 1 d . . .
C13B C 0.1360(4) 0.7117(3) 0.30013(15) 0.0310(12) Uani 1 1 d . . .
H13B H 0.1084 0.7339 0.2761 0.037 Uiso 1 1 calc R . .
C14B C 0.0983(3) 0.6427(3) 0.31290(14) 0.0268(11) Uani 1 1 d . . .
H14B H 0.0455 0.6195 0.2972 0.032 Uiso 1 1 calc R . .
C15B C 0.1368(4) 0.6071(3) 0.34826(14) 0.0276(11) Uani 1 1 d . . .
C16B C 0.2119(4) 0.6456(3) 0.37180(14) 0.0335(12) Uani 1 1 d . . .
H16B H 0.2374 0.6240 0.3964 0.040 Uiso 1 1 calc R . .
C17B C 0.2497(4) 0.7145(3) 0.35992(14) 0.0326(12) Uani 1 1 d . . .
H17B H 0.2991 0.7391 0.3767 0.039 Uiso 1 1 calc R . .
C18B C 0.1047(4) 0.5299(3) 0.36119(15) 0.0373(13) Uani 1 1 d . . .
H18B H 0.1694 0.5046 0.3707 0.045 Uiso 1 1 calc R . .
C19B C 0.0317(5) 0.5319(3) 0.39722(17) 0.0539(17) Uani 1 1 d . . .
H19D H -0.0334 0.5558 0.3891 0.081 Uiso 1 1 calc R . .
H19E H 0.0638 0.5594 0.4197 0.081 Uiso 1 1 calc R . .
H19F H 0.0171 0.4817 0.4063 0.081 Uiso 1 1 calc R . .
C20B C 0.0608(5) 0.4844(3) 0.32672(17) 0.0535(16) Uani 1 1 d . . .
H20D H 0.0464 0.4348 0.3367 0.080 Uiso 1 1 calc R . .
H20E H 0.1113 0.4821 0.3042 0.080 Uiso 1 1 calc R . .
H20F H -0.0038 0.5068 0.3168 0.080 Uiso 1 1 calc R . .
Os1B Os 0.265890(14) 0.635895(10) 0.309207(5) 0.02372(5) 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'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Os Os -1.2165 7.6030 '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
O1A Os1A N1A 88.30(14) . .
O1A Os1A C14A 126.23(16) . .
N1A Os1A C14A 90.64(16) . .
O1A Os1A C16A 85.06(16) . .
N1A Os1A C16A 147.16(18) . .
C14A Os1A C16A 68.17(17) . .
O1A Os1A C15A 92.89(16) . .
N1A Os1A C15A 110.04(17) . .
C14A Os1A C15A 38.30(17) . .
C16A Os1A C15A 38.59(17) . .
O1A Os1A C13A 162.22(15) . .
N1A Os1A C13A 98.85(17) . .
C14A Os1A C13A 38.14(17) . .
C16A Os1A C13A 80.11(18) . .
C15A Os1A C13A 69.38(18) . .
O1A Os1A C12A 142.29(16) . .
N1A Os1A C12A 128.38(17) . .
C14A Os1A C12A 68.97(18) . .
C16A Os1A C12A 68.48(19) . .
C15A Os1A C12A 82.99(18) . .
C13A Os1A C12A 37.60(17) . .
O1A Os1A C17A 105.69(15) . .
N1A Os1A C17A 165.99(17) . .
C14A Os1A C17A 80.68(18) . .
C16A Os1A C17A 37.46(18) . .
C15A Os1A C17A 69.40(18) . .
C13A Os1A C17A 67.58(18) . .
C12A Os1A C17A 38.00(17) . .
O1A Os1A Cl1A 83.02(10) . .
N1A Os1A Cl1A 85.20(11) . .
C14A Os1A Cl1A 150.39(13) . .
C16A Os1A Cl1A 125.61(14) . .
C15A Os1A Cl1A 164.17(13) . .
C13A Os1A Cl1A 113.65(13) . .
C12A Os1A Cl1A 90.89(13) . .
C17A Os1A Cl1A 96.90(14) . .
C1A O1A Os1A 129.3(3) . .
C7A N1A C8A 115.8(4) . .
C7A N1A Os1A 124.6(3) . .
C8A N1A Os1A 119.5(3) . .
O1A C1A C2A 118.3(4) . .
O1A C1A C6A 124.9(5) . .
C2A C1A C6A 116.8(5) . .
C3A C2A C1A 121.6(5) . .
C3A C2A H2A 119.2 . .
C1A C2A H2A 119.2 . .
C2A C3A C4A 121.1(5) . .
C2A C3A H3A 119.5 . .
C4A C3A H3A 119.5 . .
C5A C4A C3A 119.2(5) . .
C5A C4A H4A 120.4 . .
C3A C4A H4A 120.4 . .
C4A C5A C6A 121.7(5) . .
C4A C5A H5A 119.2 . .
C6A C5A H5A 119.2 . .
C5A C6A C1A 119.7(5) . .
C5A C6A C7A 117.3(5) . .
C1A C6A C7A 123.0(5) . .
N1A C7A C6A 129.6(5) . .
N1A C7A H7A 115.2 . .
C6A C7A H7A 115.2 . .
