#------------------------------------------------------------------------------
#$Date: 2016-03-23 00:47:07 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179128 $
#$URL: svn://www.crystallography.net/cod/cif/4/30/90/4309030.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_4309030
loop_
_publ_author_name
'Sheba D. Bergman'
'Israel Goldberg'
'Andrea Barbieri'
'Moshe Kol'
_publ_section_title
;
Mononuclear and Dinuclear Complexes of Isoeilatin
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              2513
_journal_page_last               2523
_journal_paper_doi               10.1021/ic050002q
_journal_volume                  44
_journal_year                    2005
_chemical_formula_moiety         '(C30 H20 N6 Os), 2(P F6), (C2 H3 N), (H2 O)'
_chemical_formula_sum            'C32 H25 F12 N7 O Os P2'
_chemical_formula_weight         1029.77
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                94.184(3)
_cell_angle_beta                 97.4710(19)
_cell_angle_gamma                111.128(3)
_cell_formula_units_Z            2
_cell_length_a                   11.1590(5)
_cell_length_b                   12.6670(5)
_cell_length_c                   13.9510(6)
_cell_measurement_reflns_used    6311
_cell_measurement_temperature    110(2)
_cell_measurement_theta_max      27.00
_cell_measurement_theta_min      1.74
_cell_volume                     1808.44(14)
_computing_cell_refinement       Denzo
_computing_data_collection       'Collect, Nonius B.V.'
_computing_data_reduction        Denzo
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    DIRDIF-96
_diffrn_ambient_temperature      110(2)
_diffrn_detector_area_resol_mean '56 microns'
_diffrn_measured_fraction_theta_full 0.949
_diffrn_measured_fraction_theta_max 0.949
_diffrn_measurement_device_type  'Nonius KappaCCD'
_diffrn_measurement_method       '1 deg. Phi & Omega 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  0.0330
_diffrn_reflns_av_sigmaI/netI    0.0506
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       0
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_number            13361
_diffrn_reflns_theta_full        27.00
_diffrn_reflns_theta_max         27.00
_diffrn_reflns_theta_min         1.74
_exptl_absorpt_coefficient_mu    3.718
_exptl_absorpt_correction_T_max  0.6055
_exptl_absorpt_correction_T_min  0.5235
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'Blessing, 1995'
_exptl_crystal_colour            black
_exptl_crystal_density_diffrn    1.891
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prisms
_exptl_crystal_F_000             1004
_exptl_crystal_size_max          0.20
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.15
_refine_diff_density_max         1.053
_refine_diff_density_min         -1.493
_refine_diff_density_rms         0.135
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.025
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           fullcycle
_refine_ls_number_parameters     546
_refine_ls_number_reflns         7330
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.025
_refine_ls_R_factor_all          0.0496
_refine_ls_R_factor_gt           0.0388
_refine_ls_shift/su_max          0.101
_refine_ls_shift/su_mean         0.027
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0558P)²+2.5598P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0932
_refine_ls_wR_factor_ref         0.0987
_reflns_number_gt                6311
_reflns_number_total             7330
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic050002qsi20050224_104410_4.cif
_cod_data_source_block           mk127
_cod_original_cell_volume        1808.44(13)
_cod_database_code               4309030
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Os Os 0.983748(19) 0.291829(16) 0.261184(14) 0.02532(8) Uani 1 1 d . . .
P1 P 0.62398(19) -0.2342(2) 0.07608(15) 0.0608(5) Uani 1 1 d . . .
P2 P 0.74630(14) 0.18069(12) 0.62753(11) 0.0332(3) Uani 1 1 d . . .
F1 F 0.5066(5) -0.2376(6) 0.1307(4) 0.0935(18) Uani 1 1 d . . .
F2 F 0.6268(6) -0.3429(5) 0.1227(4) 0.0981(18) Uani 1 1 d . . .
F3 F 0.5218(6) -0.3080(5) -0.0154(4) 0.1020(18) Uani 1 1 d . . .
F4 F 0.7388(5) -0.2358(5) 0.0216(4) 0.0835(15) Uani 1 1 d . . .
F5 F 0.6254(5) -0.1215(5) 0.0329(3) 0.0818(15) Uani 1 1 d . . .
F6 F 0.7250(5) -0.1563(5) 0.1698(4) 0.0964(19) Uani 1 1 d . . .
