#------------------------------------------------------------------------------
#$Date: 2016-03-23 00:50:43 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179131 $
#$URL: svn://www.crystallography.net/cod/cif/4/30/93/4309387.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_4309387
loop_
_publ_author_name
'Gema Arribas'
'M. Carmen Barral'
'Rodrigo González-Prieto'
'Reyes Jiménez-Aparicio'
'J. Luis Priego'
'M. Rosario Torres'
'Francisco A. Urbanos'
_publ_contact_author
;                                                                               
      Jimenez-Aparicio Reyes
      Departamento de Quimica Inorganica I
      Facultad de Ciencias Quimicas 
      Universidad Complutense de Madrid
      28040 Madrid (Spain)
;
_publ_contact_author_email       qcmm@quim.ucm.es
_publ_contact_author_fax         '+34 91 3944352'
_publ_contact_author_phone       '+34 91 3944334'
_publ_section_title
;
Discrete and Monodimensional Heteropolynuclear Structures Formed by
Tetracarboxylatodiruthenium(II,III) and Perrhenato Fragments
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              5770
_journal_page_last               5777
_journal_paper_doi               10.1021/ic050757x
_journal_volume                  44
_journal_year                    2005
_chemical_formula_sum            'C24 H44 O13 Re Ru2'
_chemical_formula_weight         928.93
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           11
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yb'
_symmetry_space_group_name_H-M   'P 1 21/m 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 109.7360(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   11.6763(8)
_cell_length_b                   9.5760(6)
_cell_length_c                   16.0089(11)
_cell_measurement_temperature    293(2)
_cell_volume                     1684.84(19)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SHELXTL'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.915
_diffrn_measured_fraction_theta_max 0.915
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and 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  0.0522
_diffrn_reflns_av_sigmaI/netI    0.0624
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            10821
_diffrn_reflns_theta_full        28.90
_diffrn_reflns_theta_max         28.90
_diffrn_reflns_theta_min         1.35
_exptl_absorpt_coefficient_mu    4.523
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            'dark red'
_exptl_crystal_density_diffrn    1.831
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prismatic
_exptl_crystal_F_000             910
_exptl_crystal_size_max          0.07
_exptl_crystal_size_mid          0.08
_exptl_crystal_size_min          0.23
_refine_diff_density_max         2.488
_refine_diff_density_min         -1.256
_refine_diff_density_rms         0.181
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.964
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     161
_refine_ls_number_reflns         4289
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.964
_refine_ls_R_factor_all          0.0626
_refine_ls_R_factor_gt           0.0452
_refine_ls_shift/su_max          0.768
_refine_ls_shift/su_mean         0.032
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0711P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1159
_refine_ls_wR_factor_ref         0.1236
_reflns_number_gt                3180
_reflns_number_total             4289
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic050757xsi20050512_114754_1.cif
_cod_data_source_block           '[Ru2(mu-O2CCMe3)4(ReO4)]n.THF'
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
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_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_database_code               4309387
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z'
'-x, -y, -z'
'x, -y-1/2, 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
Re1 Re 0.39613(3) 0.2500 0.25703(2) 0.03436(13) Uani 1 2 d S . .
Ru1 Ru 0.32364(4) 0.63164(4) 0.18466(3) 0.02874(14) Uani 1 1 d . . .
O1 O 0.3340(4) 0.3977(4) 0.1948(3) 0.0498(13) Uani 1 1 d . . .
O2 O 0.3632(10) 0.2500 0.3510(6) 0.084(3) Uani 1 2 d S . .
O3 O 0.5488(7) 0.2500 0.2806(6) 0.069(2) Uani 1 2 d S . .
O4 O 0.3007(4) 0.6328(4) 0.3040(3) 0.0407(11) Uani 1 1 d . . .
O5 O 0.1416(4) 0.6335(4) 0.1238(3) 0.0362(10) Uani 1 1 d . . .
O6 O 0.3493(4) 0.6336(4) 0.0658(3) 0.0355(10) Uani 1 1 d . . .
O7 O 0.5065(4) 0.6336(4) 0.2479(3) 0.0377(11) Uani 1 1 d . . .
C1 C 0.2932(9) 0.7500 0.3413(7) 0.042(2) Uani 1 2 d S . .
C2 C 0.2727(12) 0.7500 0.4292(8) 0.059(3) Uani 1 2 d S . .
C5 C 0.0852(8) 0.7500 0.1069(6) 0.035(2) Uani 1 2 d S . .
C6 C -0.0502(9) 0.7500 0.0646(9) 0.057(3) Uani 1 2 d S . .