N1A C8A C9A 111.8(4) . .
N1A C8A H8A1 109.3 . .
C9A C8A H8A1 109.3 . .
N1A C8A H8A2 109.3 . .
C9A C8A H8A2 109.3 . .
H8A1 C8A H8A2 107.9 . .
C8A C9A C10A 112.7(5) . .
C8A C9A H9A1 109.1 . .
C10A C9A H9A1 109.1 . .
C8A C9A H9A2 109.1 . .
C10A C9A H9A2 109.1 . .
H9A1 C9A H9A2 107.8 . .
C9A C10A H10A 109.5 . .
C9A C10A H10B 109.5 . .
H10A C10A H10B 109.5 . .
C9A C10A H10C 109.5 . .
H10A C10A H10C 109.5 . .
H10B C10A H10C 109.5 . .
C12A C11A H11A 109.5 . .
C12A C11A H11B 109.5 . .
H11A C11A H11B 109.5 . .
C12A C11A H11C 109.5 . .
H11A C11A H11C 109.5 . .
H11B C11A H11C 109.5 . .
C13A C12A C17A 118.3(5) . .
C13A C12A C11A 120.2(5) . .
C17A C12A C11A 121.4(5) . .
C13A C12A Os1A 70.9(3) . .
C17A C12A Os1A 71.4(3) . .
C11A C12A Os1A 128.4(4) . .
C12A C13A C14A 120.5(4) . .
C12A C13A Os1A 71.5(3) . .
C14A C13A Os1A 69.1(3) . .
C12A C13A H13A 119.7 . .
C14A C13A H13A 119.7 . .
Os1A C13A H13A 132.8 . .
C15A C14A C13A 122.4(4) . .
C15A C14A Os1A 71.8(3) . .
C13A C14A Os1A 72.8(3) . .
C15A C14A H14A 118.8 . .
C13A C14A H14A 118.8 . .
Os1A C14A H14A 129.2 . .
C14A C15A C16A 115.8(4) . .
C14A C15A C18A 124.4(5) . .
C16A C15A C18A 119.7(4) . .
C14A C15A Os1A 69.9(3) . .
C16A C15A Os1A 70.2(3) . .
C18A C15A Os1A 127.2(4) . .
C17A C16A C15A 123.4(4) . .
C17A C16A Os1A 73.5(3) . .
C15A C16A Os1A 71.2(3) . .
C17A C16A H16A 118.3 . .
C15A C16A H16A 118.3 . .
Os1A C16A H16A 129.8 . .
C16A C17A C12A 119.4(5) . .
C16A C17A Os1A 69.1(3) . .
C12A C17A Os1A 70.6(3) . .
C16A C17A H17A 120.3 . .
C12A C17A H17A 120.3 . .
Os1A C17A H17A 133.0 . .
C15A C18A C19A 113.5(4) . .
C15A C18A C20A 110.1(5) . .
C19A C18A C20A 111.6(5) . .
C15A C18A H18A 107.1 . .
C19A C18A H18A 107.1 . .
C20A C18A H18A 107.1 . .
C18A C19A H19A 109.5 . .
C18A C19A H19B 109.5 . .
H19A C19A H19B 109.5 . .
C18A C19A H19C 109.5 . .
H19A C19A H19C 109.5 . .
H19B C19A H19C 109.5 . .
C18A C20A H20A 109.5 . .
C18A C20A H20B 109.5 . .
H20A C20A H20B 109.5 . .
C18A C20A H20C 109.5 . .
H20A C20A H20C 109.5 . .
H20B C20A H20C 109.5 . .
C1B O1B Os1B 129.4(3) . .
C7B N1B C8B 115.2(4) . .
C7B N1B Os1B 124.8(3) . .
C8B N1B Os1B 120.0(3) . .
O1B C1B C2B 118.8(5) . .
O1B C1B C6B 124.0(4) . .
C2B C1B C6B 117.2(5) . .
C3B C2B C1B 122.4(6) . .
C3B C2B H2B 118.8 . .
C1B C2B H2B 118.8 . .
C2B C3B C4B 121.4(6) . .
C2B C3B H3B 119.3 . .
C4B C3B H3B 119.3 . .
C5B C4B C3B 117.7(5) . .
C5B C4B H4B 121.1 . .
C3B C4B H4B 121.1 . .
C4B C5B C6B 123.0(6) . .
C4B C5B H5B 118.5 . .
C6B C5B H5B 118.5 . .
C1B C6B C5B 118.3(5) . .
C1B C6B C7B 123.6(5) . .
C5B C6B C7B 117.9(5) . .
N1B C7B C6B 129.1(5) . .
N1B C7B H7B 115.5 . .
C6B C7B H7B 115.5 . .
N1B C8B C9B 111.8(5) . .
N1B C8B H8B1 109.3 . .
C9B C8B H8B1 109.3 . .
N1B C8B H8B2 109.3 . .
C9B C8B H8B2 109.3 . .
H8B1 C8B H8B2 107.9 . .
C8B C9B C10B 113.5(6) . .
C8B C9B H9B1 108.9 . .
C10B C9B H9B1 108.9 . .
C8B C9B H9B2 108.9 . .
C10B C9B H9B2 108.9 . .