F7 F 0.7599(4) 0.0861(4) 0.6916(3) 0.0655(12) Uani 1 1 d . . .
F8 F 0.8534(3) 0.2780(3) 0.7054(3) 0.0523(9) Uani 1 1 d . . .
F9 F 0.6347(4) 0.1912(3) 0.6845(3) 0.0535(10) Uani 1 1 d . . .
F10 F 0.7345(4) 0.2770(3) 0.5643(3) 0.0582(10) Uani 1 1 d . . .
F11 F 0.6402(4) 0.0842(4) 0.5500(3) 0.0630(12) Uani 1 1 d . . .
F12 F 0.8560(4) 0.1713(3) 0.5692(3) 0.0494(9) Uani 1 1 d . . .
N1 N 0.9334(4) 0.4256(3) 0.3031(3) 0.0248(9) Uani 1 1 d . . .
N2 N 1.0394(4) 0.3127(3) 0.4135(3) 0.0252(9) Uani 1 1 d . . .
N3 N 0.7926(4) 0.1844(3) 0.2540(3) 0.0261(9) Uani 1 1 d . . .
N4 N 0.9112(5) 0.2825(4) 0.1162(3) 0.0312(10) Uani 1 1 d . . .
N5 N 1.1760(4) 0.3857(4) 0.2538(3) 0.0342(10) Uani 1 1 d . . .
N6 N 1.0473(4) 0.1629(4) 0.2108(3) 0.0300(10) Uani 1 1 d . . .
C1 C 0.9795(6) 0.3340(5) 0.0486(4) 0.0358(12) Uani 1 1 d . . .
H1 H 1.0696 0.3788 0.0681 0.043 Uiso 1 1 calc R . .
C2 C 0.9241(6) 0.3245(5) -0.0483(4) 0.0412(14) Uani 1 1 d . . .
H2 H 0.9752 0.3615 -0.0942 0.049 Uiso 1 1 calc R . .
C3 C 0.7938(6) 0.2603(5) -0.0759(4) 0.0401(14) Uani 1 1 d . . .
H3 H 0.7535 0.2538 -0.1416 0.048 Uiso 1 1 calc R . .
C4 C 0.7206(6) 0.2050(5) -0.0092(4) 0.0380(13) Uani 1 1 d . . .
H4 H 0.6305 0.1597 -0.0283 0.046 Uiso 1 1 calc R . .
C5 C 0.7813(5) 0.2168(4) 0.0861(4) 0.0295(11) Uani 1 1 d . . .
C6 C 0.7140(5) 0.1627(4) 0.1645(4) 0.0304(11) Uani 1 1 d . . .
C7 C 0.5822(6) 0.0937(5) 0.1507(4) 0.0372(13) Uani 1 1 d . . .
H7 H 0.5291 0.0803 0.0886 0.045 Uiso 1 1 calc R . .
C8 C 0.5295(6) 0.0445(5) 0.2292(5) 0.0427(14) Uani 1 1 d . . .
H8 H 0.4404 -0.0043 0.2212 0.051 Uiso 1 1 calc R . .
C9 C 0.6076(6) 0.0674(5) 0.3178(4) 0.0387(13) Uani 1 1 d . . .
H9 H 0.5728 0.0351 0.3722 0.046 Uiso 1 1 calc R . .
C10 C 0.7375(5) 0.1377(5) 0.3286(4) 0.0354(12) Uani 1 1 d . . .
H10 H 0.7899 0.1536 0.3912 0.042 Uiso 1 1 calc R . .
C11 C 0.9712(6) 0.0538(5) 0.1812(4) 0.0404(14) Uani 1 1 d . . .
H11 H 0.8819 0.0281 0.1880 0.048 Uiso 1 1 calc R . .
C12 C 1.0190(7) -0.0229(6) 0.1406(5) 0.0481(16) Uani 1 1 d . . .
H12 H 0.9634 -0.1003 0.1197 0.058 Uiso 1 1 calc R . .
C13 C 1.1482(7) 0.0149(6) 0.1311(5) 0.0517(17) Uani 1 1 d . . .
H13 H 1.1833 -0.0371 0.1054 0.062 Uiso 1 1 calc R . .
C14 C 1.2261(7) 0.1264(6) 0.1583(5) 0.0489(16) Uani 1 1 d . . .
