# Electronic Supplementary Material (ESI) for Dalton Transactions.
# This journal is © The Royal Society of Chemistry 2018

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_vv69_a
_database_code_depnum_ccdc_archive 'CCDC 1846339'
_audit_update_record             
;
2018-05-30 deposited with the CCDC.
2018-08-03 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014/7
_shelx_SHELXL_version_number     2014/7
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         
'C52 H58 N2 O6 Os2 P4, 2(C24 H20 B), 2(C H2 Cl2)'

_chemical_formula_sum            'C102 H102 B2 Cl4 N2 O6 Os2 P4'
_chemical_formula_weight         2119.55

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'
B B 0.0013 0.0007 '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'
P P 0.1023 0.0942 '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'

_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'

_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.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   12.7763(19)
_cell_length_b                   13.497(2)
_cell_length_c                   14.717(2)
_cell_angle_alpha                63.354(4)
_cell_angle_beta                 86.818(5)
_cell_angle_gamma                83.617(5)
_cell_volume                     2254.3(6)
_cell_formula_units_Z            1
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    9937
_cell_measurement_theta_min      3.04
_cell_measurement_theta_max      28.33

_exptl_crystal_description       prism
_exptl_crystal_colour            brown
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.561
_exptl_crystal_F_000             1066
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.085
_exptl_crystal_size_mid          0.072
_exptl_crystal_size_min          0.041
_exptl_absorpt_coefficient_mu    3.062
_shelx_estimated_absorpt_T_min   0.781
_shelx_estimated_absorpt_T_max   0.885

_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.6693
_exptl_absorpt_correction_T_max  0.7457
_exptl_absorpt_process_details   'SADABS-2016/2 (Bruker AXS Inc.)'
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      100(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'Incoatec high brillance I\muS microsource'
_diffrn_radiation_monochromator  'Incoatec HeliosTM multilayer optics'
_diffrn_measurement_device_type  'Bruker D8 Venture Photon 100 CMOS'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            85416
_diffrn_reflns_av_unetI/netI     0.0222
_diffrn_reflns_av_R_equivalents  0.0344
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_theta_min         2.222
_diffrn_reflns_theta_max         28.356
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measured_fraction_theta_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.997
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.997
_diffrn_reflns_point_group_measured_fraction_full 0.999
_reflns_number_total             11224
_reflns_number_gt                10461
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;

_computing_data_collection       'Bruker APEX3'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXT-2014/5 (Sheldrick, 2014)'
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_computing_molecular_graphics    ?
_computing_publication_material  ?
_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0387P)²+10.7990P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   mixed
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         11224
_refine_ls_number_parameters     553
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0364
_refine_ls_R_factor_gt           0.0326
_refine_ls_wR_factor_ref         0.0867
_refine_ls_wR_factor_gt          0.0849
_refine_ls_goodness_of_fit_ref   1.094
_refine_ls_restrained_S_all      1.094
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