H9B1 C9B H9B2 107.7 . .
C9B C10B H10D 109.5 . .
C9B C10B H10E 109.5 . .
H10D C10B H10E 109.5 . .
C9B C10B H10F 109.5 . .
H10D C10B H10F 109.5 . .
H10E C10B H10F 109.5 . .
C12B C11B H11D 109.5 . .
C12B C11B H11E 109.5 . .
H11D C11B H11E 109.5 . .
C12B C11B H11F 109.5 . .
H11D C11B H11F 109.5 . .
H11E C11B H11F 109.5 . .
C13B C12B C17B 117.9(4) . .
C13B C12B C11B 121.4(5) . .
C17B C12B C11B 120.7(5) . .
C13B C12B Os1B 71.0(3) . .
C17B C12B Os1B 71.0(3) . .
C11B C12B Os1B 128.1(4) . .
C12B C13B C14B 120.7(4) . .
C12B C13B Os1B 71.5(3) . .
C14B C13B Os1B 70.0(3) . .
C12B C13B H13B 119.7 . .
C14B C13B H13B 119.7 . .
Os1B C13B H13B 131.7 . .
C13B C14B C15B 122.1(4) . .
C13B C14B Os1B 72.1(3) . .
C15B C14B Os1B 70.7(3) . .
C13B C14B H14B 119.0 . .
C15B C14B H14B 119.0 . .
Os1B C14B H14B 131.1 . .
C14B C15B C16B 116.8(4) . .
C14B C15B C18B 123.7(4) . .
C16B C15B C18B 119.4(4) . .
C14B C15B Os1B 71.1(3) . .
C16B C15B Os1B 71.0(3) . .
C18B C15B Os1B 126.6(3) . .
C17B C16B C15B 122.0(5) . .
C17B C16B Os1B 72.7(3) . .
C15B C16B Os1B 70.6(3) . .
C17B C16B H16B 119.0 . .
C15B C16B H16B 119.0 . .
Os1B C16B H16B 130.5 . .
C16B C17B C12B 120.4(5) . .
C16B C17B Os1B 69.8(3) . .
C12B C17B Os1B 70.9(3) . .
C16B C17B H17B 119.8 . .
C12B C17B H17B 119.8 . .
Os1B C17B H17B 132.6 . .
C19B C18B C20B 111.2(5) . .
C19B C18B C15B 111.2(4) . .
C20B C18B C15B 113.8(4) . .
C19B C18B H18B 106.7 . .
C20B C18B H18B 106.7 . .
C15B C18B H18B 106.7 . .
C18B C19B H19D 109.5 . .
C18B C19B H19E 109.5 . .
H19D C19B H19E 109.5 . .
C18B C19B H19F 109.5 . .
H19D C19B H19F 109.5 . .
H19E C19B H19F 109.5 . .
C18B C20B H20D 109.5 . .
C18B C20B H20E 109.5 . .
H20D C20B H20E 109.5 . .
C18B C20B H20F 109.5 . .
H20D C20B H20F 109.5 . .
H20E C20B H20F 109.5 . .
O1B Os1B N1B 87.94(14) . .
O1B Os1B C15B 94.65(16) . .
N1B Os1B C15B 107.86(17) . .
O1B Os1B C14B 129.42(16) . .
N1B Os1B C14B 91.53(16) . .
C15B Os1B C14B 38.19(17) . .
O1B Os1B C16B 83.60(16) . .
N1B Os1B C16B 143.64(18) . .
C15B Os1B C16B 38.39(17) . .
C14B Os1B C16B 67.84(18) . .
O1B Os1B C13B 163.02(15) . .
N1B Os1B C13B 102.00(17) . .
C15B Os1B C13B 69.32(18) . .
C14B Os1B C13B 37.88(17) . .
C16B Os1B C13B 80.26(18) . .
O1B Os1B C12B 138.23(16) . .
N1B Os1B C12B 132.63(18) . .
C15B Os1B C12B 82.89(18) . .
C14B Os1B C12B 68.50(18) . .
C16B Os1B C12B 68.76(19) . .
C13B Os1B C12B 37.52(18) . .
O1B Os1B C17B 102.27(16) . .
N1B Os1B C17B 169.45(17) . .
C15B Os1B C17B 69.06(18) . .
C14B Os1B C17B 79.98(17) . .
C16B Os1B C17B 37.52(18) . .
C13B Os1B C17B 67.45(18) . .
C12B Os1B C17B 38.07(18) . .
O1B Os1B Cl1B 83.90(10) . .
N1B Os1B Cl1B 84.15(11) . .
C15B Os1B Cl1B 167.88(13) . .
C14B Os1B Cl1B 146.33(13) . .
C16B Os1B Cl1B 129.61(14) . .
C13B Os1B Cl1B 110.54(13) . .
C12B Os1B Cl1B 90.16(14) . .
C17B Os1B Cl1B 99.42(13) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Os1A O1A 2.069(3) .
Os1A N1A 2.097(4) .
Os1A C14A 2.140(5) .
Os1A C16A 2.151(5) .
Os1A C15A 2.165(5) .
Os1A C13A 2.188(5) .
Os1A C12A 2.197(5) .
Os1A C17A 2.207(5) .
