#------------------------------------------------------------------------------
#$Date: 2016-03-25 11:39:42 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179801 $
#$URL: svn://www.crystallography.net/cod/cif/7/00/97/7009729.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_7009729
loop_
_publ_author_name
'Braga, Dario'
'Cojazzi, Gianna'
'Abati, Alexander'
'Maini, Lucia'
'Polito, Marco'
'Scaccianoce, Laura'
'Grepioni, Fabrizia'
_publ_section_title
;
 Making and converting organometallic pseudo-polymorphs via
 non-solution methods †
;
_journal_issue                   21
_journal_name_full
'Journal of the Chemical Society, Dalton Transactions'
_journal_page_first              3969
_journal_paper_doi               10.1039/b003160g
_journal_year                    2000
_chemical_formula_sum            'C13 H15 B2 F8 N O2 Ru'
_chemical_formula_weight         491.95
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 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                 117.118(5)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   18.184(4)
_cell_length_b                   11.865(3)
_cell_length_c                   18.251(4)
_cell_measurement_temperature    293(2)
_cell_volume                     3504.8(14)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.912
_diffrn_measured_fraction_theta_max 0.912
_diffrn_measurement_device_type  'Bruker Smart'
_diffrn_measurement_method       CCD
_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  0.2304
_diffrn_reflns_av_sigmaI/netI    0.1233
_diffrn_reflns_limit_h_max       27
_diffrn_reflns_limit_h_min       -26
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_l_max       28
_diffrn_reflns_limit_l_min       -23
_diffrn_reflns_number            48694
_diffrn_reflns_theta_full        34.00
_diffrn_reflns_theta_max         34.00
_diffrn_reflns_theta_min         3.66
_exptl_absorpt_coefficient_mu    0.983
_exptl_absorpt_correction_type   Sadabs
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.864
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1936
_exptl_crystal_size_max          0.22
_exptl_crystal_size_mid          0.18
_exptl_crystal_size_min          0.15
_refine_diff_density_max         1.063
_refine_diff_density_min         -1.657
_refine_diff_density_rms         0.138
_refine_ls_extinction_coef       0.0055(4)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   0.881
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     490
_refine_ls_number_reflns         13045
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.881
_refine_ls_R_factor_all          0.1039
_refine_ls_R_factor_gt           0.0540
_refine_ls_shift/su_max          0.040
_refine_ls_shift/su_mean         0.002
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0632P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1267
_refine_ls_wR_factor_ref         0.1546
_reflns_number_gt                6408
_reflns_number_total             13045
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b003160g.txt
_cod_data_source_block           6
_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_original_cell_volume        3505.1(13)
_cod_original_sg_symbol_H-M      P2(1)/n
_cod_database_code               7009729
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -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
Ru1 Ru 0.936580(12) 0.220703(19) 0.812084(12) 0.03305(8) Uani 1 1 d . . .
Ru2 Ru 0.686679(14) 0.27982(2) 1.061190(13) 0.03476(9) Uani 1 1 d . . .
C1 C 1.0064(3) 0.3256(4) 0.9225(2) 0.0641(11) Uani 1 1 d . . .
H1 H 0.9939 0.3956 0.9369 0.077 Uiso 1 1 calc R . .
C2 C 1.0518(2) 0.3195(4) 0.8782(2) 0.0617(10) Uani 1 1 d . . .
H2 H 1.0687 0.3854 0.8627 0.074 Uiso 1 1 calc R . .
C3 C 1.0723(2) 0.2137(3) 0.8568(2) 0.0591(11) Uani 1 1 d . . .
H3 H 1.1026 0.2098 0.8273 0.071 Uiso 1 1 calc R . .
C4 C 1.0466(2) 0.1147(4) 0.8803(2) 0.0613(10) Uani 1 1 d . . .
H4 H 1.0598 0.0448 0.8664 0.074 Uiso 1 1 calc R . .
C5 C 1.0006(3) 0.1214(4) 0.9251(2) 0.0664(11) Uani 1 1 d . . .
H5 H 0.9841 0.0555 0.9411 0.080 Uiso 1 1 calc R . .