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
CT1 H 0.5251 0.8219 0.8577 0.000 Uiso 0 1 d . U P . .
Os Os 0.57319(2) 0.67685(2) 0.87497(2) 0.00930(5) Uani 1 1 d . . . . .
N1 N 0.5178(2) 0.5384(2) 0.9727(2) 0.0112(5) Uani 1 1 d . . . . .
C1 C 0.4363(3) 0.7950(3) 0.8757(4) 0.0238(9) Uani 1 1 d . . . . .
H1 H 0.3669 0.7730 0.8903 0.029 Uiso 1 1 calc R U . . .
C2 C 0.4842(3) 0.8408(3) 0.7791(3) 0.0214(8) Uani 1 1 d . . . . .
H2 H 0.4518 0.8571 0.7167 0.026 Uiso 1 1 calc R U . . .
C3 C 0.5895(3) 0.8588(3) 0.7903(3) 0.0180(7) Uani 1 1 d . . . . .
H3 H 0.6403 0.8866 0.7376 0.022 Uiso 1 1 calc R U . . .
C4 C 0.6046(3) 0.8274(3) 0.8952(3) 0.0187(8) Uani 1 1 d . . . . .
H4 H 0.6671 0.8324 0.9245 0.022 Uiso 1 1 calc R U . . .
C5 C 0.5110(4) 0.7874(3) 0.9482(3) 0.0225(8) Uani 1 1 d . . . . .
H5 H 0.4995 0.7604 1.0194 0.027 Uiso 1 1 calc R U . . .
P2 P 0.56282(8) 0.61868(8) 0.75390(7) 0.01299(17) Uani 1 1 d . . . . .
O21 O 0.5366(2) 0.4929(2) 0.7983(2) 0.0153(5) Uani 1 1 d . . . . .
O22 O 0.4754(2) 0.6884(2) 0.6686(2) 0.0188(6) Uani 1 1 d . . . . .
O23 O 0.6612(2) 0.6193(2) 0.6833(2) 0.0188(6) Uani 1 1 d . . . . .
C41 C 0.5269(4) 0.4435(4) 0.7295(3) 0.0248(9) Uani 1 1 d . . . . .
H41A H 0.4772 0.4916 0.6754 0.037 Uiso 1 1 calc R U . . .
H41B H 0.5011 0.3700 0.7674 0.037 Uiso 1 1 calc R U . . .
H41C H 0.5959 0.4358 0.6996 0.037 Uiso 1 1 calc R U . . .
C42 C 0.3654(3) 0.6859(4) 0.6972(3) 0.0232(8) Uani 1 1 d . . . . .
H42A H 0.3395 0.6191 0.6995 0.035 Uiso 1 1 calc R U . . .
H42B H 0.3250 0.7523 0.6471 0.035 Uiso 1 1 calc R U . . .
H42C H 0.3571 0.6844 0.7644 0.035 Uiso 1 1 calc R U . . .
C43 C 0.6965(4) 0.7241(4) 0.6096(3) 0.0279(10) Uani 1 1 d . . . . .
H43A H 0.6471 0.7591 0.5527 0.042 Uiso 1 1 calc R U . . .
H43B H 0.7667 0.7108 0.5845 0.042 Uiso 1 1 calc R U . . .
H43C H 0.6994 0.7735 0.6418 0.042 Uiso 1 1 calc R U . . .
P1 P 0.74485(7) 0.59488(7) 0.92483(7) 0.01049(16) Uani 1 1 d . . . . .
C11 C 0.7734(3) 0.4427(3) 0.9787(3) 0.0130(7) Uani 1 1 d . . . . .
C12 C 0.8217(3) 0.3810(3) 1.0733(3) 0.0170(7) Uani 1 1 d . . . . .
H12 H 0.8344 0.4168 1.1138 0.020 Uiso 1 1 calc R U . . .
C13 C 0.8513(3) 0.2670(3) 1.1089(3) 0.0206(8) Uani 1 1 d . . . . .