Os1A Cl1A 2.4276(13) .
O1A C1A 1.300(6) .
N1A C7A 1.291(6) .
N1A C8A 1.476(6) .
C1A C2A 1.416(7) .
C1A C6A 1.421(7) .
C2A C3A 1.369(7) .
C2A H2A 0.9500 .
C3A C4A 1.389(7) .
C3A H3A 0.9500 .
C4A C5A 1.358(7) .
C4A H4A 0.9500 .
C5A C6A 1.408(7) .
C5A H5A 0.9500 .
C6A C7A 1.430(7) .
C7A H7A 0.9500 .
C8A C9A 1.506(8) .
C8A H8A1 0.9900 .
C8A H8A2 0.9900 .
C9A C10A 1.517(8) .
C9A H9A1 0.9900 .
C9A H9A2 0.9900 .
C10A H10A 0.9800 .
C10A H10B 0.9800 .
C10A H10C 0.9800 .
C11A C12A 1.495(7) .
C11A H11A 0.9800 .
C11A H11B 0.9800 .
C11A H11C 0.9800 .
C12A C13A 1.413(7) .
C12A C17A 1.434(7) .
C13A C14A 1.415(6) .
C13A H13A 0.9500 .
C14A C15A 1.412(6) .
C14A H14A 0.9500 .
C15A C16A 1.426(7) .
C15A C18A 1.513(7) .
C16A C17A 1.401(7) .
C16A H16A 0.9500 .
C17A H17A 0.9500 .
C18A C19A 1.516(7) .
C18A C20A 1.518(7) .
C18A H18A 1.0000 .
C19A H19A 0.9800 .
C19A H19B 0.9800 .
C19A H19C 0.9800 .
C20A H20A 0.9800 .
C20A H20B 0.9800 .
C20A H20C 0.9800 .
Cl1B Os1B 2.4349(12) .
O1B C1B 1.307(5) .
O1B Os1B 2.063(3) .
N1B C7B 1.286(6) .
N1B C8B 1.490(6) .
N1B Os1B 2.092(4) .
C1B C2B 1.404(7) .
C1B C6B 1.414(7) .
C2B C3B 1.361(8) .
C2B H2B 0.9500 .
C3B C4B 1.386(9) .
C3B H3B 0.9500 .
C4B C5B 1.361(8) .
C4B H4B 0.9500 .
C5B C6B 1.421(7) .
C5B H5B 0.9500 .
C6B C7B 1.428(7) .
C7B H7B 0.9500 .
C8B C9B 1.492(8) .
C8B H8B1 0.9900 .
C8B H8B2 0.9900 .
C9B C10B 1.509(8) .
C9B H9B1 0.9900 .
C9B H9B2 0.9900 .
C10B H10D 0.9800 .
C10B H10E 0.9800 .
C10B H10F 0.9800 .
C11B C12B 1.502(7) .
C11B H11D 0.9800 .
C11B H11E 0.9800 .
C11B H11F 0.9800 .
C12B C13B 1.410(7) .
C12B C17B 1.433(7) .
C12B Os1B 2.196(5) .
C13B C14B 1.412(6) .
C13B Os1B 2.189(5) .
C13B H13B 0.9500 .
C14B C15B 1.412(6) .
C14B Os1B 2.161(4) .
C14B H14B 0.9500 .
C15B C16B 1.419(7) .
C15B C18B 1.527(7) .
C15B Os1B 2.156(5) .
C16B C17B 1.402(7) .
C16B Os1B 2.161(4) .
C16B H16B 0.9500 .
C17B Os1B 2.198(4) .
C17B H17B 0.9500 .
C18B C19B 1.503(7) .
C18B C20B 1.506(7) .
C18B H18B 1.0000 .
C19B H19D 0.9800 .
C19B H19E 0.9800 .
C19B H19F 0.9800 .
C20B H20D 0.9800 .
C20B H20E 0.9800 .
C20B H20F 0.9800 .
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
N1A Os1A O1A C1A -0.5(4) . . . .
C14A Os1A O1A C1A -90.0(4) . . . .
C16A Os1A O1A C1A -148.3(4) . . . .
C15A Os1A O1A C1A -110.5(4) . . . .
C13A Os1A O1A C1A -114.8(6) . . . .
C12A Os1A O1A C1A 167.2(4) . . . .
C17A Os1A O1A C1A -179.9(4) . . . .
Cl1A Os1A O1A C1A 84.9(4) . . . .
O1A Os1A N1A C7A -5.0(4) . . . .
C14A Os1A N1A C7A 121.2(4) . . . .
C16A Os1A N1A C7A 73.2(5) . . . .
C15A Os1A N1A C7A 87.5(4) . . . .
C13A Os1A N1A C7A 158.6(4) . . . .
C12A Os1A N1A C7A -175.5(4) . . . .
C17A Os1A N1A C7A 172.6(6) . . . .
Cl1A Os1A N1A C7A -88.1(4) . . . .
O1A Os1A N1A C8A 178.4(4) . . . .
C14A Os1A N1A C8A -55.4(4) . . . .
C16A Os1A N1A C8A -103.4(4) . . . .
C15A Os1A N1A C8A -89.1(4) . . . .