C9 C 0.3587(8) 0.7500 0.0308(6) 0.035(2) Uani 1 2 d S . .
C10 C 0.3903(10) 0.7500 -0.0546(7) 0.047(2) Uani 1 2 d S . .
C13 C 0.5608(8) 0.7500 0.2704(6) 0.036(2) Uani 1 2 d S . .
C14 C 0.6905(9) 0.7500 0.3276(8) 0.055(3) Uani 1 2 d S . .
C3 C 0.3293(11) 0.6223(14) 0.4827(9) 0.118(4) Uiso 1 1 d . . .
H3A H 0.3205 0.6275 0.5401 0.177 Uiso 1 1 calc R . .
H3B H 0.4141 0.6183 0.4895 0.177 Uiso 1 1 calc R . .
H3C H 0.2892 0.5400 0.4525 0.177 Uiso 1 1 calc R . .
C4 C 0.133(2) 0.7500 0.4116(16) 0.150(8) Uiso 1 2 d S . .
H4A H 0.1187 0.7500 0.4671 0.225 Uiso 1 2 calc SR . .
H4B H 0.0974 0.6681 0.3784 0.225 Uiso 0.50 1 calc PR . .
H4C H 0.0974 0.8319 0.3784 0.225 Uiso 0.50 1 calc PR . .
C7 C -0.1080(11) 0.6178(13) 0.0720(9) 0.111(4) Uiso 1 1 d . . .
H7A H -0.0959 0.5991 0.1333 0.167 Uiso 1 1 calc R . .
H7B H -0.0725 0.5441 0.0483 0.167 Uiso 1 1 calc R . .
H7C H -0.1935 0.6233 0.0394 0.167 Uiso 1 1 calc R . .
C8 C -0.074(2) 0.7500 -0.0321(15) 0.151(8) Uiso 1 2 d S . .
H8A H -0.0405 0.8332 -0.0482 0.226 Uiso 0.50 1 calc PR . .
H8B H -0.1600 0.7472 -0.0630 0.226 Uiso 1 2 calc SR . .
H8C H -0.0364 0.6696 -0.0477 0.226 Uiso 0.50 1 calc PR . .
C11 C 0.5321(13) 0.7500 -0.0250(11) 0.091(5) Uiso 1 2 d S . .
H11A H 0.5567 0.7500 -0.0765 0.137 Uiso 1 2 calc SR . .
H11B H 0.5635 0.6681 0.0098 0.137 Uiso 0.50 1 calc PR . .
H11C H 0.5635 0.8319 0.0098 0.137 Uiso 0.50 1 calc PR . .
C12 C 0.3477(10) 0.6152(11) -0.1077(7) 0.087(3) Uiso 1 1 d . . .
H12A H 0.3811 0.5361 -0.0707 0.131 Uiso 1 1 calc R . .
H12B H 0.3750 0.6146 -0.1580 0.131 Uiso 1 1 calc R . .
H12C H 0.2605 0.6105 -0.1278 0.131 Uiso 1 1 calc R . .
C15 C 0.7520(10) 0.6156(13) 0.3238(8) 0.102(4) Uiso 1 1 d . . .
H15A H 0.7076 0.5403 0.3381 0.153 Uiso 1 1 calc R . .
H15B H 0.8333 0.6175 0.3657 0.153 Uiso 1 1 calc R . .
H15C H 0.7549 0.6022 0.2651 0.153 Uiso 1 1 calc R . .
C16 C 0.6805(17) 0.7500 0.4240(13) 0.120(6) Uiso 1 2 d S . .
H16A H 0.7607 0.7500 0.4676 0.180 Uiso 1 2 calc SR . .
H16B H 0.6374 0.6681 0.4314 0.180 Uiso 0.50 1 calc PR . .
H16C H 0.6374 0.8319 0.4314 0.180 Uiso 0.50 1 calc PR . .
C17 C 0.0562(14) 0.3294(15) 0.2795(11) 0.152 Uiso 1 1 d . . .
H17A H 0.1389 0.3640 0.3043 0.183 Uiso 1 1 calc R . .
H17B H 0.0213 0.3640 0.2193 0.183 Uiso 1 1 calc R . .
C18 C -0.0107(17) 0.375(2) 0.3292(13) 0.170 Uiso 1 1 d . . .
H18A H -0.0803 0.4283 0.2931 0.204 Uiso 1 1 calc R . .
H18B H 0.0383 0.4329 0.3778 0.204 Uiso 1 1 calc R . .
O9 O -0.0494(18) 0.2500 0.3624(15) 0.205 Uiso 1 2 d S . .