H13 H 0.8834 0.2258 1.1736 0.025 Uiso 1 1 calc R U . . .
C14 C 0.8343(3) 0.2141(3) 1.0504(3) 0.0204(8) Uani 1 1 d . . . . .
H14 H 0.8559 0.1370 1.0742 0.024 Uiso 1 1 calc R U . . .
C15 C 0.7854(3) 0.2744(3) 0.9562(3) 0.0195(8) Uani 1 1 d . . . . .
H15 H 0.7729 0.2381 0.9161 0.023 Uiso 1 1 calc R U . . .
C16 C 0.7547(3) 0.3878(3) 0.9210(3) 0.0170(7) Uani 1 1 d . . . . .
H16 H 0.7208 0.4281 0.8571 0.020 Uiso 1 1 calc R U . . .
C21 C 0.7875(3) 0.6234(3) 1.0269(3) 0.0127(7) Uani 1 1 d . . . . .
C22 C 0.8861(3) 0.6586(3) 1.0276(3) 0.0154(7) Uani 1 1 d . . . . .
H22 H 0.9346 0.6676 0.9738 0.019 Uiso 1 1 calc R U . . .
C23 C 0.9137(3) 0.6805(3) 1.1058(3) 0.0203(8) Uani 1 1 d . . . . .
H23 H 0.9804 0.7059 1.1047 0.024 Uiso 1 1 calc R U . . .
C24 C 0.8445(4) 0.6657(4) 1.1859(3) 0.0223(8) Uani 1 1 d . . . . .
H24 H 0.8637 0.6808 1.2395 0.027 Uiso 1 1 calc R U . . .
C25 C 0.7465(3) 0.6285(4) 1.1875(3) 0.0210(8) Uani 1 1 d . . . . .
H25 H 0.6993 0.6171 1.2427 0.025 Uiso 1 1 calc R U . . .
C26 C 0.7183(3) 0.6080(3) 1.1081(3) 0.0170(7) Uani 1 1 d . . . . .
H26 H 0.6513 0.5834 1.1091 0.020 Uiso 1 1 calc R U . . .
C31 C 0.8487(3) 0.6452(3) 0.8288(3) 0.0136(7) Uani 1 1 d . . . . .
C32 C 0.8560(3) 0.7597(3) 0.7760(3) 0.0187(8) Uani 1 1 d . . . . .
H32 H 0.8074 0.8095 0.7905 0.022 Uiso 1 1 calc R U . . .
C33 C 0.9338(3) 0.8015(3) 0.7025(3) 0.0217(8) Uani 1 1 d . . . . .
H33 H 0.9387 0.8795 0.6675 0.026 Uiso 1 1 calc R U . . .
C34 C 1.0039(3) 0.7296(4) 0.6802(3) 0.0229(8) Uani 1 1 d . . . . .
H34 H 1.0560 0.7583 0.6288 0.028 Uiso 1 1 calc R U . . .
C35 C 0.9981(4) 0.6163(4) 0.7327(3) 0.0254(9) Uani 1 1 d . . . . .
H35 H 1.0470 0.5669 0.7179 0.030 Uiso 1 1 calc R U . . .
C36 C 0.9211(3) 0.5736(3) 0.8072(3) 0.0185(7) Uani 1 1 d . . . . .
H36 H 0.9180 0.4953 0.8433 0.022 Uiso 1 1 calc R U . . .
Cl1 Cl 0.93711(16) 0.7991(2) 0.43679(18) 0.0789(6) Uani 1 1 d . . . . .
Cl2 Cl 0.9241(2) 0.9024(3) 0.2162(2) 0.1256(13) Uani 1 1 d . . . . .
C1S C 0.9879(6) 0.8027(8) 0.3246(6) 0.069(2) Uani 1 1 d . . . . .
H1SA H 0.9848 0.7286 0.3270 0.083 Uiso 1 1 calc R U . . .
H1SB H 1.0629 0.8165 0.3196 0.083 Uiso 1 1 calc R U . . .
B1 B 0.6761(3) 0.1803(3) 0.6526(3) 0.0159(8) Uani 1 1 d . . . . .