C13A Os1A N1A C8A -18.0(4) . . . .
C12A Os1A N1A C8A 7.9(4) . . . .
C17A Os1A N1A C8A -4.0(9) . . . .
Cl1A Os1A N1A C8A 95.3(4) . . . .
Os1A O1A C1A C2A -177.7(3) . . . .
Os1A O1A C1A C6A 4.8(7) . . . .
O1A C1A C2A C3A -177.0(5) . . . .
C6A C1A C2A C3A 0.7(7) . . . .
C1A C2A C3A C4A 0.7(8) . . . .
C2A C3A C4A C5A -1.2(8) . . . .
C3A C4A C5A C6A 0.4(8) . . . .
C4A C5A C6A C1A 0.9(8) . . . .
C4A C5A C6A C7A -178.6(5) . . . .
O1A C1A C6A C5A 176.1(5) . . . .
C2A C1A C6A C5A -1.4(7) . . . .
O1A C1A C6A C7A -4.4(8) . . . .
C2A C1A C6A C7A 178.1(5) . . . .
C8A N1A C7A C6A -176.2(5) . . . .
Os1A N1A C7A C6A 7.1(8) . . . .
C5A C6A C7A N1A 177.4(5) . . . .
C1A C6A C7A N1A -2.1(9) . . . .
C7A N1A C8A C9A 99.2(6) . . . .
Os1A N1A C8A C9A -83.9(5) . . . .
N1A C8A C9A C10A -67.5(6) . . . .
O1A Os1A C12A C13A 150.7(3) . . . .
N1A Os1A C12A C13A -45.0(3) . . . .
C14A Os1A C12A C13A 28.2(3) . . . .
C16A Os1A C12A C13A 102.1(3) . . . .
C15A Os1A C12A C13A 65.0(3) . . . .
C17A Os1A C12A C13A 130.3(4) . . . .
Cl1A Os1A C12A C13A -129.6(3) . . . .
O1A Os1A C12A C17A 20.4(4) . . . .
N1A Os1A C12A C17A -175.3(3) . . . .
C14A Os1A C12A C17A -102.2(3) . . . .
C16A Os1A C12A C17A -28.2(3) . . . .
C15A Os1A C12A C17A -65.3(3) . . . .
C13A Os1A C12A C17A -130.3(4) . . . .
Cl1A Os1A C12A C17A 100.1(3) . . . .
O1A Os1A C12A C11A -95.4(5) . . . .
N1A Os1A C12A C11A 68.9(5) . . . .
C14A Os1A C12A C11A 142.0(5) . . . .
C16A Os1A C12A C11A -144.0(5) . . . .
C15A Os1A C12A C11A 178.9(5) . . . .
C13A Os1A C12A C11A 113.9(6) . . . .
C17A Os1A C12A C11A -115.8(6) . . . .
Cl1A Os1A C12A C11A -15.7(5) . . . .
C17A C12A C13A C14A 4.5(7) . . . .
C11A C12A C13A C14A -174.6(5) . . . .
Os1A C12A C13A C14A -50.7(4) . . . .
C17A C12A C13A Os1A 55.2(4) . . . .
C11A C12A C13A Os1A -124.0(5) . . . .
O1A Os1A C13A C12A -101.4(6) . . . .
N1A Os1A C13A C12A 145.9(3) . . . .
C14A Os1A C13A C12A -134.5(4) . . . .
C16A Os1A C13A C12A -67.4(3) . . . .
C15A Os1A C13A C12A -106.0(3) . . . .
C17A Os1A C13A C12A -30.5(3) . . . .
Cl1A Os1A C13A C12A 57.3(3) . . . .
O1A Os1A C13A C14A 33.1(7) . . . .
N1A Os1A C13A C14A -79.6(3) . . . .
C16A Os1A C13A C14A 67.1(3) . . . .
C15A Os1A C13A C14A 28.6(3) . . . .
C12A Os1A C13A C14A 134.5(4) . . . .
C17A Os1A C13A C14A 104.0(3) . . . .
Cl1A Os1A C13A C14A -168.2(2) . . . .
C12A C13A C14A C15A -2.5(7) . . . .
Os1A C13A C14A C15A -54.3(4) . . . .
C12A C13A C14A Os1A 51.8(4) . . . .
O1A Os1A C14A C15A -34.3(3) . . . .
N1A Os1A C14A C15A -122.6(3) . . . .
C16A Os1A C14A C15A 31.6(3) . . . .
C13A Os1A C14A C15A 133.8(4) . . . .
C12A Os1A C14A C15A 106.0(3) . . . .
C17A Os1A C14A C15A 68.4(3) . . . .
Cl1A Os1A C14A C15A 156.0(2) . . . .
O1A Os1A C14A C13A -168.1(2) . . . .
N1A Os1A C14A C13A 103.6(3) . . . .
C16A Os1A C14A C13A -102.2(3) . . . .
C15A Os1A C14A C13A -133.8(4) . . . .
C12A Os1A C14A C13A -27.8(3) . . . .
C17A Os1A C14A C13A -65.4(3) . . . .
Cl1A Os1A C14A C13A 22.2(4) . . . .
C13A C14A C15A C16A 0.0(7) . . . .