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'
Ru Ru -1.2594 0.8363 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Re Re -1.0185 7.2310 '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
O2 Re1 O3 110.1(5) . . ?
O2 Re1 O1 109.6(3) . 4_565 ?
O3 Re1 O1 109.4(2) . 4_565 ?
O2 Re1 O1 109.6(3) . . ?
O3 Re1 O1 109.4(2) . . ?
O1 Re1 O1 108.7(3) 4_565 . ?
O5 Ru1 O4 90.13(19) . . ?
O5 Ru1 O7 178.57(17) . . ?
O4 Ru1 O7 88.9(2) . . ?
O5 Ru1 O6 90.69(18) . . ?
O4 Ru1 O6 178.82(17) . . ?
O7 Ru1 O6 90.28(18) . . ?
O5 Ru1 O1 93.79(17) . . ?
O4 Ru1 O1 87.58(18) . . ?
O7 Ru1 O1 87.21(16) . . ?
O6 Ru1 O1 93.22(17) . . ?
O5 Ru1 Ru1 89.50(11) . 4_575 ?
O4 Ru1 Ru1 89.70(12) . 4_575 ?
O7 Ru1 Ru1 89.46(11) . 4_575 ?
O6 Ru1 Ru1 89.46(11) . 4_575 ?
O1 Ru1 Ru1 175.74(13) . 4_575 ?
Re1 O1 Ru1 148.6(3) . . ?
C1 O4 Ru1 119.7(5) . . ?
C5 O5 Ru1 119.6(4) . . ?
C9 O6 Ru1 119.1(5) . . ?
C13 O7 Ru1 119.3(4) . . ?
O4 C1 O4 121.2(9) . 4_575 ?
O4 C1 C2 119.4(4) . . ?
O4 C1 C2 119.4(4) 4_575 . ?
C4 C2 C1 108.5(13) . . ?
C4 C2 C3 109.5(9) . 4_575 ?
C1 C2 C3 110.7(8) . 4_575 ?
C4 C2 C3 109.5(9) . . ?
C1 C2 C3 110.7(8) . . ?
C3 C2 C3 108.0(13) 4_575 . ?
O5 C5 O5 121.7(8) 4_575 . ?
O5 C5 C6 119.1(4) 4_575 . ?
O5 C5 C6 119.1(4) . . ?
C7 C6 C7 120.5(13) . 4_575 ?
C7 C6 C5 114.2(7) . . ?
C7 C6 C5 114.2(7) 4_575 . ?
C7 C6 C8 99.1(9) . . ?
C7 C6 C8 99.1(9) 4_575 . ?
C5 C6 C8 105.6(13) . . ?
O6 C9 O6 122.9(8) . 4_575 ?
O6 C9 C10 118.5(4) . . ?
O6 C9 C10 118.5(4) 4_575 . ?
C9 C10 C12 111.4(6) . . ?
C9 C10 C12 111.4(6) . 4_575 ?
C12 C10 C12 114.7(11) . 4_575 ?
C9 C10 C11 106.3(9) . . ?
C12 C10 C11 106.2(7) . . ?
C12 C10 C11 106.2(7) 4_575 . ?
O7 C13 O7 122.3(8) . 4_575 ?
O7 C13 C14 118.8(4) . . ?
O7 C13 C14 118.8(4) 4_575 . ?
C13 C14 C15 112.5(6) . 4_575 ?
C13 C14 C15 112.5(6) . . ?
C15 C14 C15 120.1(12) 4_575 . ?
C13 C14 C16 101.9(11) . . ?
C15 C14 C16 103.6(8) 4_575 . ?
C15 C14 C16 103.6(8) . . ?
C2 C3 H3A 109.5 . . ?
C2 C3 H3B 109.4 . . ?
H3A C3 H3B 109.5 . . ?
C2 C3 H3C 109.5 . . ?
H3A C3 H3C 109.5 . . ?
H3B C3 H3C 109.5 . . ?
C2 C4 H4A 109.6 . . ?
C2 C4 H4B 109.4 . . ?
H4A C4 H4B 109.5 . . ?
C2 C4 H4C 109.4 . . ?
H4A C4 H4C 109.5 . . ?
H4B C4 H4C 109.5 . . ?
C6 C7 H7A 109.5 . . ?
C6 C7 H7B 109.5 . . ?
H7A C7 H7B 109.5 . . ?
C6 C7 H7C 109.5 . . ?
H7A C7 H7C 109.5 . . ?
H7B C7 H7C 109.5 . . ?
C6 C8 H8A 109.5 . . ?
C6 C8 H8B 109.4 . . ?
H8A C8 H8B 109.5 . . ?
