#------------------------------------------------------------------------------
#$Date: 2016-03-21 10:35:27 +0200 (Mon, 21 Mar 2016) $
#$Revision: 178658 $
#$URL: svn://www.crystallography.net/cod/cif/4/07/69/4076937.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_4076937
loop_
_publ_author_name
'Lindner, Ekkehard'
'Ayasse, Christoph S.'
'Eichele, Klaus'
'Steimann, Manfred'
_publ_section_title
;
 Macrocyclic Di- and Tetranuclear Osmacycloferrocenophanes†,1
;
_journal_issue                   20
_journal_name_full               Organometallics
_journal_page_first              4217
_journal_paper_doi               10.1021/om020310l
_journal_volume                  21
_journal_year                    2002
_chemical_formula_moiety         'C84 H96 Fe2 O8 Os2, C6 H14'
_chemical_formula_sum            'C90 H110 Fe2 O8 Os2'
_chemical_formula_weight         1811.88
_chemical_name_common            'compound 4h * n-hexane'
_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                93.038(8)
_cell_angle_beta                 92.63(2)
_cell_angle_gamma                104.982(9)
_cell_formula_units_Z            1
_cell_length_a                   6.6774(19)
_cell_length_b                   11.1945(16)
_cell_length_c                   29.219(4)
_cell_measurement_reflns_used    28
_cell_measurement_temperature    173(2)
_cell_measurement_theta_max      12.36
_cell_measurement_theta_min      5.11
_cell_volume                     2102.9(7)
_computing_cell_refinement       'Bruker XSCANS'
_computing_data_collection       'Bruker XSCANS'
_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      173(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Bruker P4'
_diffrn_measurement_method       '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  0.0430
_diffrn_reflns_av_sigmaI/netI    0.1009
_diffrn_reflns_limit_h_max       1
_diffrn_reflns_limit_h_min       -8
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       37
_diffrn_reflns_limit_l_min       -37
_diffrn_reflns_number            12141
_diffrn_reflns_theta_full        27.50
_diffrn_reflns_theta_max         27.50
_diffrn_reflns_theta_min         2.06
_diffrn_standards_interval_count 98
_diffrn_standards_number         2
_exptl_absorpt_coefficient_mu    3.402
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.431
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       needle
_exptl_crystal_F_000             918
_exptl_crystal_size_max          0.50
_exptl_crystal_size_mid          0.08
_exptl_crystal_size_min          0.08
_refine_diff_density_max         2.061
_refine_diff_density_min         -1.243
_refine_diff_density_rms         0.129
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.018
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     446
_refine_ls_number_reflns         9664
_refine_ls_number_restraints     14
_refine_ls_restrained_S_all      1.020
_refine_ls_R_factor_all          0.1299
_refine_ls_R_factor_gt           0.0666
_refine_ls_shift/su_max          2.297
_refine_ls_shift/su_mean         0.028
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0671P)²+2.2041P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1363
_refine_ls_wR_factor_ref         0.1621
_reflns_number_gt                5680
_reflns_number_total             9664
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            om020310l.cif
_cod_data_source_block           ayasse06
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
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_values 1715 2011-07-08 13:25:40Z adriana 
;
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               4076937
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
Os1 Os -0.17143(7) 0.54761(4) 0.583692(12) 0.06178(17) Uani 1 1 d D
Fe1 Fe 0.74862(14) -0.24813(8) 1.00140(3) 0.0259(2) Uani 1 1 d .
C1 C 0.1109(16) 0.6439(12) 0.5762(4) 0.091(4) Uani 1 1 d D
O1 O 0.2811(14) 0.6963(11) 0.5734(3) 0.132(4) Uani 1 1 d D
C2 C -0.2913(16) 0.6136(9) 0.5322(3) 0.070(3) Uani 1 1 d D
O2 O -0.3640(13) 0.6543(7) 0.5025(2) 0.095(2) Uani 1 1 d D
C3 C -0.1434(18) 0.4000(10) 0.5499(3) 0.080(3) Uani 1 1 d D
O3 O -0.1203(16) 0.3152(9) 0.5294(3) 0.112(3) Uani 1 1 d D
C4 C -0.4338(18) 0.4626(10) 0.6031(3) 0.120(7) Uani 1 1 d D
O4 O -0.5931(13) 0.4097(9) 0.6174(3) 0.100(3) Uani 1 1 d D
C5 C -0.0396(16) 0.4913(9) 0.6480(3) 0.066(3) Uani 1 1 d .
H5A H 0.1127 0.5270 0.6498 0.079 Uiso 1 1 calc R
H5B H -0.0950 0.5288 0.6744 0.079 Uiso 1 1 calc R
C6 C -0.0833(16) 0.3512(9) 0.6533(3) 0.070(3) Uani 1 1 d .
H6A H -0.2352 0.3156 0.6535 0.084 Uiso 1 1 calc R
H6B H -0.0343 0.3123 0.6263 0.084 Uiso 1 1 calc R
C7 C 0.0200(16) 0.3184(9) 0.6966(3) 0.063(3) Uani 1 1 d .
H7A H 0.1703 0.3604 0.6980 0.076 Uiso 1 1 calc R
H7B H -0.0395 0.3494 0.7238 0.076 Uiso 1 1 calc R
C8 C -0.0083(15) 0.1814(9) 0.6982(3) 0.065(3) Uani 1 1 d .
H8A H 0.0290 0.1485 0.6686 0.078 Uiso 1 1 calc R
H8B H -0.1567 0.1412 0.7019 0.078 Uiso 1 1 calc R
C9 C 0.1216(14) 0.1469(8) 0.7369(3) 0.051(2) Uani 1 1 d .
C10 C 0.0322(14) 0.0917(9) 0.7749(3) 0.063(2) Uani 1 1 d .
H10 H -0.1140 0.0740 0.7769 0.075 Uiso 1 1 calc R
C11 C 0.1535(12) 0.0619(8) 0.8103(3) 0.051(2) Uani 1 1 d .