Os1A C14A C15A C16A -54.7(4) . . . .
C13A C14A C15A C18A 176.7(5) . . . .
Os1A C14A C15A C18A 121.9(5) . . . .
C13A C14A C15A Os1A 54.7(4) . . . .
O1A Os1A C15A C14A 153.0(3) . . . .
N1A Os1A C15A C14A 63.7(3) . . . .
C16A Os1A C15A C14A -128.7(4) . . . .
C13A Os1A C15A C14A -28.4(3) . . . .
C12A Os1A C15A C14A -64.7(3) . . . .
C17A Os1A C15A C14A -101.4(3) . . . .
Cl1A Os1A C15A C14A -132.6(4) . . . .
O1A Os1A C15A C16A -78.4(3) . . . .
N1A Os1A C15A C16A -167.6(3) . . . .
C14A Os1A C15A C16A 128.7(4) . . . .
C13A Os1A C15A C16A 100.2(3) . . . .
C12A Os1A C15A C16A 64.0(3) . . . .
C17A Os1A C15A C16A 27.3(3) . . . .
Cl1A Os1A C15A C16A -3.9(7) . . . .
O1A Os1A C15A C18A 34.4(4) . . . .
N1A Os1A C15A C18A -54.8(5) . . . .
C14A Os1A C15A C18A -118.5(6) . . . .
C16A Os1A C15A C18A 112.8(5) . . . .
C13A Os1A C15A C18A -147.0(5) . . . .
C12A Os1A C15A C18A 176.8(5) . . . .
C17A Os1A C15A C18A 140.1(5) . . . .
Cl1A Os1A C15A C18A 108.9(6) . . . .
C14A C15A C16A C17A 0.3(7) . . . .
C18A C15A C16A C17A -176.5(5) . . . .
Os1A C15A C16A C17A -54.2(4) . . . .
C14A C15A C16A Os1A 54.5(4) . . . .
C18A C15A C16A Os1A -122.3(4) . . . .
O1A Os1A C16A C17A -124.0(3) . . . .
N1A Os1A C16A C17A 156.9(3) . . . .
C14A Os1A C16A C17A 103.7(3) . . . .
C15A Os1A C16A C17A 135.1(4) . . . .
C13A Os1A C16A C17A 65.9(3) . . . .
C12A Os1A C16A C17A 28.6(3) . . . .
Cl1A Os1A C16A C17A -46.2(3) . . . .
O1A Os1A C16A C15A 100.9(3) . . . .
N1A Os1A C16A C15A 21.8(5) . . . .
C14A Os1A C16A C15A -31.4(3) . . . .
C13A Os1A C16A C15A -69.2(3) . . . .
C12A Os1A C16A C15A -106.5(3) . . . .
C17A Os1A C16A C15A -135.1(4) . . . .
Cl1A Os1A C16A C15A 178.7(2) . . . .
C15A C16A C17A C12A 1.8(7) . . . .
Os1A C16A C17A C12A -51.5(4) . . . .
C15A C16A C17A Os1A 53.2(4) . . . .
C13A C12A C17A C16A -4.1(7) . . . .
C11A C12A C17A C16A 175.0(5) . . . .
Os1A C12A C17A C16A 50.8(4) . . . .
C13A C12A C17A Os1A -54.9(4) . . . .
C11A C12A C17A Os1A 124.2(5) . . . .
O1A Os1A C17A C16A 59.1(3) . . . .
N1A Os1A C17A C16A -118.4(7) . . . .
C14A Os1A C17A C16A -66.1(3) . . . .
C15A Os1A C17A C16A -28.1(3) . . . .
C13A Os1A C17A C16A -103.5(3) . . . .
C12A Os1A C17A C16A -133.7(4) . . . .
Cl1A Os1A C17A C16A 143.7(3) . . . .
O1A Os1A C17A C12A -167.2(3) . . . .
N1A Os1A C17A C12A 15.3(9) . . . .
C14A Os1A C17A C12A 67.6(3) . . . .
C16A Os1A C17A C12A 133.7(4) . . . .
C15A Os1A C17A C12A 105.6(3) . . . .
C13A Os1A C17A C12A 30.2(3) . . . .
Cl1A Os1A C17A C12A -82.6(3) . . . .
C14A C15A C18A C19A -13.8(7) . . . .
C16A C15A C18A C19A 162.7(5) . . . .
Os1A C15A C18A C19A 76.0(6) . . . .
C14A C15A C18A C20A 112.2(6) . . . .
C16A C15A C18A C20A -71.3(6) . . . .
Os1A C15A C18A C20A -158.0(4) . . . .
Os1B O1B C1B C2B 174.9(3) . . . .
Os1B O1B C1B C6B -7.1(7) . . . .
O1B C1B C2B C3B 179.8(5) . . . .
C6B C1B C2B C3B 1.7(8) . . . .
C1B C2B C3B C4B -0.7(10) . . . .
C2B C3B C4B C5B -1.5(10) . . . .
C3B C4B C5B C6B 2.6(9) . . . .
O1B C1B C6B C5B -178.6(5) . . . .
C2B C1B C6B C5B -0.7(7) . . . .
O1B C1B C6B C7B -4.5(8) . . . .