H14 H 1.3153 0.1533 0.1513 0.059 Uiso 1 1 calc R . .
C15 C 1.1726(6) 0.2001(5) 0.1965(4) 0.0391(14) Uani 1 1 d . . .
C16 C 1.2475(6) 0.3240(5) 0.2237(4) 0.0367(13) Uani 1 1 d . . .
C17 C 1.3786(6) 0.3774(6) 0.2192(5) 0.0505(17) Uani 1 1 d . . .
H17 H 1.4270 0.3342 0.1987 0.061 Uiso 1 1 calc R . .
C18 C 1.4392(7) 0.4961(7) 0.2453(6) 0.063(2) Uani 1 1 d . . .
H18 H 1.5291 0.5344 0.2428 0.076 Uiso 1 1 calc R . .
C19 C 1.3664(7) 0.5551(6) 0.2743(6) 0.0575(19) Uani 1 1 d . . .
H19 H 1.4052 0.6354 0.2921 0.069 Uiso 1 1 calc R . .
C20 C 1.2369(6) 0.4979(5) 0.2776(5) 0.0425(14) Uani 1 1 d . . .
H20 H 1.1881 0.5408 0.2980 0.051 Uiso 1 1 calc R . .
C21 C 0.8721(5) 0.4803(4) 0.2455(4) 0.0279(11) Uani 1 1 d . . .
H21 H 0.8481 0.4535 0.1777 0.034 Uiso 1 1 calc R . .
C22 C 0.8434(5) 0.5708(4) 0.2791(4) 0.0306(11) Uani 1 1 d . . .
H22 H 0.8006 0.6049 0.2350 0.037 Uiso 1 1 calc R . .
C23 C 0.8772(5) 0.6139(4) 0.3794(4) 0.0268(11) Uani 1 1 d . . .
C24 C 0.9391(5) 0.5583(4) 0.4399(3) 0.0235(10) Uani 1 1 d . . .
C25 C 0.9635(5) 0.4653(4) 0.3994(4) 0.0240(10) Uani 1 1 d . . .
C26 C 1.0237(4) 0.4038(4) 0.4589(4) 0.0228(10) Uani 1 1 d . . .
C27 C 1.0950(5) 0.2523(4) 0.4742(4) 0.0260(10) Uani 1 1 d . . .
C28 C 1.1004(5) 0.1505(5) 0.4329(4) 0.0329(12) Uani 1 1 d . . .
H28 H 1.0653 0.1231 0.3660 0.039 Uiso 1 1 calc R . .
C29 C 1.1569(6) 0.0892(5) 0.4891(4) 0.0413(14) Uani 1 1 d . . .
H29 H 1.1612 0.0205 0.4604 0.050 Uiso 1 1 calc R . .
C30 C 1.2074(6) 0.1280(5) 0.5873(5) 0.0432(15) Uani 1 1 d . . .
H30 H 1.2474 0.0866 0.6252 0.052 Uiso 1 1 calc R . .
C31 C 1.1994(6) 0.2255(5) 0.6293(4) 0.0340(12) Uani 1 1 d . . .
H31 H 1.2336 0.2507 0.6965 0.041 Uiso 1 1 calc R . .
C32 C 1.1420(5) 0.2892(4) 0.5757(4) 0.0277(11) Uani 1 1 d . . .
O33 O 0.7485(6) 0.5079(6) 0.0167(4) 0.0774(17) Uani 1 1 d . . .
H33A H 0.7784 0.5837 0.0331 0.012(12) Uiso 1 1 d R . .
H33B H 0.6619 0.4743 0.0275 0.06(2) Uiso 1 1 d R . .