C11B C 0.5494(3) 0.2224(3) 0.6439(3) 0.0158(7) Uani 1 1 d . . . . .
C12B C 0.4734(3) 0.1503(3) 0.7013(3) 0.0217(8) Uani 1 1 d . . . . .
H12B H 0.4968 0.0772 0.7501 0.026 Uiso 1 1 calc R U . . .
C13B C 0.3657(4) 0.1814(4) 0.6895(3) 0.0245(9) Uani 1 1 d . . . . .
H13B H 0.3174 0.1297 0.7296 0.029 Uiso 1 1 calc R U . . .
C14B C 0.3287(3) 0.2877(4) 0.6196(3) 0.0220(8) Uani 1 1 d . . . . .
H14B H 0.2552 0.3095 0.6117 0.026 Uiso 1 1 calc R U . . .
C15B C 0.4003(3) 0.3617(3) 0.5612(3) 0.0189(8) Uani 1 1 d . . . . .
H15B H 0.3760 0.4348 0.5127 0.023 Uiso 1 1 calc R U . . .
C16B C 0.5081(3) 0.3287(3) 0.5739(3) 0.0168(7) Uani 1 1 d . . . . .
H16B H 0.5558 0.3809 0.5332 0.020 Uiso 1 1 calc R U . . .
C21B C 0.7463(3) 0.2879(3) 0.6147(3) 0.0174(7) Uani 1 1 d . . . . .
C22B C 0.7769(3) 0.3504(3) 0.5135(3) 0.0196(8) Uani 1 1 d . . . . .
H22B H 0.7572 0.3296 0.4636 0.024 Uiso 1 1 calc R U . . .
C23B C 0.8350(3) 0.4416(3) 0.4830(3) 0.0224(8) Uani 1 1 d . . . . .
H23B H 0.8544 0.4809 0.4136 0.027 Uiso 1 1 calc R U . . .
C24B C 0.8646(3) 0.4753(3) 0.5527(3) 0.0232(8) Uani 1 1 d . . . . .
H24B H 0.9059 0.5363 0.5325 0.028 Uiso 1 1 calc R U . . .
C25B C 0.8328(5) 0.4182(4) 0.6526(4) 0.0373(12) Uani 1 1 d . . . . .
H25B H 0.8494 0.4419 0.7014 0.045 Uiso 1 1 calc R U . . .
C26B C 0.7766(5) 0.3262(4) 0.6819(4) 0.0351(12) Uani 1 1 d . . . . .
H26B H 0.7578 0.2872 0.7515 0.042 Uiso 1 1 calc R U . . .
C31B C 0.7096(3) 0.0960(3) 0.7718(3) 0.0190(8) Uani 1 1 d . . . . .
C32B C 0.6542(4) 0.0995(3) 0.8549(3) 0.0259(9) Uani 1 1 d . . . . .
H32B H 0.5914 0.1483 0.8425 0.031 Uiso 1 1 calc R U . . .
C33B C 0.6867(4) 0.0347(4) 0.9557(3) 0.0300(10) Uani 1 1 d . . . . .
H33B H 0.6455 0.0389 1.0098 0.036 Uiso 1 1 calc R U . . .
C34B C 0.7794(4) -0.0358(4) 0.9763(3) 0.0319(11) Uani 1 1 d . . . . .
H34B H 0.8026 -0.0794 1.0444 0.038 Uiso 1 1 calc R U . . .
C35B C 0.8369(4) -0.0414(4) 0.8966(4) 0.0280(9) Uani 1 1 d . . . . .
H35B H 0.9008 -0.0886 0.9094 0.034 Uiso 1 1 calc R U . . .
C36B C 0.8014(4) 0.0227(3) 0.7962(3) 0.0226(8) Uani 1 1 d . . . . .
H36B H 0.8416 0.0158 0.7426 0.027 Uiso 1 1 calc R U . . .
C41B C 0.7019(3) 0.1162(3) 0.5798(3) 0.0165(7) Uani 1 1 d . . . . .