C2B C1B C6B C7B 173.5(5) . . . .
C4B C5B C6B C1B -1.5(8) . . . .
C4B C5B C6B C7B -176.0(5) . . . .
C8B N1B C7B C6B -178.7(5) . . . .
Os1B N1B C7B C6B 0.7(8) . . . .
C1B C6B C7B N1B 7.9(9) . . . .
C5B C6B C7B N1B -177.9(5) . . . .
C7B N1B C8B C9B -103.8(6) . . . .
Os1B N1B C8B C9B 76.8(5) . . . .
N1B C8B C9B C10B 75.6(7) . . . .
C17B C12B C13B C14B -3.3(7) . . . .
C11B C12B C13B C14B 175.5(5) . . . .
Os1B C12B C13B C14B 51.9(4) . . . .
C17B C12B C13B Os1B -55.2(4) . . . .
C11B C12B C13B Os1B 123.6(5) . . . .
C12B C13B C14B C15B -0.3(7) . . . .
Os1B C13B C14B C15B 52.3(4) . . . .
C12B C13B C14B Os1B -52.6(4) . . . .
C13B C14B C15B C16B 3.1(7) . . . .
Os1B C14B C15B C16B 56.0(4) . . . .
C13B C14B C15B C18B -174.8(4) . . . .
Os1B C14B C15B C18B -121.9(5) . . . .
C13B C14B C15B Os1B -52.9(4) . . . .
C14B C15B C16B C17B -2.4(7) . . . .
C18B C15B C16B C17B 175.6(4) . . . .
Os1B C15B C16B C17B 53.7(4) . . . .
C14B C15B C16B Os1B -56.1(4) . . . .
C18B C15B C16B Os1B 121.9(4) . . . .
C15B C16B C17B C12B -1.1(7) . . . .
Os1B C16B C17B C12B 51.7(4) . . . .
C15B C16B C17B Os1B -52.7(4) . . . .
C13B C12B C17B C16B 3.9(7) . . . .
C11B C12B C17B C16B -174.8(5) . . . .
Os1B C12B C17B C16B -51.2(4) . . . .
C13B C12B C17B Os1B 55.1(4) . . . .
C11B C12B C17B Os1B -123.7(5) . . . .
C14B C15B C18B C19B -105.4(5) . . . .
C16B C15B C18B C19B 76.7(6) . . . .
Os1B C15B C18B C19B 164.0(4) . . . .
C14B C15B C18B C20B 21.1(7) . . . .
C16B C15B C18B C20B -156.8(5) . . . .
Os1B C15B C18B C20B -69.5(6) . . . .
C1B O1B Os1B N1B 11.2(4) . . . .
C1B O1B Os1B C15B 119.0(4) . . . .
C1B O1B Os1B C14B 101.5(4) . . . .
C1B O1B Os1B C16B 155.8(4) . . . .
C1B O1B Os1B C13B 137.7(6) . . . .
C1B O1B Os1B C12B -156.5(4) . . . .
C1B O1B Os1B C17B -171.5(4) . . . .
C1B O1B Os1B Cl1B -73.1(4) . . . .
C7B N1B Os1B O1B -7.8(4) . . . .
C8B N1B Os1B O1B 171.6(4) . . . .
C7B N1B Os1B C15B -102.0(4) . . . .
C8B N1B Os1B C15B 77.4(4) . . . .
C7B N1B Os1B C14B -137.2(4) . . . .
C8B N1B Os1B C14B 42.2(4) . . . .
C7B N1B Os1B C16B -84.1(5) . . . .
C8B N1B Os1B C16B 95.3(4) . . . .
C7B N1B Os1B C13B -173.9(4) . . . .
C8B N1B Os1B C13B 5.5(4) . . . .
C7B N1B Os1B C12B 161.1(4) . . . .
C8B N1B Os1B C12B -19.5(5) . . . .
C7B N1B Os1B C17B -173.3(8) . . . .
C8B N1B Os1B C17B 6.1(11) . . . .
C7B N1B Os1B Cl1B 76.3(4) . . . .
C8B N1B Os1B Cl1B -104.3(4) . . . .
C14B C15B Os1B O1B -158.0(3) . . . .
C16B C15B Os1B O1B 73.6(3) . . . .
C18B C15B Os1B O1B -39.5(4) . . . .
C14B C15B Os1B N1B -68.6(3) . . . .
C16B C15B Os1B N1B 162.9(3) . . . .
C18B C15B Os1B N1B 49.8(4) . . . .
C16B C15B Os1B C14B -128.5(4) . . . .
C18B C15B Os1B C14B 118.5(5) . . . .
C14B C15B Os1B C16B 128.5(4) . . . .
C18B C15B Os1B C16B -113.1(5) . . . .
C14B C15B Os1B C13B 27.8(3) . . . .
C16B C15B Os1B C13B -100.7(3) . . . .
C18B C15B Os1B C13B 146.2(5) . . . .
C14B C15B Os1B C12B 64.0(3) . . . .
C16B C15B Os1B C12B -64.5(3) . . . .
C18B C15B Os1B C12B -177.6(4) . . . .
C14B C15B Os1B C17B 100.7(3) . . . .
C16B C15B Os1B C17B -27.8(3) . . . .