C6 C8 H8C 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?
C10 C11 H11A 109.5 . . ?
C10 C11 H11B 109.5 . . ?
H11A C11 H11B 109.5 . . ?
C10 C11 H11C 109.5 . . ?
H11A C11 H11C 109.5 . . ?
H11B C11 H11C 109.5 . . ?
C10 C12 H12A 109.5 . . ?
C10 C12 H12B 109.5 . . ?
H12A C12 H12B 109.5 . . ?
C10 C12 H12C 109.5 . . ?
H12A C12 H12C 109.5 . . ?
H12B C12 H12C 109.5 . . ?
C14 C15 H15A 109.5 . . ?
C14 C15 H15B 109.5 . . ?
H15A C15 H15B 109.5 . . ?
C14 C15 H15C 109.5 . . ?
H15A C15 H15C 109.5 . . ?
H15B C15 H15C 109.5 . . ?
C14 C16 H16A 109.5 . . ?
C14 C16 H16B 109.5 . . ?
H16A C16 H16B 109.5 . . ?
C14 C16 H16C 109.5 . . ?
H16A C16 H16C 109.5 . . ?
H16B C16 H16C 109.5 . . ?
C18 C17 C17 108.6(11) . 4_565 ?
C18 C17 H17A 109.5 . . ?
C17 C17 H17A 109.9 4_565 . ?
C18 C17 H17B 110.6 . . ?
C17 C17 H17B 109.9 4_565 . ?
H17A C17 H17B 108.3 . . ?
C17 C18 O9 105.3(19) . . ?
C17 C18 H18A 110.0 . . ?
O9 C18 H18A 110.1 . . ?
C17 C18 H18B 111.1 . . ?
O9 C18 H18B 111.4 . . ?
H18A C18 H18B 108.8 . . ?
C18 O9 C18 112(2) 4_565 . ?
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
Re1 O2 1.674(8) . ?
Re1 O3 1.693(7) . ?
Re1 O1 1.741(4) 4_565 ?
Re1 O1 1.741(4) . ?
Ru1 O5 2.017(4) . ?
Ru1 O4 2.016(5) . ?
Ru1 O7 2.030(4) . ?
Ru1 O6 2.024(4) . ?
Ru1 O1 2.247(4) . ?
Ru1 Ru1 2.2667(9) 4_575 ?
O4 C1 1.288(6) . ?
O5 C5 1.277(6) . ?
O6 C9 1.268(6) . ?
O7 C13 1.272(6) . ?
C1 O4 1.288(6) 4_575 ?
C1 C2 1.505(15) . ?
C2 C4 1.56(2) . ?
C2 C3 1.511(15) 4_575 ?
C2 C3 1.511(15) . ?
C5 O5 1.277(6) 4_575 ?
C5 C6 1.496(13) . ?
C6 C7 1.458(13) . ?
C6 C7 1.458(13) 4_575 ?
C6 C8 1.48(2) . ?
C9 O6 1.268(6) 4_575 ?
C9 C10 1.531(13) . ?
C10 C12 1.533(12) . ?
C10 C12 1.533(12) 4_575 ?
C10 C11 1.562(17) . ?
C13 O7 1.272(6) 4_575 ?
C13 C14 1.482(13) . ?
C14 C15 1.485(13) 4_575 ?
C14 C15 1.485(13) . ?
C14 C16 1.59(2) . ?
C3 H3A 0.9600 . ?
C3 H3B 0.9600 . ?
C3 H3C 0.9600 . ?
C4 H4A 0.9600 . ?
C4 H4B 0.9600 . ?
C4 H4C 0.9600 . ?
C7 H7A 0.9600 . ?
C7 H7B 0.9600 . ?
C7 H7C 0.9600 . ?
C8 H8A 0.9600 . ?
C8 H8B 0.9600 . ?
C8 H8C 0.9600 . ?
C11 H11A 0.9600 . ?
C11 H11B 0.9600 . ?
C11 H11C 0.9600 . ?
C12 H12A 0.9600 . ?
C12 H12B 0.9600 . ?
C12 H12C 0.9600 . ?
C15 H15A 0.9600 . ?
C15 H15B 0.9600 . ?
C15 H15C 0.9600 . ?
C16 H16A 0.9600 . ?
C16 H16B 0.9600 . ?
C16 H16C 0.9600 . ?
C17 C18 1.359(19) . ?
C17 C17 1.52(3) 4_565 ?
C17 H17A 0.9700 . ?
C17 H17B 0.9700 . ?
C18 O9 1.441(18) . ?
C18 H18A 0.9700 . ?