H11 H 0.0880 0.0269 0.8365 0.061 Uiso 1 1 calc R
C12 C 0.3627(12) 0.0810(6) 0.8087(2) 0.0397(17) Uani 1 1 d .
C13 C 0.4500(15) 0.1376(10) 0.7707(3) 0.071(3) Uani 1 1 d .
H13 H 0.5963 0.1551 0.7687 0.085 Uiso 1 1 calc R
C14 C 0.3331(17) 0.1695(10) 0.7357(3) 0.076(3) Uani 1 1 d .
H14 H 0.4001 0.2079 0.7103 0.091 Uiso 1 1 calc R
C15 C 0.4932(12) 0.0451(6) 0.8462(2) 0.0389(17) Uani 1 1 d .
H15A H 0.4903 0.0973 0.8745 0.047 Uiso 1 1 calc R
H15B H 0.6388 0.0642 0.8372 0.047 Uiso 1 1 calc R
C16 C 0.4274(12) -0.0894(7) 0.8572(2) 0.0405(17) Uani 1 1 d .
H16A H 0.4130 -0.1425 0.8284 0.049 Uiso 1 1 calc R
H16B H 0.2897 -0.1063 0.8704 0.049 Uiso 1 1 calc R
C17 C 0.5811(11) -0.1235(6) 0.8908(2) 0.0352(16) Uani 1 1 d .
H17A H 0.5915 -0.0724 0.9200 0.042 Uiso 1 1 calc R
H17B H 0.7199 -0.1035 0.8781 0.042 Uiso 1 1 calc R
C18 C 0.5199(10) -0.2602(6) 0.9008(2) 0.0311(15) Uani 1 1 d .
H18A H 0.3838 -0.2790 0.9147 0.037 Uiso 1 1 calc R
H18B H 0.5028 -0.3110 0.8714 0.037 Uiso 1 1 calc R
C19 C 0.6755(10) -0.2983(6) 0.9326(2) 0.0285(14) Uani 1 1 d .
C20 C 0.8916(11) -0.2400(6) 0.9402(2) 0.0346(16) Uani 1 1 d .
H20 H 0.9653 -0.1677 0.9265 0.042 Uiso 1 1 calc R
C21 C 0.9793(11) -0.3090(6) 0.9720(2) 0.0368(16) Uani 1 1 d .
H21 H 1.1199 -0.2897 0.9837 0.044 Uiso 1 1 calc R
C22 C 0.8177(10) -0.4108(6) 0.9828(2) 0.0325(15) Uani 1 1 d .
H22 H 0.8309 -0.4732 1.0026 0.039 Uiso 1 1 calc R
C23 C 0.6324(10) -0.4034(6) 0.9588(2) 0.0310(15) Uani 1 1 d .
H23 H 0.5000 -0.4602 0.9601 0.037 Uiso 1 1 calc R
C24 C 0.2684(10) 0.2378(6) 0.9281(2) 0.0286(14) Uani 1 1 d .
C25 C 0.4673(10) 0.2460(6) 0.9508(2) 0.0288(14) Uani 1 1 d .
H25 H 0.5917 0.3087 0.9478 0.035 Uiso 1 1 calc R
C26 C 0.4443(11) 0.1431(6) 0.9785(2) 0.0328(15) Uani 1 1 d .
H26 H 0.5514 0.1254 0.9974 0.039 Uiso 1 1 calc R
C27 C 0.2354(10) 0.0715(6) 0.9733(2) 0.0317(15) Uani 1 1 d .
H27 H 0.1782 -0.0023 0.9880 0.038 Uiso 1 1 calc R
C28 C 0.1260(10) 0.1289(6) 0.9422(2) 0.0297(14) Uani 1 1 d .
H28 H -0.0169 0.1000 0.9324 0.036 Uiso 1 1 calc R
C29 C 0.2266(11) 0.3240(6) 0.8928(2) 0.0362(16) Uani 1 1 d .
H29A H 0.2581 0.2932 0.8623 0.043 Uiso 1 1 calc R
H29B H 0.3232 0.4070 0.9001 0.043 Uiso 1 1 calc R
C30 C 0.0046(11) 0.3378(7) 0.8898(3) 0.0396(17) Uani 1 1 d .
H30A H -0.0275 0.3705 0.9200 0.048 Uiso 1 1 calc R
H30B H -0.0935 0.2553 0.8826 0.048 Uiso 1 1 calc R
C31 C -0.0259(12) 0.4256(7) 0.8528(3) 0.0460(19) Uani 1 1 d .
H31A H 0.0747 0.5074 0.8595 0.055 Uiso 1 1 calc R
H31B H 0.0023 0.3917 0.8225 0.055 Uiso 1 1 calc R
C32 C -0.2406(13) 0.4414(8) 0.8508(3) 0.049(2) Uani 1 1 d .
H32A H -0.2696 0.4691 0.8820 0.059 Uiso 1 1 calc R
H32B H -0.3384 0.3592 0.8429 0.059 Uiso 1 1 calc R
C33 C -0.2882(13) 0.5315(7) 0.8175(3) 0.0452(19) Uani 1 1 d .
C34 C -0.1504(15) 0.6473(8) 0.8134(3) 0.061(2) Uani 1 1 d .
H34 H -0.0190 0.6672 0.8300 0.073 Uiso 1 1 calc R
C35 C -0.1997(16) 0.7333(8) 0.7861(3) 0.064(3) Uani 1 1 d .
H35 H -0.1017 0.8108 0.7837 0.076 Uiso 1 1 calc R
C36 C -0.3960(16) 0.7069(9) 0.7615(3) 0.059(2) Uani 1 1 d .
C37 C -0.5294(17) 0.5916(9) 0.7654(3) 0.072(3) Uani 1 1 d .