C42B C 0.8037(3) 0.1001(3) 0.5442(3) 0.0187(8) Uani 1 1 d . . . . .
H42D H 0.8600 0.1277 0.5626 0.022 Uiso 1 1 calc R U . . .
C43B C 0.8261(3) 0.0457(3) 0.4832(3) 0.0223(8) Uani 1 1 d . . . . .
H43D H 0.8965 0.0367 0.4617 0.027 Uiso 1 1 calc R U . . .
C44B C 0.7461(4) 0.0047(3) 0.4538(3) 0.0228(8) Uani 1 1 d . . . . .
H44B H 0.7608 -0.0323 0.4121 0.027 Uiso 1 1 calc R U . . .
C45B C 0.6442(4) 0.0192(3) 0.4867(3) 0.0219(8) Uani 1 1 d . . . . .
H45B H 0.5883 -0.0085 0.4678 0.026 Uiso 1 1 calc R U . . .
C46B C 0.6232(3) 0.0743(3) 0.5476(3) 0.0180(7) Uani 1 1 d . . . . .
H46B H 0.5525 0.0838 0.5681 0.022 Uiso 1 1 calc R U . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Os CT1 1.8918(3) . ?
Os N1 1.957(3) . ?
Os C3 2.229(4) . ?
Os C1 2.235(4) . ?
Os C2 2.236(4) . ?
Os C5 2.260(4) . ?
Os P2 2.2611(10) . ?
Os C4 2.262(4) . ?
Os P1 2.3416(10) . ?
N1 N1 1.116(6) 2_667 ?
C1 C2 1.407(6) . ?
C1 C5 1.433(6) . ?
C2 C3 1.425(6) . ?
C3 C4 1.424(6) . ?
C4 C5 1.412(6) . ?
P2 O23 1.585(3) . ?
P2 O21 1.590(3) . ?
P2 O22 1.604(3) . ?
O21 C41 1.457(5) . ?
O22 C42 1.444(5) . ?
O23 C43 1.446(5) . ?
P1 C31 1.830(4) . ?
P1 C21 1.832(4) . ?
P1 C11 1.840(4) . ?
C11 C16 1.397(5) . ?
C11 C12 1.399(5) . ?
C12 C13 1.398(5) . ?
C13 C14 1.380(6) . ?
C14 C15 1.395(6) . ?
C15 C16 1.393(5) . ?
C21 C22 1.397(5) . ?
C21 C26 1.398(5) . ?
C22 C23 1.382(6) . ?
C23 C24 1.387(6) . ?
C24 C25 1.394(6) . ?
C25 C26 1.388(5) . ?
C31 C36 1.391(5) . ?
C31 C32 1.395(5) . ?
C32 C33 1.392(5) . ?
C33 C34 1.382(6) . ?
C34 C35 1.379(6) . ?
C35 C36 1.394(6) . ?
Cl1 C1S 1.721(9) . ?
Cl2 C1S 1.731(8) . ?
B1 C11B 1.647(6) . ?
B1 C41B 1.653(6) . ?
B1 C21B 1.653(6) . ?
B1 C31B 1.655(6) . ?
C11B C16B 1.402(5) . ?
C11B C12B 1.409(5) . ?
C12B C13B 1.390(6) . ?
C13B C14B 1.385(6) . ?
C14B C15B 1.385(6) . ?
C15B C16B 1.396(6) . ?
C21B C26B 1.393(6) . ?
C21B C22B 1.401(5) . ?
C22B C23B 1.392(6) . ?
C23B C24B 1.380(6) . ?
C24B C25B 1.382(7) . ?
C25B C26B 1.388(6) . ?
C31B C32B 1.396(6) . ?
C31B C36B 1.398(6) . ?
C32B C33B 1.401(6) . ?
C33B C34B 1.389(7) . ?
C34B C35B 1.376(7) . ?
C35B C36B 1.406(6) . ?
C41B C42B 1.406(6) . ?
C41B C46B 1.406(6) . ?
C42B C43B 1.392(6) . ?
C43B C44B 1.389(6) . ?
C44B C45B 1.389(6) . ?
C45B C46B 1.397(6) . ?