N34 N 0.6372(14) 0.3537(14) 0.3549(13) 0.092(6) Uani 0.517(12) 1 d P A 1
C35 C 0.5569(13) 0.3071(13) 0.3968(11) 0.057(4) Uani 0.517(12) 1 d P A 1
C36 C 0.4538(14) 0.2432(14) 0.4372(12) 0.066(5) Uani 0.517(12) 1 d P A 1
H36A H 0.3898 0.2798 0.4354 0.099 Uiso 0.517(12) 1 calc PR A 1
H36B H 0.4843 0.2373 0.5050 0.099 Uiso 0.517(12) 1 calc PR A 1
H36C H 0.4132 0.1667 0.4002 0.099 Uiso 0.517(12) 1 calc PR A 1
N34' N 0.6310(15) 0.5044(18) 0.4926(15) 0.116(9) Uani 0.483(12) 1 d P A 2
C35' C 0.5615(15) 0.4132(19) 0.4767(15) 0.085(7) Uani 0.483(12) 1 d P A 2
C36' C 0.4667(17) 0.2997(17) 0.4732(13) 0.086(7) Uani 0.483(12) 1 d P A 2
H36D H 0.5112 0.2459 0.4792 0.128 Uiso 0.483(12) 1 calc PR A 2
H36E H 0.4066 0.2787 0.4109 0.128 Uiso 0.483(12) 1 calc PR A 2
H36C H 0.4177 0.2972 0.5269 0.128 Uiso 0.483(12) 1 calc PR A 2
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'
Os Os -1.2165 7.6030 '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'
F F 0.0171 0.0103 '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'
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 Os N4 93.94(17) . . ?
N1 Os N3 88.81(17) . . ?
N4 Os N3 78.69(17) . . ?
N1 Os N5 97.22(18) . . ?
N4 Os N5 96.79(18) . . ?
N3 Os N5 172.74(17) . . ?
N1 Os N2 78.54(16) . . ?
N4 Os N2 171.79(16) . . ?
N3 Os N2 97.69(16) . . ?
N5 Os N2 87.51(17) . . ?
N1 Os N6 175.00(16) . . ?
N4 Os N6 83.97(17) . . ?
N3 Os N6 95.21(17) . . ?
N5 Os N6 78.56(18) . . ?
N2 Os N6 103.79(16) . . ?
F2 P1 F3 92.7(4) . . ?
F2 P1 F4 89.3(3) . . ?
F3 P1 F4 90.1(3) . . ?
F2 P1 F5 177.6(4) . . ?
F3 P1 F5 89.7(3) . . ?
F4 P1 F5 90.7(3) . . ?
F2 P1 F1 88.8(3) . . ?
F3 P1 F1 88.9(3) . . ?
F4 P1 F1 177.8(3) . . ?
F5 P1 F1 91.2(3) . . ?
F2 P1 F6 88.6(3) . . ?
F3 P1 F6 178.0(4) . . ?
F4 P1 F6 91.5(3) . . ?
F5 P1 F6 89.0(3) . . ?
F1 P1 F6 89.6(3) . . ?
F11 P2 F7 89.6(3) . . ?
F11 P2 F10 91.2(2) . . ?
F7 P2 F10 179.2(3) . . ?
F11 P2 F12 89.4(2) . . ?
F7 P2 F12 91.2(2) . . ?
F10 P2 F12 88.7(2) . . ?
F11 P2 F8 179.9(3) . . ?
F7 P2 F8 90.5(2) . . ?
F10 P2 F8 88.7(2) . . ?
F12 P2 F8 90.5(2) . . ?
F11 P2 F9 90.2(2) . . ?
F7 P2 F9 89.8(2) . . ?
F10 P2 F9 90.3(2) . . ?
F12 P2 F9 178.9(2) . . ?
F8 P2 F9 89.9(2) . . ?
C25 N1 C21 115.8(4) . . ?
C25 N1 Os 116.5(3) . . ?
C21 N1 Os 127.8(4) . . ?
C26 N2 C27 115.8(4) . . ?
C26 N2 Os 112.9(3) . . ?
C27 N2 Os 131.2(3) . . ?
C1 N4 C5 117.5(5) . . ?
C1 N4 Os 125.9(4) . . ?
C5 N4 Os 116.5(3) . . ?
C10 N3 C6 117.7(4) . . ?
C10 N3 Os 126.2(4) . . ?
C6 N3 Os 116.1(3) . . ?
C11 N6 C15 118.8(5) . . ?
C11 N6 Os 125.5(4) . . ?
C15 N6 Os 115.1(4) . . ?
C20 N5 C16 117.9(5) . . ?
C20 N5 Os 126.2(4) . . ?
C16 N5 Os 115.9(4) . . ?
N4 C1 C2 123.0(6) . . ?
N4 C1 H1 118.5 . . ?
C2 C1 H1 118.5 . . ?
C3 C2 C1 118.3(5) . . ?
C3 C2 H2 120.8 . . ?
C1 C2 H2 120.8 . . ?
C2 C3 C4 120.5(6) . . ?