H37 H -0.6605 0.5704 0.7487 0.087 Uiso 1 1 calc R
C38 C -0.4775(14) 0.5056(8) 0.7930(3) 0.058(2) Uani 1 1 d .
H38 H -0.5743 0.4275 0.7951 0.069 Uiso 1 1 calc R
C39 C -0.448(2) 0.8001(9) 0.7315(3) 0.091(4) Uani 1 1 d .
H39A H -0.5933 0.7690 0.7188 0.110 Uiso 1 1 calc R
H39B H -0.4365 0.8783 0.7501 0.110 Uiso 1 1 calc R
C40 C -0.307(2) 0.8253(10) 0.6930(3) 0.095(4) Uani 1 1 d .
H40A H -0.1609 0.8548 0.7056 0.114 Uiso 1 1 calc R
H40B H -0.3388 0.8915 0.6751 0.114 Uiso 1 1 calc R
C41 C -0.3313(18) 0.7050(9) 0.6602(3) 0.075(3) Uani 1 1 d .
H41A H -0.3260 0.6352 0.6793 0.090 Uiso 1 1 calc R
H41B H -0.4703 0.6845 0.6438 0.090 Uiso 1 1 calc R
C42 C -0.175(2) 0.7146(11) 0.6262(3) 0.088(4) Uani 1 1 d .
H42A H -0.0364 0.7457 0.6426 0.106 Uiso 1 1 calc R
H42B H -0.1917 0.7785 0.6052 0.106 Uiso 1 1 calc R
C60 C 0.423(6) 0.048(4) 0.5816(14) 0.40(2) Uiso 1 1 d D
H60A H 0.4764 0.1244 0.6015 0.606 Uiso 1 1 calc R
H60B H 0.5118 0.0487 0.5559 0.606 Uiso 1 1 calc R
H60C H 0.4211 -0.0237 0.5993 0.606 Uiso 1 1 calc R
C61 C 0.190(6) 0.041(4) 0.5622(14) 0.37(2) Uiso 1 1 d D
H61A H 0.0948 -0.0180 0.5803 0.446 Uiso 1 1 calc R
H61B H 0.1662 0.1238 0.5695 0.446 Uiso 1 1 calc R
C62 C 0.118(5) 0.006(4) 0.5108(14) 0.34(2) Uiso 1 1 d D
H62A H 0.1469 -0.0756 0.5035 0.402 Uiso 1 1 calc R
H62B H 0.2132 0.0663 0.4929 0.402 Uiso 1 1 calc R
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'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Fe Fe 0.3463 0.8444 '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
C4 Os1 C3 91.6(5) . .
C4 Os1 C2 93.3(4) . .
C3 Os1 C2 95.8(4) . .
C4 Os1 C1 169.0(4) . .
C3 Os1 C1 95.1(6) . .
C2 Os1 C1 94.6(4) . .
C4 Os1 C42 91.2(4) . .
C3 Os1 C42 174.2(4) . .
C2 Os1 C42 89.1(4) . .
C1 Os1 C42 81.4(5) . .
C4 Os1 C5 86.0(4) . .
C3 Os1 C5 91.2(4) . .
C2 Os1 C5 173.0(4) . .
C1 Os1 C5 85.2(4) . .
C42 Os1 C5 84.0(4) . .
C4 Os1 Fe1 76.3(3) . 2_657
C3 Os1 Fe1 98.2(3) . 2_657
C2 Os1 Fe1 162.7(3) . 2_657
C1 Os1 Fe1 94.1(3) . 2_657
C42 Os1 Fe1 77.6(2) . 2_657
C5 Os1 Fe1 11.9(3) . 2_657
C4 Os1 Fe1 83.3(3) . .
C3 Os1 Fe1 76.8(3) . .
C2 Os1 Fe1 171.7(3) . .
C1 Os1 Fe1 89.7(3) . .
C42 Os1 Fe1 98.5(2) . .
C5 Os1 Fe1 14.8(3) . .
Fe1 Os1 Fe1 22.347(8) 2_657 .
C4 Os1 Os1 80.1(3) . 2_657
C3 Os1 Os1 86.0(3) . 2_657
C2 Os1 Os1 173.3(3) . 2_657
C1 Os1 Os1 91.7(3) . 2_657
C42 Os1 Os1 89.5(2) . 2_657
C5 Os1 Os1 8.0(3) . 2_657
Fe1 Os1 Os1 12.724(5) 2_657 2_657
Fe1 Os1 Os1 9.623(4) . 2_657
C23 Fe1 C26 119.3(3) . 2_657
C23 Fe1 C21 68.2(3) . .
C26 Fe1 C21 163.6(3) 2_657 .
C23 Fe1 C22 40.6(3) . .
C26 Fe1 C22 154.2(3) 2_657 .
C21 Fe1 C22 40.4(3) . .
C23 Fe1 C27 154.3(3) . 2_657
C26 Fe1 C27 40.5(3) 2_657 2_657
C21 Fe1 C27 127.0(3) . 2_657
C22 Fe1 C27 164.0(3) . 2_657
C23 Fe1 C25 106.7(3) . 2_657
C26 Fe1 C25 40.7(2) 2_657 2_657
C21 Fe1 C25 154.8(3) . 2_657
C22 Fe1 C25 119.7(3) . 2_657
C27 Fe1 C25 68.3(3) 2_657 2_657
C23 Fe1 C19 40.3(2) . .
C26 Fe1 C19 106.7(3) 2_657 .
C21 Fe1 C19 68.8(3) . .
C22 Fe1 C19 68.4(3) . .
C27 Fe1 C19 120.2(3) 2_657 .
C25 Fe1 C19 124.2(3) 2_657 .
C23 Fe1 C20 67.5(3) . .
C26 Fe1 C20 125.7(3) 2_657 .
C21 Fe1 C20 41.0(3) . .
C22 Fe1 C20 68.0(3) . .
C27 Fe1 C20 109.0(3) 2_657 .
C25 Fe1 C20 161.9(3) 2_657 .