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
CT1 Os N1 126.05(9) . . ?
CT1 Os C3 32.89(10) . . ?
N1 Os C3 158.93(14) . . ?
CT1 Os C1 32.73(11) . . ?
N1 Os C1 98.01(14) . . ?
C3 Os C1 61.97(15) . . ?
CT1 Os C2 32.58(11) . . ?
N1 Os C2 128.48(14) . . ?
C3 Os C2 37.21(15) . . ?
C1 Os C2 36.68(16) . . ?
CT1 Os C5 32.32(10) . . ?
N1 Os C5 98.79(14) . . ?
C3 Os C5 61.59(15) . . ?
C1 Os C5 37.17(17) . . ?
C2 Os C5 61.38(16) . . ?
CT1 Os P2 123.98(3) . . ?
N1 Os P2 88.26(9) . . ?
C3 Os P2 105.26(11) . . ?
C1 Os P2 113.52(13) . . ?
C2 Os P2 91.75(11) . . ?
C5 Os P2 150.38(12) . . ?
CT1 Os C4 32.27(10) . . ?
N1 Os C4 129.48(14) . . ?
C3 Os C4 36.97(15) . . ?
C1 Os C4 61.50(15) . . ?
C2 Os C4 61.41(15) . . ?
C5 Os C4 36.39(15) . . ?
P2 Os C4 141.72(11) . . ?
CT1 Os P1 123.31(2) . . ?
N1 Os P1 89.76(9) . . ?
C3 Os P1 104.63(11) . . ?
C1 Os P1 150.12(12) . . ?
C2 Os P1 141.33(11) . . ?
C5 Os P1 113.22(12) . . ?
P2 Os P1 95.43(3) . . ?
C4 Os P1 91.39(11) . . ?
N1 N1 Os 177.2(4) 2_667 . ?
C2 C1 C5 107.8(4) . . ?
C2 C1 Os 71.7(2) . . ?
C5 C1 Os 72.4(2) . . ?
C1 C2 C3 108.5(4) . . ?
C1 C2 Os 71.6(2) . . ?
C3 C2 Os 71.1(2) . . ?
C4 C3 C2 107.5(4) . . ?
C4 C3 Os 72.8(2) . . ?
C2 C3 Os 71.7(2) . . ?
C5 C4 C3 108.3(4) . . ?
C5 C4 Os 71.7(2) . . ?
C3 C4 Os 70.3(2) . . ?
C4 C5 C1 107.9(4) . . ?
C4 C5 Os 71.9(2) . . ?
C1 C5 Os 70.5(2) . . ?
O23 P2 O21 101.30(15) . . ?
O23 P2 O22 99.68(16) . . ?
O21 P2 O22 104.86(15) . . ?
O23 P2 Os 120.37(11) . . ?
O21 P2 Os 113.29(10) . . ?
O22 P2 Os 115.13(12) . . ?
C41 O21 P2 119.7(2) . . ?
C42 O22 P2 119.3(2) . . ?
C43 O23 P2 119.8(3) . . ?
C31 P1 C21 103.09(17) . . ?
C31 P1 C11 102.57(17) . . ?
C21 P1 C11 102.05(16) . . ?
C31 P1 Os 116.78(12) . . ?
C21 P1 Os 110.23(12) . . ?
C11 P1 Os 119.93(12) . . ?
C16 C11 C12 118.5(3) . . ?
C16 C11 P1 119.8(3) . . ?
C12 C11 P1 121.4(3) . . ?
C13 C12 C11 120.6(4) . . ?
C14 C13 C12 120.3(4) . . ?
C13 C14 C15 119.7(4) . . ?
C16 C15 C14 120.1(4) . . ?
C15 C16 C11 120.7(4) . . ?
C22 C21 C26 118.7(3) . . ?
C22 C21 P1 123.0(3) . . ?
C26 C21 P1 118.3(3) . . ?
C23 C22 C21 120.6(4) . . ?
C22 C23 C24 120.3(4) . . ?
C23 C24 C25 119.8(4) . . ?
C26 C25 C24 119.8(4) . . ?
C25 C26 C21 120.7(4) . . ?
C36 C31 C32 118.9(3) . . ?
C36 C31 P1 122.5(3) . . ?
C32 C31 P1 118.6(3) . . ?
C33 C32 C31 120.5(4) . . ?
C34 C33 C32 120.1(4) . . ?
C35 C34 C33 119.9(4) . . ?
C34 C35 C36 120.5(4) . . ?
C31 C36 C35 120.2(4) . . ?
Cl1 C1S Cl2 114.8(5) . . ?
C11B B1 C41B 108.0(3) . . ?
C11B B1 C21B 110.2(3) . . ?
C41B B1 C21B 110.1(3) . . ?
C11B B1 C31B 111.0(3) . . ?
C41B B1 C31B 110.7(3) . . ?
C21B B1 C31B 106.8(3) . . ?
C16B C11B C12B 114.8(4) . . ?
C16B C11B B1 123.1(3) . . ?
C12B C11B B1 121.9(3) . . ?
C13B C12B C11B 122.9(4) . . ?
C14B C13B C12B 120.2(4) . . ?
C13B C14B C15B 119.2(4) . . ?
C14B C15B C16B 119.8(4) . . ?
C15B C16B C11B 123.2(4) . . ?
C26B C21B C22B 114.5(4) . . ?
C26B C21B B1 121.8(4) . . ?
C22B C21B B1 123.7(3) . . ?
C23B C22B C21B 122.8(4) . . ?
C24B C23B C22B 120.7(4) . . ?
C23B C24B C25B 118.3(4) . . ?
C24B C25B C26B 120.2(4) . . ?
C25B C26B C21B 123.6(4) . . ?
C32B C31B C36B 115.0(4) . . ?
C32B C31B B1 122.9(4) . . ?
C36B C31B B1 121.9(4) . . ?
C31B C32B C33B 123.3(4) . . ?
C34B C33B C32B 119.8(4) . . ?
C35B C34B C33B 118.9(4) . . ?
C34B C35B C36B 120.3(4) . . ?
C31B C36B C35B 122.8(4) . . ?
C42B C41B C46B 114.5(4) . . ?
C42B C41B B1 123.0(3) . . ?
C46B C41B B1 122.5(3) . . ?
C43B C42B C41B 123.4(4) . . ?
C44B C43B C42B 120.3(4) . . ?
C43B C44B C45B 118.3(4) . . ?
C44B C45B C46B 120.5(4) . . ?
C45B C46B C41B 123.0(4) . . ?

_refine_diff_density_max         3.059
_refine_diff_density_min         -2.753
_refine_diff_density_rms         0.145