C6 C 0.9793(3) 0.2264(4) 0.9456(2) 0.0639(12) Uani 1 1 d . . .
H6 H 0.9480 0.2305 0.9740 0.077 Uiso 1 1 calc R . .
C7 C 0.8243(2) 0.1173(4) 0.7466(2) 0.0594(9) Uani 1 1 d . . .
H7 H 0.8096 0.0499 0.7624 0.071 Uiso 1 1 calc R . .
C8 C 0.8699(2) 0.1157(4) 0.7021(2) 0.0628(10) Uani 1 1 d . . .
H8 H 0.8852 0.0471 0.6885 0.075 Uiso 1 1 calc R . .
C9 C 0.8926(3) 0.2162(4) 0.6780(2) 0.0631(12) Uani 1 1 d . . .
H9 H 0.9234 0.2144 0.6491 0.076 Uiso 1 1 calc R . .
C10 C 0.8688(3) 0.3199(4) 0.6976(2) 0.0639(11) Uani 1 1 d . . .
H10 H 0.8832 0.3867 0.6808 0.077 Uiso 1 1 calc R . .
C11 C 0.8235(2) 0.3233(4) 0.7424(2) 0.0613(10) Uani 1 1 d . . .
H11 H 0.8082 0.3920 0.7557 0.074 Uiso 1 1 calc R . .
C12 C 0.8009(2) 0.2199(4) 0.7674(2) 0.0579(10) Uani 1 1 d . . .
H12 H 0.7709 0.2211 0.7973 0.070 Uiso 1 1 calc R . .
C13 C 0.5513(2) 0.2886(4) 1.0160(2) 0.0592(11) Uani 1 1 d . . .
H13 H 0.5213 0.2908 1.0457 0.071 Uiso 1 1 calc R . .
C14 C 0.5781(2) 0.3888(3) 0.9959(2) 0.0578(9) Uani 1 1 d . . .
H14 H 0.5658 0.4577 1.0122 0.069 Uiso 1 1 calc R . .
C15 C 0.6238(2) 0.3854(4) 0.9511(2) 0.0599(10) Uani 1 1 d . . .
H15 H 0.6410 0.4523 0.9371 0.072 Uiso 1 1 calc R . .
C16 C 0.6436(2) 0.2822(4) 0.9273(2) 0.0591(11) Uani 1 1 d . . .
H16 H 0.6750 0.2801 0.8989 0.071 Uiso 1 1 calc R . .
C17 C 0.6154(2) 0.1809(4) 0.9471(2) 0.0568(9) Uani 1 1 d . . .
H17 H 0.6274 0.1120 0.9306 0.068 Uiso 1 1 calc R . .
C18 C 0.5696(2) 0.1840(4) 0.9913(2) 0.0583(9) Uani 1 1 d . . .
H18 H 0.5513 0.1174 1.0044 0.070 Uiso 1 1 calc R . .
C19 C 0.8221(2) 0.2740(4) 1.1055(2) 0.0566(10) Uani 1 1 d . . .
H19 H 0.8521 0.2717 1.0757 0.068 Uiso 1 1 calc R . .
C20 C 0.7962(2) 0.1729(4) 1.1282(2) 0.0582(10) Uani 1 1 d . . .
H20 H 0.8097 0.1039 1.1134 0.070 Uiso 1 1 calc R . .
C21 C 0.7504(2) 0.1757(4) 1.1729(2) 0.0610(10) Uani 1 1 d . . .
H21 H 0.7338 0.1090 1.1877 0.073 Uiso 1 1 calc R . .
C22 C 0.7297(3) 0.2809(4) 1.1953(2) 0.0584(11) Uani 1 1 d . . .
H22 H 0.6986 0.2840 1.2240 0.070 Uiso 1 1 calc R . .
C23 C 0.7566(2) 0.3806(4) 1.1735(2) 0.0586(9) Uani 1 1 d . . .
H23 H 0.7443 0.4498 1.1892 0.070 Uiso 1 1 calc R . .
C24 C 0.8018(2) 0.3778(4) 1.1286(2) 0.0575(9) Uani 1 1 d . . .