C19 Fe1 C20 40.4(3) . .
C23 Fe1 C28 163.3(3) . 2_657
C26 Fe1 C28 68.0(3) 2_657 2_657
C21 Fe1 C28 109.1(3) . 2_657
C22 Fe1 C28 126.7(3) . 2_657
C27 Fe1 C28 40.4(2) 2_657 2_657
C25 Fe1 C28 68.2(3) 2_657 2_657
C19 Fe1 C28 155.7(3) . 2_657
C20 Fe1 C28 122.1(3) . 2_657
C23 Fe1 C24 125.4(3) . 2_657
C26 Fe1 C24 68.4(3) 2_657 2_657
C21 Fe1 C24 120.7(3) . 2_657
C22 Fe1 C24 107.8(3) . 2_657
C27 Fe1 C24 68.3(3) 2_657 2_657
C25 Fe1 C24 40.8(2) 2_657 2_657
C19 Fe1 C24 161.7(3) . 2_657
C20 Fe1 C24 156.5(3) . 2_657
C28 Fe1 C24 40.5(2) 2_657 2_657
C23 Fe1 Fe1 119.43(19) . 2_657
C26 Fe1 Fe1 22.37(19) 2_657 2_657
C21 Fe1 Fe1 141.7(2) . 2_657
C22 Fe1 Fe1 159.79(19) . 2_657
C27 Fe1 Fe1 35.14(19) 2_657 2_657
C25 Fe1 Fe1 63.02(17) 2_657 2_657
C19 Fe1 Fe1 93.23(18) . 2_657
C20 Fe1 Fe1 103.89(19) . 2_657
C28 Fe1 Fe1 73.46(18) 2_657 2_657
C24 Fe1 Fe1 86.83(18) 2_657 2_657
C23 Fe1 Os1 86.45(18) . .
C26 Fe1 Os1 63.05(19) 2_657 .
C21 Fe1 Os1 104.9(2) . .
C22 Fe1 Os1 119.10(19) . .
C27 Fe1 Os1 70.17(18) 2_657 .
C25 Fe1 Os1 99.19(17) 2_657 .
C19 Fe1 Os1 50.79(17) . .
C20 Fe1 Os1 63.93(19) . .
C28 Fe1 Os1 109.93(18) 2_657 .
C24 Fe1 Os1 130.79(18) 2_657 .
Fe1 Fe1 Os1 44.079(14) 2_657 .
O1 C1 Os1 176.2(10) . .
O2 C2 Os1 178.3(10) . .
O3 C3 Os1 177.6(12) . .
O4 C4 Os1 176.6(9) . .
C6 C5 Os1 116.2(6) . .
C7 C6 C5 113.7(8) . .
C8 C7 C6 112.2(8) . .
C7 C8 C9 113.5(7) . .
C14 C9 C10 117.0(8) . .
C14 C9 C8 121.4(8) . .
C10 C9 C8 121.6(8) . .
C9 C10 C11 120.9(8) . .
C12 C11 C10 122.2(8) . .
C11 C12 C13 116.1(7) . .
C11 C12 C15 122.4(7) . .
C13 C12 C15 121.6(7) . .
C14 C13 C12 122.5(9) . .
C9 C14 C13 121.2(8) . .
C12 C15 C16 115.3(6) . .
C15 C16 C17 112.6(6) . .
C16 C17 C18 113.0(6) . .
C19 C18 C17 114.2(5) . .
C23 C19 C20 107.0(6) . .
C23 C19 C18 125.6(6) . .
C20 C19 C18 127.4(6) . .
C23 C19 Fe1 69.1(4) . .
C20 C19 Fe1 69.9(4) . .
C18 C19 Fe1 128.4(5) . .
C19 C20 C21 108.4(6) . .
C19 C20 Fe1 69.7(4) . .
C21 C20 Fe1 68.8(4) . .
C22 C21 C20 107.3(6) . .
C22 C21 Fe1 69.8(4) . .
C20 C21 Fe1 70.2(4) . .
C21 C22 C23 108.0(6) . .
C21 C22 Fe1 69.8(4) . .
C23 C22 Fe1 69.5(4) . .
C19 C23 C22 109.3(6) . .
C19 C23 Fe1 70.6(4) . .
C22 C23 Fe1 69.9(4) . .
C28 C24 C25 107.5(5) . .
C28 C24 C29 127.3(6) . .
C25 C24 C29 125.0(6) . .
C28 C24 Fe1 69.7(3) . 2_657
C25 C24 Fe1 69.2(3) . 2_657
C29 C24 Fe1 130.3(5) . 2_657
C26 C25 C24 107.6(6) . .
C26 C25 Fe1 69.1(4) . 2_657
C24 C25 Fe1 70.0(4) . 2_657
C27 C26 C25 108.6(6) . .
C27 C26 Fe1 70.1(4) . 2_657
C25 C26 Fe1 70.3(4) . 2_657
C26 C27 C28 108.2(6) . .
C26 C27 Fe1 69.5(4) . 2_657
C28 C27 Fe1 70.4(4) . 2_657
C27 C28 C24 108.1(6) . .
C27 C28 Fe1 69.2(4) . 2_657
C24 C28 Fe1 69.8(3) . 2_657
C24 C29 C30 114.9(6) . .
C29 C30 C31 111.7(6) . .
C32 C31 C30 111.6(6) . .
C31 C32 C33 116.9(7) . .
C38 C33 C34 117.6(7) . .
C38 C33 C32 120.7(7) . .
C34 C33 C32 121.5(7) . .
C35 C34 C33 121.9(9) . .
C34 C35 C36 120.3(9) . .
C37 C36 C35 117.2(8) . .
C37 C36 C39 122.6(9) . .
C35 C36 C39 120.1(10) . .
C36 C37 C38 121.8(9) . .
C33 C38 C37 121.2(9) . .
C40 C39 C36 111.6(9) . .
C39 C40 C41 111.1(10) . .