C2 C3 H3 119.7 . . ?
C4 C3 H3 119.7 . . ?
C3 C4 C5 118.6(6) . . ?
C3 C4 H4 120.7 . . ?
C5 C4 H4 120.7 . . ?
N4 C5 C4 122.1(5) . . ?
N4 C5 C6 114.0(5) . . ?
C4 C5 C6 123.9(5) . . ?
N3 C6 C7 121.6(5) . . ?
N3 C6 C5 114.6(5) . . ?
C7 C6 C5 123.7(5) . . ?
C8 C7 C6 118.9(5) . . ?
C8 C7 H7 120.5 . . ?
C6 C7 H7 120.5 . . ?
C9 C8 C7 119.1(5) . . ?
C9 C8 H8 120.5 . . ?
C7 C8 H8 120.5 . . ?
C8 C9 C10 120.0(5) . . ?
C8 C9 H9 120.0 . . ?
C10 C9 H9 120.0 . . ?
N3 C10 C9 122.6(5) . . ?
N3 C10 H10 118.7 . . ?
C9 C10 H10 118.7 . . ?
N6 C11 C12 121.7(6) . . ?
N6 C11 H11 119.2 . . ?
C12 C11 H11 119.2 . . ?
C13 C12 C11 118.8(6) . . ?
C13 C12 H12 120.6 . . ?
C11 C12 H12 120.6 . . ?
C14 C13 C12 120.2(6) . . ?
C14 C13 H13 119.9 . . ?
C12 C13 H13 119.9 . . ?
C13 C14 C15 118.6(6) . . ?
C13 C14 H14 120.7 . . ?
C15 C14 H14 120.7 . . ?
N6 C15 C14 121.7(6) . . ?
N6 C15 C16 115.5(5) . . ?
C14 C15 C16 122.7(6) . . ?
N5 C16 C17 121.0(6) . . ?
N5 C16 C15 114.8(5) . . ?
C17 C16 C15 124.2(6) . . ?
C16 C17 C18 119.2(6) . . ?
C16 C17 H17 120.4 . . ?
C18 C17 H17 120.4 . . ?
C19 C18 C17 118.6(6) . . ?
C19 C18 H18 120.7 . . ?
C17 C18 H18 120.7 . . ?
C18 C19 C20 119.7(7) . . ?
C18 C19 H19 120.1 . . ?
C20 C19 H19 120.1 . . ?
N5 C20 C19 123.5(6) . . ?
N5 C20 H20 118.2 . . ?
C19 C20 H20 118.2 . . ?
C22 C21 N1 124.2(5) . . ?
C22 C21 H21 117.9 . . ?
N1 C21 H21 117.9 . . ?
C21 C22 C23 120.1(5) . . ?
C21 C22 H22 120.0 . . ?
C23 C22 H22 120.0 . . ?
C24 C23 C22 116.6(5) . . ?
C24 C23 C32 117.2(5) . 2_766 ?
C22 C23 C32 126.2(5) . 2_766 ?
C25 C24 C23 119.6(5) . . ?
C25 C24 C26 120.3(4) . 2_766 ?
C23 C24 C26 120.1(5) . 2_766 ?
N1 C25 C24 123.8(4) . . ?
N1 C25 C26 114.7(4) . . ?
C24 C25 C26 121.6(4) . . ?
N2 C26 C24 124.7(4) . 2_766 ?
N2 C26 C25 117.2(4) . . ?
C24 C26 C25 118.1(4) 2_766 . ?
C28 C27 N2 118.1(5) . . ?
C28 C27 C32 119.2(5) . . ?
N2 C27 C32 122.7(5) . . ?
C29 C28 C27 120.3(5) . . ?
C29 C28 H28 119.9 . . ?
C27 C28 H28 119.9 . . ?
C28 C29 C30 120.2(6) . . ?
C28 C29 H29 119.9 . . ?
C30 C29 H29 119.9 . . ?
C31 C30 C29 120.1(5) . . ?
C31 C30 H30 119.9 . . ?
C29 C30 H30 119.9 . . ?
C30 C31 C32 121.6(5) . . ?
C30 C31 H31 119.2 . . ?
C32 C31 H31 119.2 . . ?
C31 C32 C27 118.5(5) . . ?
C31 C32 C23 122.1(5) . 2_766 ?
C27 C32 C23 119.3(4) . 2_766 ?