C18B C15B Os1B C17B -140.9(4) . . . .
C14B C15B Os1B Cl1B 119.4(6) . . . .
C16B C15B Os1B Cl1B -9.0(8) . . . .
C18B C15B Os1B Cl1B -122.1(6) . . . .
C13B C14B Os1B O1B 163.7(2) . . . .
C15B C14B Os1B O1B 29.0(3) . . . .
C13B C14B Os1B N1B -107.7(3) . . . .
C15B C14B Os1B N1B 117.5(3) . . . .
C13B C14B Os1B C15B 134.7(4) . . . .
C13B C14B Os1B C16B 103.1(3) . . . .
C15B C14B Os1B C16B -31.7(3) . . . .
C15B C14B Os1B C13B -134.7(4) . . . .
C13B C14B Os1B C12B 28.1(3) . . . .
C15B C14B Os1B C12B -106.6(3) . . . .
C13B C14B Os1B C17B 66.0(3) . . . .
C15B C14B Os1B C17B -68.8(3) . . . .
C13B C14B Os1B Cl1B -26.0(4) . . . .
C15B C14B Os1B Cl1B -160.7(2) . . . .
C17B C16B Os1B O1B 119.8(3) . . . .
C15B C16B Os1B O1B -105.8(3) . . . .
C17B C16B Os1B N1B -162.5(3) . . . .
C15B C16B Os1B N1B -28.2(4) . . . .
C17B C16B Os1B C15B -134.3(4) . . . .
C17B C16B Os1B C14B -102.8(3) . . . .
C15B C16B Os1B C14B 31.5(3) . . . .
C17B C16B Os1B C13B -65.5(3) . . . .
C15B C16B Os1B C13B 68.9(3) . . . .
C17B C16B Os1B C12B -28.3(3) . . . .
C15B C16B Os1B C12B 106.1(3) . . . .
C15B C16B Os1B C17B 134.3(4) . . . .
C17B C16B Os1B Cl1B 43.2(3) . . . .
C15B C16B Os1B Cl1B 177.5(2) . . . .
C12B C13B Os1B O1B 85.9(6) . . . .
C14B C13B Os1B O1B -48.0(7) . . . .
C12B C13B Os1B N1B -149.3(3) . . . .
C14B C13B Os1B N1B 76.8(3) . . . .
C12B C13B Os1B C15B 105.9(3) . . . .
C14B C13B Os1B C15B -28.0(3) . . . .
C12B C13B Os1B C14B 133.9(4) . . . .
C12B C13B Os1B C16B 67.7(3) . . . .
C14B C13B Os1B C16B -66.3(3) . . . .
C14B C13B Os1B C12B -133.9(4) . . . .
C12B C13B Os1B C17B 30.8(3) . . . .
C14B C13B Os1B C17B -103.1(3) . . . .
C12B C13B Os1B Cl1B -61.1(3) . . . .
C14B C13B Os1B Cl1B 165.0(2) . . . .
C13B C12B Os1B O1B -154.1(3) . . . .
C17B C12B Os1B O1B -24.2(4) . . . .
C11B C12B Os1B O1B 90.4(5) . . . .
C13B C12B Os1B N1B 42.7(4) . . . .
C17B C12B Os1B N1B 172.6(3) . . . .
C11B C12B Os1B N1B -72.8(5) . . . .
C13B C12B Os1B C15B -65.0(3) . . . .
C17B C12B Os1B C15B 64.9(3) . . . .
C11B C12B Os1B C15B 179.4(5) . . . .
C13B C12B Os1B C14B -28.4(3) . . . .
C17B C12B Os1B C14B 101.5(3) . . . .
C11B C12B Os1B C14B -143.9(5) . . . .
C13B C12B Os1B C16B -102.0(3) . . . .
C17B C12B Os1B C16B 27.9(3) . . . .
C11B C12B Os1B C16B 142.5(5) . . . .
C17B C12B Os1B C13B 129.9(4) . . . .
C11B C12B Os1B C13B -115.5(6) . . . .
C13B C12B Os1B C17B -129.9(4) . . . .
C11B C12B Os1B C17B 114.6(6) . . . .
C13B C12B Os1B Cl1B 124.9(3) . . . .
C17B C12B Os1B Cl1B -105.2(3) . . . .
C11B C12B Os1B Cl1B 9.4(5) . . . .
C16B C17B Os1B O1B -61.9(3) . . . .
C12B C17B Os1B O1B 163.8(3) . . . .
C16B C17B Os1B N1B 103.3(9) . . . .
C12B C17B Os1B N1B -31.0(11) . . . .
C16B C17B Os1B C15B 28.4(3) . . . .
C12B C17B Os1B C15B -105.9(3) . . . .
C16B C17B Os1B C14B 66.5(3) . . . .
C12B C17B Os1B C14B -67.8(3) . . . .
C12B C17B Os1B C16B -134.3(4) . . . .
C16B C17B Os1B C13B 103.9(3) . . . .
C12B C17B Os1B C13B -30.4(3) . . . .
C16B C17B Os1B C12B 134.3(4) . . . .
C16B C17B Os1B Cl1B -147.7(3) . . . .
C12B C17B Os1B Cl1B 78.0(3) . . . .