C42 C41 C40 115.0(10) . .
C41 C42 Os1 118.4(8) . .
C62 C61 C60 122(3) . .
C61 C62 C62 124(4) . 2_556
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Os1 C4 1.892(13) .
Os1 C3 1.935(10) .
Os1 C2 1.940(7) .
Os1 C1 1.943(11) .
Os1 C42 2.193(12) .
Os1 C5 2.228(8) .
Os1 Fe1 13.124(2) 2_657
Os1 Fe1 17.292(3) .
Os1 Os1 29.850(5) 2_657
Fe1 C23 2.039(6) .
Fe1 C26 2.041(7) 2_657
Fe1 C21 2.043(7) .
Fe1 C22 2.044(6) .
Fe1 C27 2.049(6) 2_657
Fe1 C25 2.057(6) 2_657
Fe1 C19 2.060(6) .
Fe1 C20 2.061(7) .
Fe1 C28 2.065(6) 2_657
Fe1 C24 2.066(6) 2_657
Fe1 Fe1 7.173(2) 2_657
C1 O1 1.145(10) .
C2 O2 1.145(9) .
C3 O3 1.143(10) .
C4 O4 1.183(12) .
C5 C6 1.538(13) .
C6 C7 1.520(11) .
C7 C8 1.500(12) .
C8 C9 1.520(10) .
C9 C14 1.371(13) .
C9 C10 1.383(11) .
C10 C11 1.391(11) .
C11 C12 1.361(11) .
C12 C13 1.385(11) .
C12 C15 1.504(9) .
C13 C14 1.374(12) .
C15 C16 1.513(10) .
C16 C17 1.521(9) .
C17 C18 1.527(9) .
C18 C19 1.519(9) .
C19 C23 1.412(9) .
C19 C20 1.423(9) .
C20 C21 1.437(9) .
C21 C22 1.413(10) .
C22 C23 1.417(9) .
C24 C28 1.431(9) .
C24 C25 1.436(9) .
C24 C29 1.513(9) .
C24 Fe1 2.067(6) 2_657
C25 C26 1.423(9) .
C25 Fe1 2.057(6) 2_657
C26 C27 1.415(9) .
C26 Fe1 2.041(7) 2_657
C27 C28 1.420(9) .
C27 Fe1 2.049(6) 2_657
C28 Fe1 2.065(6) 2_657
C29 C30 1.529(10) .
C30 C31 1.541(9) .
C31 C32 1.488(11) .
C32 C33 1.519(10) .
C33 C38 1.378(11) .
C33 C34 1.397(12) .
C34 C35 1.376(12) .
C35 C36 1.418(13) .
C36 C37 1.379(13) .
C36 C39 1.496(12) .
C37 C38 1.389(12) .
C39 C40 1.494(16) .
C40 C41 1.579(14) .
C41 C42 1.464(14) .
C60 C61 1.61(3) .
C61 C62 1.55(3) .
C62 C62 1.65(6) 2_556
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_4
C4 Os1 Fe1 C23 70.6(4) . .
C3 Os1 Fe1 C23 -22.6(4) . .
C2 Os1 Fe1 C23 4(2) . .
C1 Os1 Fe1 C23 -117.9(4) . .
C42 Os1 Fe1 C23 160.9(4) . .
C5 Os1 Fe1 C23 170.3(11) . .
Fe1 Os1 Fe1 C23 140.52(19) 2_657 .
Os1 Os1 Fe1 C23 140.52(19) 2_657 .
C4 Os1 Fe1 C26 -55.0(4) . 2_657
C3 Os1 Fe1 C26 -148.2(4) . 2_657
C2 Os1 Fe1 C26 -122(2) . 2_657
C1 Os1 Fe1 C26 116.5(5) . 2_657
C42 Os1 Fe1 C26 35.3(4) . 2_657
C5 Os1 Fe1 C26 44.7(11) . 2_657
Fe1 Os1 Fe1 C26 14.9(2) 2_657 2_657
Os1 Os1 Fe1 C26 14.9(2) 2_657 2_657
C4 Os1 Fe1 C21 137.0(4) . .
C3 Os1 Fe1 C21 43.8(4) . .
C2 Os1 Fe1 C21 70(2) . .
C1 Os1 Fe1 C21 -51.6(5) . .
C42 Os1 Fe1 C21 -132.8(4) . .
C5 Os1 Fe1 C21 -123.4(11) . .
Fe1 Os1 Fe1 C21 -153.1(2) 2_657 .
Os1 Os1 Fe1 C21 -153.1(2) 2_657 .
C4 Os1 Fe1 C22 95.8(4) . .
C3 Os1 Fe1 C22 2.6(4) . .
C2 Os1 Fe1 C22 29(2) . .
C1 Os1 Fe1 C22 -92.7(5) . .
C42 Os1 Fe1 C22 -173.9(4) . .
C5 Os1 Fe1 C22 -164.5(11) . .
Fe1 Os1 Fe1 C22 165.7(2) 2_657 .
Os1 Os1 Fe1 C22 165.7(2) 2_657 .
C4 Os1 Fe1 C27 -98.6(4) . 2_657
C3 Os1 Fe1 C27 168.2(4) . 2_657
C2 Os1 Fe1 C27 -165(2) . 2_657
C1 Os1 Fe1 C27 72.9(4) . 2_657
C42 Os1 Fe1 C27 -8.3(4) . 2_657
C5 Os1 Fe1 C27 1.1(11) . 2_657
Fe1 Os1 Fe1 C27 -28.7(2) 2_657 2_657
Os1 Os1 Fe1 C27 -28.7(2) 2_657 2_657
C4 Os1 Fe1 C25 -35.7(4) . 2_657
C3 Os1 Fe1 C25 -129.0(4) . 2_657
C2 Os1 Fe1 C25 -102(2) . 2_657
C1 Os1 Fe1 C25 135.7(4) . 2_657
C42 Os1 Fe1 C25 54.5(4) . 2_657
C5 Os1 Fe1 C25 63.9(11) . 2_657
Fe1 Os1 Fe1 C25 34.14(19) 2_657 2_657
Os1 Os1 Fe1 C25 34.14(19) 2_657 2_657
C4 Os1 Fe1 C19 91.3(4) . .