H33A O33 H33B 110.3 . . ?
N34 C35 C36 173(2) . . ?
N34' C35' C36' 170(3) . . ?
C35' C36' H36D 109.6 . . ?
C35' C36' H36E 109.4 . . ?
H36D C36' H36E 109.5 . . ?
C35' C36' H36C 109.4 . . ?
H36D C36' H36C 109.5 . . ?
H36E C36' H36C 109.5 . . ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Os N1 2.038(4) . ?
Os N3 2.057(4) . ?
Os N4 2.060(4) . ?
Os N6 2.065(4) . ?
Os N2 2.104(4) . ?
Os N5 2.113(4) . ?
P1 F2 1.574(5) . ?
P1 F3 1.576(6) . ?
P1 F4 1.578(5) . ?
P1 F5 1.584(5) . ?
P1 F1 1.588(5) . ?
P1 F6 1.606(6) . ?
P2 F11 1.580(4) . ?
P2 F7 1.584(4) . ?
P2 F10 1.589(4) . ?
P2 F12 1.589(4) . ?
P2 F8 1.592(4) . ?
P2 F9 1.601(4) . ?
N1 C25 1.354(6) . ?
N1 C21 1.369(6) . ?
N2 C26 1.353(6) . ?
N2 C27 1.410(6) . ?
N3 C10 1.344(7) . ?
N3 C6 1.376(7) . ?
N4 C1 1.346(7) . ?
N4 C5 1.375(7) . ?
N5 C20 1.330(7) . ?
N5 C16 1.383(7) . ?
N6 C11 1.335(7) . ?
N6 C15 1.352(7) . ?
C1 C2 1.389(8) . ?
C1 H1 0.9500 . ?
C2 C3 1.372(9) . ?
C2 H2 0.9500 . ?
C3 C4 1.381(8) . ?
C3 H3 0.9500 . ?
C4 C5 1.383(8) . ?
C4 H4 0.9500 . ?
C5 C6 1.477(7) . ?
C6 C7 1.393(8) . ?
C7 C8 1.392(8) . ?
C7 H7 0.9500 . ?
C8 C9 1.362(8) . ?
C8 H8 0.9500 . ?
C9 C10 1.381(8) . ?
C9 H9 0.9500 . ?
C10 H10 0.9500 . ?
C11 C12 1.387(8) . ?
C11 H11 0.9500 . ?
C12 C13 1.374(10) . ?
C12 H12 0.9500 . ?
C13 C14 1.358(10) . ?
C13 H13 0.9500 . ?
C14 C15 1.387(8) . ?
C14 H14 0.9500 . ?
C15 C16 1.480(9) . ?
C16 C17 1.385(8) . ?
C17 C18 1.405(10) . ?
C17 H17 0.9500 . ?
C18 C19 1.365(10) . ?
C18 H18 0.9500 . ?
C19 C20 1.372(9) . ?
C19 H19 0.9500 . ?
C20 H20 0.9500 . ?
C21 C22 1.365(7) . ?
C21 H21 0.9500 . ?
C22 C23 1.415(7) . ?
C22 H22 0.9500 . ?
C23 C24 1.403(7) . ?
C23 C32 1.434(7) 2_766 ?
C24 C25 1.398(7) . ?
C24 C26 1.415(7) 2_766 ?
C25 C26 1.439(7) . ?
C26 C24 1.415(7) 2_766 ?
C27 C28 1.399(7) . ?
C27 C32 1.425(7) . ?
C28 C29 1.389(8) . ?
C28 H28 0.9500 . ?
C29 C30 1.392(9) . ?
C29 H29 0.9500 . ?
C30 C31 1.365(8) . ?
C30 H30 0.9500 . ?
C31 C32 1.398(7) . ?
C31 H31 0.9500 . ?
C32 C23 1.435(7) 2_766 ?
O33 H33A 0.8961 . ?
O33 H33B 0.9420 . ?
N34 C35 1.139(18) . ?
C35 C36 1.36(2) . ?
C36 H36A 0.9800 . ?
C36 H36B 0.9800 . ?
C36 H36C 0.9800 . ?
N34' C35' 1.12(3) . ?
C35' C36' 1.44(3) . ?
C36' H36D 0.9800 . ?
C36' H36E 0.9800 . ?
C36' H36C 0.9800 . ?