C18 H18B 0.9700 . ?
O9 C18 1.441(18) 4_565 ?
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
_geom_torsion_publ_flag
O2 Re1 O1 Ru1 60.0(7) . . . . ?
O3 Re1 O1 Ru1 -60.8(6) . . . . ?
O1 Re1 O1 Ru1 179.9(3) 4_565 . . . ?
O5 Ru1 O1 Re1 -139.4(5) . . . . ?
O4 Ru1 O1 Re1 -49.4(6) . . . . ?
O7 Ru1 O1 Re1 39.6(6) . . . . ?
O6 Ru1 O1 Re1 129.7(5) . . . . ?
Ru1 Ru1 O1 Re1 1(2) 4_575 . . . ?
O5 Ru1 O4 C1 -89.3(6) . . . . ?
O7 Ru1 O4 C1 89.7(6) . . . . ?
O6 Ru1 O4 C1 44(9) . . . . ?
O1 Ru1 O4 C1 176.9(6) . . . . ?
Ru1 Ru1 O4 C1 0.2(6) 4_575 . . . ?
O4 Ru1 O5 C5 88.1(6) . . . . ?
O7 Ru1 O5 C5 41(7) . . . . ?
O6 Ru1 O5 C5 -91.1(6) . . . . ?
O1 Ru1 O5 C5 175.7(6) . . . . ?
Ru1 Ru1 O5 C5 -1.6(6) 4_575 . . . ?
O5 Ru1 O6 C9 90.5(6) . . . . ?
O4 Ru1 O6 C9 -43(9) . . . . ?
O7 Ru1 O6 C9 -88.4(6) . . . . ?
O1 Ru1 O6 C9 -175.7(6) . . . . ?
Ru1 Ru1 O6 C9 1.0(6) 4_575 . . . ?
O5 Ru1 O7 C13 -40(7) . . . . ?
O4 Ru1 O7 C13 -86.7(6) . . . . ?
O6 Ru1 O7 C13 92.4(6) . . . . ?
O1 Ru1 O7 C13 -174.3(6) . . . . ?
Ru1 Ru1 O7 C13 3.0(6) 4_575 . . . ?
Ru1 O4 C1 O4 -0.4(13) . . . 4_575 ?
Ru1 O4 C1 C2 178.4(7) . . . . ?
O4 C1 C2 C4 -89.4(8) . . . . ?
O4 C1 C2 C4 89.4(8) 4_575 . . . ?
O4 C1 C2 C3 150.5(9) . . . 4_575 ?
O4 C1 C2 C3 -30.7(14) 4_575 . . 4_575 ?
O4 C1 C2 C3 30.7(14) . . . . ?
O4 C1 C2 C3 -150.5(9) 4_575 . . . ?
Ru1 O5 C5 O5 3.3(12) . . . 4_575 ?
Ru1 O5 C5 C6 -177.9(8) . . . . ?
O5 C5 C6 C7 -162.8(10) 4_575 . . . ?
O5 C5 C6 C7 18.4(16) . . . . ?
O5 C5 C6 C7 -18.4(16) 4_575 . . 4_575 ?
O5 C5 C6 C7 162.8(10) . . . 4_575 ?
O5 C5 C6 C8 89.4(8) 4_575 . . . ?
O5 C5 C6 C8 -89.4(8) . . . . ?
Ru1 O6 C9 O6 -2.2(12) . . . 4_575 ?
Ru1 O6 C9 C10 174.2(6) . . . . ?
O6 C9 C10 C12 27.0(12) . . . . ?
O6 C9 C10 C12 -156.5(8) 4_575 . . . ?
O6 C9 C10 C12 156.5(8) . . . 4_575 ?
O6 C9 C10 C12 -27.0(12) 4_575 . . 4_575 ?
O6 C9 C10 C11 -88.3(7) . . . . ?
O6 C9 C10 C11 88.3(7) 4_575 . . . ?
Ru1 O7 C13 O7 -6.2(12) . . . 4_575 ?
Ru1 O7 C13 C14 171.4(7) . . . . ?
O7 C13 C14 C15 160.9(9) . . . 4_575 ?
O7 C13 C14 C15 -21.5(14) 4_575 . . 4_575 ?
O7 C13 C14 C15 21.5(14) . . . . ?
O7 C13 C14 C15 -160.9(9) 4_575 . . . ?
O7 C13 C14 C16 -88.8(8) . . . . ?
O7 C13 C14 C16 88.8(8) 4_575 . . . ?
C17 C17 C18 O9 1.7(18) 4_565 . . . ?
C17 C18 O9 C18 -3(3) . . . 4_565 ?