C3 Os1 Fe1 C19 -1.9(4) . .
C2 Os1 Fe1 C19 25(2) . .
C1 Os1 Fe1 C19 -97.2(5) . .
C42 Os1 Fe1 C19 -178.4(4) . .
C5 Os1 Fe1 C19 -169.0(11) . .
Fe1 Os1 Fe1 C19 161.2(2) 2_657 .
Os1 Os1 Fe1 C19 161.2(2) 2_657 .
C4 Os1 Fe1 C20 137.3(4) . .
C3 Os1 Fe1 C20 44.1(4) . .
C2 Os1 Fe1 C20 71(2) . .
C1 Os1 Fe1 C20 -51.2(5) . .
C42 Os1 Fe1 C20 -132.4(4) . .
C5 Os1 Fe1 C20 -123.0(11) . .
Fe1 Os1 Fe1 C20 -152.8(2) 2_657 .
Os1 Os1 Fe1 C20 -152.8(2) 2_657 .
C4 Os1 Fe1 C28 -105.8(4) . 2_657
C3 Os1 Fe1 C28 161.0(4) . 2_657
C2 Os1 Fe1 C28 -172(2) . 2_657
C1 Os1 Fe1 C28 65.7(4) . 2_657
C42 Os1 Fe1 C28 -15.6(4) . 2_657
C5 Os1 Fe1 C28 -6.1(11) . 2_657
Fe1 Os1 Fe1 C28 -35.92(19) 2_657 2_657
Os1 Os1 Fe1 C28 -35.92(19) 2_657 2_657
C4 Os1 Fe1 C24 -64.8(4) . 2_657
C3 Os1 Fe1 C24 -158.0(4) . 2_657
C2 Os1 Fe1 C24 -131(2) . 2_657
C1 Os1 Fe1 C24 106.7(5) . 2_657
C42 Os1 Fe1 C24 25.4(4) . 2_657
C5 Os1 Fe1 C24 34.8(11) . 2_657
Fe1 Os1 Fe1 C24 5.1(2) 2_657 2_657
Os1 Os1 Fe1 C24 5.1(2) 2_657 2_657
C4 Os1 Fe1 Fe1 -69.9(3) . 2_657
C3 Os1 Fe1 Fe1 -163.1(4) . 2_657
C2 Os1 Fe1 Fe1 -136(2) . 2_657
C1 Os1 Fe1 Fe1 101.6(4) . 2_657
C42 Os1 Fe1 Fe1 20.4(3) . 2_657
C5 Os1 Fe1 Fe1 29.8(11) . 2_657
Os1 Os1 Fe1 Fe1 0.0 2_657 2_657
C4 Os1 C1 O1 59(22) . .
C3 Os1 C1 O1 -68(20) . .
C2 Os1 C1 O1 -165(20) . .
C42 Os1 C1 O1 107(20) . .
C5 Os1 C1 O1 22(20) . .
Fe1 Os1 C1 O1 30(20) 2_657 .
Fe1 Os1 C1 O1 8(20) . .
Os1 Os1 C1 O1 18(20) 2_657 .
C4 Os1 C2 O2 67(34) . .
C3 Os1 C2 O2 159(34) . .
C1 Os1 C2 O2 -105(34) . .
C42 Os1 C2 O2 -24(34) . .
C5 Os1 C2 O2 -17(36) . .
Fe1 Os1 C2 O2 15(35) 2_657 .
Fe1 Os1 C2 O2 133(33) . .
Os1 Os1 C2 O2 54(35) 2_657 .
C4 Os1 C3 O3 177(100) . .
C2 Os1 C3 O3 84(21) . .
C1 Os1 C3 O3 -12(21) . .
C42 Os1 C3 O3 -64(23) . .
C5 Os1 C3 O3 -97(21) . .
Fe1 Os1 C3 O3 -107(21) 2_657 .
Fe1 Os1 C3 O3 -100(21) . .
Os1 Os1 C3 O3 -103(21) 2_657 .
C3 Os1 C4 O4 109(16) . .
C2 Os1 C4 O4 -155(16) . .
C1 Os1 C4 O4 -19(18) . .
C42 Os1 C4 O4 -66(16) . .
C5 Os1 C4 O4 18(16) . .
Fe1 Os1 C4 O4 11(16) 2_657 .
Fe1 Os1 C4 O4 32(16) . .
Os1 Os1 C4 O4 23(16) 2_657 .
C4 Os1 C5 C6 60.2(8) . .
C3 Os1 C5 C6 -31.3(8) . .
C2 Os1 C5 C6 145(3) . .
C1 Os1 C5 C6 -126.3(8) . .
C42 Os1 C5 C6 151.9(8) . .
Fe1 Os1 C5 C6 95.1(15) 2_657 .
Fe1 Os1 C5 C6 -18.7(7) . .
Os1 Os1 C5 C6 18.1(14) 2_657 .
Os1 C5 C6 C7 176.9(7) . .
C5 C6 C7 C8 -174.3(9) . .
C6 C7 C8 C9 170.6(8) . .
C7 C8 C9 C14 -71.2(12) . .
C7 C8 C9 C10 108.5(11) . .
C14 C9 C10 C11 0.5(14) . .
C8 C9 C10 C11 -179.3(8) . .
C9 C10 C11 C12 -2.4(14) . .
C10 C11 C12 C13 3.0(13) . .
C10 C11 C12 C15 -178.0(8) . .
C11 C12 C13 C14 -2.0(14) . .
C15 C12 C13 C14 179.1(9) . .
C10 C9 C14 C13 0.5(16) . .
C8 C9 C14 C13 -179.7(9) . .
C12 C13 C14 C9 0.3(17) . .
C11 C12 C15 C16 55.8(10) . .
C13 C12 C15 C16 -125.3(9) . .
C12 C15 C16 C17 172.5(6) . .
C15 C16 C17 C18 -177.9(6) . .
C16 C17 C18 C19 177.4(6) . .
C17 C18 C19 C23 158.6(6) . .
C17 C18 C19 C20 -24.7(10) . .
C17 C18 C19 Fe1 68.2(8) . .
C26 Fe1 C19 C23 -115.8(4) 2_657 .
C21 Fe1 C19 C23 80.9(4) . .
C22 Fe1 C19 C23 37.3(4) . .
C27 Fe1 C19 C23 -157.7(4) 2_657 .
C25 Fe1 C19 C23 -74.7(5) 2_657 .
C20 Fe1 C19 C23 118.3(6) . .
C28 Fe1 C19 C23 170.7(6) 2_657 .
C24 Fe1 C19 C23 -44.3(10) 2_657 .
Fe1 Fe1 C19 C23 -134.0(4) 2_657 .
Os1 Fe1 C19 C23 -146.9(5) . .
C23 Fe1 C19 C20 -118.3(6) . .
C26 Fe1 C19 C20 125.9(4) 2_657 .
C21 Fe1 C19 C20 -37.4(4) . .
C22 Fe1 C19 C20 -81.0(4) . .
C27 Fe1 C19 C20 84.0(4) 2_657 .
C25 Fe1 C19 C20 167.0(4) 2_657 .
C28 Fe1 C19 C20 52.4(8) 2_657 .
C24 Fe1 C19 C20 -162.6(7) 2_657 .
Fe1 Fe1 C19 C20 107.7(4) 2_657 .
Os1 Fe1 C19 C20 94.8(4) . .
C23 Fe1 C19 C18 119.5(7) . .
C26 Fe1 C19 C18 3.6(6) 2_657 .
C21 Fe1 C19 C18 -159.7(6) . .
C22 Fe1 C19 C18 156.7(6) . .
C27 Fe1 C19 C18 -38.3(7) 2_657 .
C25 Fe1 C19 C18 44.7(6) 2_657 .
C20 Fe1 C19 C18 -122.3(7) . .
C28 Fe1 C19 C18 -69.9(9) 2_657 .
C24 Fe1 C19 C18 75.1(10) 2_657 .
Fe1 Fe1 C19 C18 -14.5(5) 2_657 .
Os1 Fe1 C19 C18 -27.5(4) . .
C23 C19 C20 C21 -1.2(7) . .
C18 C19 C20 C21 -178.4(6) . .
Fe1 C19 C20 C21 58.1(5) . .
C23 C19 C20 Fe1 -59.3(4) . .
C18 C19 C20 Fe1 123.5(7) . .
C23 Fe1 C20 C19 38.1(4) . .
C26 Fe1 C20 C19 -72.8(5) 2_657 .
C21 Fe1 C20 C19 120.2(6) . .
C22 Fe1 C20 C19 82.1(4) . .
C27 Fe1 C20 C19 -114.7(4) 2_657 .
C25 Fe1 C20 C19 -36.7(10) 2_657 .
C28 Fe1 C20 C19 -157.4(4) 2_657 .
C24 Fe1 C20 C19 166.4(6) 2_657 .
Fe1 Fe1 C20 C19 -78.4(4) 2_657 .
Os1 Fe1 C20 C19 -59.3(3) . .
C23 Fe1 C20 C21 -82.2(4) . .
C26 Fe1 C20 C21 167.0(4) 2_657 .
C22 Fe1 C20 C21 -38.1(4) . .
C27 Fe1 C20 C21 125.1(4) 2_657 .
C25 Fe1 C20 C21 -156.9(8) 2_657 .
C19 Fe1 C20 C21 -120.2(6) . .
C28 Fe1 C20 C21 82.4(5) 2_657 .
C24 Fe1 C20 C21 46.2(8) 2_657 .
Fe1 Fe1 C20 C21 161.4(4) 2_657 .
Os1 Fe1 C20 C21 -179.5(4) . .
C19 C20 C21 C22 1.5(7) . .
Fe1 C20 C21 C22 60.2(5) . .
C19 C20 C21 Fe1 -58.7(5) . .
C23 Fe1 C21 C22 -37.7(4) . .
C26 Fe1 C21 C22 -158.4(9) 2_657 .
C27 Fe1 C21 C22 166.2(4) 2_657 .
C25 Fe1 C21 C22 45.3(8) 2_657 .
C19 Fe1 C21 C22 -81.2(4) . .
C20 Fe1 C21 C22 -118.1(6) . .
C28 Fe1 C21 C22 124.6(4) 2_657 .
C24 Fe1 C21 C22 81.5(4) 2_657 .
Fe1 Fe1 C21 C22 -148.1(3) 2_657 .
Os1 Fe1 C21 C22 -117.6(4) . .
C23 Fe1 C21 C20 80.4(4) . .
C26 Fe1 C21 C20 -40.3(11) 2_657 .
C22 Fe1 C21 C20 118.1(6) . .
C27 Fe1 C21 C20 -75.7(5) 2_657 .
C25 Fe1 C21 C20 163.3(6) 2_657 .
C19 Fe1 C21 C20 36.9(4) . .
C28 Fe1 C21 C20 -117.3(4) 2_657 .
C24 Fe1 C21 C20 -160.4(4) 2_657 .
Fe1 Fe1 C21 C20 -30.0(6) 2_657 .
Os1 Fe1 C21 C20 0.5(4) . .
C20 C21 C22 C23 -1.2(7) . .
Fe1 C21 C22 C23 59.2(5) . .
C20 C21 C22 Fe1 -60.4(5) . .
C23 Fe1 C22 C21 119.3(6) . .
C26 Fe1 C22 C21 166.2(6) 2_657 .
C27 Fe1 C22 C21 -43.5(11) 2_657 .
C25 Fe1 C22 C21 -159.7(4) 2_657 .
C19 Fe1 C22 C21 82.3(4) . .
C20 Fe1 C22 C21 38.6(4) . .
C28 Fe1 C22 C21 -75.8(5) 2_657 .
C24 Fe1 C22 C21 -116.7(4) 2_657 .
Fe1 Fe1 C22 C21 108.3(6) 2_657 .
Os1 Fe1 C22 C21 78.5(4) . .
C26 Fe1 C22 C23 46.9(8) 2_657 .
C21 Fe1 C22 C23 -119.3(6) . .
C27 Fe1 C22 C23 -162.8(9) 2_657 .
C25 Fe1 C22 C23 81.1(4) 2_657 .
C19 Fe1 C22 C23 -37.0(4) . .
C20 Fe1 C22 C23 -80.7(4) . .
C28 Fe1 C22 C23 164.9(4) 2_657 .
C24 Fe1 C22 C23 124.0(4) 2_657 .
Fe1 Fe1 C22 C23 -11.0(8) 2_657 .
Os1 Fe1 C22 C23 -40.7(4) . .
C20 C19 C23 C22 0.5(7) . .
C18 C19 C23 C22 177.7(6) . .
Fe1 C19 C23 C22 -59.4(5) . .
C20 C19 C23 Fe1 59.8(4) . .
C18 C19 C23 Fe1 -122.9(6) . .
C21 C22 C23 C19 0.5(8) . .
Fe1 C22 C23 C19 59.8(5) . .
C21 C22 C23 Fe1 -59.4(5) . .
C26 Fe1 C23 C19 81.3(4) 2_657 .
C21 Fe1 C23 C19 -82.6(4) . .
C22 Fe1 C23 C19 -120.1(6) . .
C27 Fe1 C23 C19 49.0(8) 2_657 .
C25 Fe1 C23 C19 123.6(4) 2_657 .
C20 Fe1 C23 C19 -38.1(4) . .
C28 Fe1 C23 C19 -166.6(8) 2_657 .
C24 Fe1 C23 C19 164.4(4) 2_657 .
Fe1 Fe1 C23 C19 55.6(4) 2_657 .
Os1 Fe1 C23 C19 25.1(4) . .
C26 Fe1 C23 C22 -158.6(4) 2_657 .
C21 Fe1 C23 C22 37.5(4) . .
C27 Fe1 C23 C22 169.1(6) 2_657 .
C25 Fe1 C23 C22 -116.3(4) 2_657 .
C19 Fe1 C23 C22 120.1(6) . .
C20 Fe1 C23 C22 81.9(4) . .
C28 Fe1 C23 C22 -46.5(11) 2_657 .
C24 Fe1 C23 C22 -75.5(5) 2_657 .
Fe1 Fe1 C23 C22 175.7(3) 2_657 .
Os1 Fe1 C23 C22 145.2(4) . .
C28 C24 C25 C26 -0.4(7) . .
C29 C24 C25 C26 -175.6(6) . .
Fe1 C24 C25 C26 59.1(4) 2_657 .
C28 C24 C25 Fe1 -59.4(4) . 2_657
C29 C24 C25 Fe1 125.4(6) . 2_657
C24 C25 C26 C27 0.2(7) . .
Fe1 C25 C26 C27 59.8(5) 2_657 .
C24 C25 C26 Fe1 -59.6(4) . 2_657
C25 C26 C27 C28 0.1(7) . .
Fe1 C26 C27 C28 60.0(5) 2_657 .
C25 C26 C27 Fe1 -59.9(4) . 2_657
C26 C27 C28 C24 -0.3(7) . .
Fe1 C27 C28 C24 59.1(4) 2_657 .
C26 C27 C28 Fe1 -59.4(4) . 2_657
C25 C24 C28 C27 0.4(7) . .
C29 C24 C28 C27 175.5(6) . .
Fe1 C24 C28 C27 -58.8(4) 2_657 .
C25 C24 C28 Fe1 59.2(4) . 2_657
C29 C24 C28 Fe1 -125.8(7) . 2_657
C28 C24 C29 C30 32.6(10) . .
C25 C24 C29 C30 -153.2(6) . .
Fe1 C24 C29 C30 -61.6(8) 2_657 .
C24 C29 C30 C31 -179.3(6) . .
C29 C30 C31 C32 -178.5(7) . .
C30 C31 C32 C33 176.7(7) . .
C31 C32 C33 C38 141.7(8) . .
C31 C32 C33 C34 -44.0(11) . .
C38 C33 C34 C35 -0.1(14) . .
C32 C33 C34 C35 -174.6(9) . .
C33 C34 C35 C36 1.0(15) . .
C34 C35 C36 C37 -1.8(14) . .
C34 C35 C36 C39 -179.3(9) . .
C35 C36 C37 C38 1.7(15) . .
C39 C36 C37 C38 179.2(9) . .
C34 C33 C38 C37 0.0(13) . .
C32 C33 C38 C37 174.5(8) . .
C36 C37 C38 C33 -0.8(15) . .
C37 C36 C39 C40 -114.7(12) . .
C35 C36 C39 C40 62.8(12) . .
C36 C39 C40 C41 63.0(13) . .
C39 C40 C41 C42 -169.9(9) . .
C40 C41 C42 Os1 173.4(7) . .
C4 Os1 C42 C41 12.2(8) . .
C3 Os1 C42 C41 -107(4) . .
C2 Os1 C42 C41 105.5(8) . .
C1 Os1 C42 C41 -159.7(8) . .
C5 Os1 C42 C41 -73.7(8) . .
Fe1 Os1 C42 C41 -63.5(7) 2_657 .
Fe1 Os1 C42 C41 -71.3(8) . .
Os1 Os1 C42 C41 -67.9(8) 2_657 .
C60 C61 C62 C62 179(4) . 2_556