H24 H 0.8184 0.4447 1.1141 0.069 Uiso 1 1 calc R . .
B1 B 0.5475(3) 0.0432(5) 1.1717(3) 0.0536(10) Uani 1 1 d . . .
F1 F 0.5793(2) 0.1444(4) 1.2036(2) 0.1425(16) Uani 1 1 d . . .
F2 F 0.47917(19) 0.0653(3) 1.10061(17) 0.1196(11) Uani 1 1 d . . .
F3 F 0.5250(3) -0.0107(3) 1.2215(2) 0.1260(14) Uani 1 1 d . . .
F4 F 0.6012(3) -0.0101(3) 1.1525(3) 0.1250(14) Uani 1 1 d . . .
B2 B 0.4249(2) 0.4871(5) 0.8010(2) 0.0512(10) Uani 1 1 d . . .
F5 F 0.36010(14) 0.5421(2) 0.73673(13) 0.0677(6) Uani 1 1 d . . .
F6 F 0.39427(18) 0.4214(3) 0.84204(17) 0.0888(9) Uani 1 1 d . . .
F7 F 0.46570(18) 0.4223(3) 0.76910(17) 0.0915(9) Uani 1 1 d . . .
F8 F 0.47942(18) 0.5641(3) 0.85503(16) 0.0919(9) Uani 1 1 d . . .
B3 B 1.2100(3) -0.0206(4) 1.0684(3) 0.0557(10) Uani 1 1 d . . .
F9 F 1.27593(17) -0.0596(3) 1.13682(16) 0.0904(8) Uani 1 1 d . . .
F10 F 1.2393(2) 0.0345(3) 1.0210(2) 0.1112(11) Uani 1 1 d . . .
F11 F 1.1659(2) 0.0495(3) 1.0922(2) 0.1172(12) Uani 1 1 d . . .
F12 F 1.1623(2) -0.1068(3) 1.0250(2) 0.1368(15) Uani 1 1 d . . .
B4 B 0.6663(3) -0.0174(4) 0.5565(3) 0.0554(10) Uani 1 1 d . . .
F13 F 0.60274(16) -0.0608(3) 0.48730(15) 0.0878(8) Uani 1 1 d . . .
F14 F 0.7112(2) 0.0509(4) 0.5327(2) 0.1203(13) Uani 1 1 d . . .
F15 F 0.6344(2) 0.0374(3) 0.6003(2) 0.1154(12) Uani 1 1 d . . .
F16 F 0.7147(2) -0.1013(4) 0.6018(2) 0.1372(15) Uani 1 1 d . . .
C1S C 0.6784(3) 0.8239(4) 1.0727(3) 0.0934(16) Uani 1 1 d . . .
H1A H 0.6384 0.8504 1.0197 0.140 Uiso 1 1 calc R . .
H1B H 0.7292 0.8646 1.0895 0.140 Uiso 1 1 calc R . .
H1C H 0.6580 0.8358 1.1122 0.140 Uiso 1 1 calc R . .
N1 N 0.6933(2) 0.7029(3) 1.06781(18) 0.0519(7) Uani 1 1 d . . .
O1 O 0.75401(18) 0.6622(3) 1.12284(19) 0.0800(8) Uani 1 1 d . . .
O2 O 0.6404(2) 0.6513(3) 1.00986(18) 0.0815(9) Uani 1 1 d . . .
C2S C 0.9466(3) -0.3247(5) 0.8025(3) 0.0920(16) Uani 1 1 d . . .
H2A H 0.8934 -0.3603 0.7805 0.138 Uiso 1 1 calc R . .
H2B H 0.9824 -0.3577 0.8547 0.138 Uiso 1 1 calc R . .
H2C H 0.9698 -0.3351 0.7651 0.138 Uiso 1 1 calc R . .
N2 N 0.93749(17) -0.2036(3) 0.81318(16) 0.0525(8) Uani 1 1 d . . .
O3 O 0.8777(2) -0.1573(3) 0.76003(19) 0.0777(8) Uani 1 1 d . . .
O4 O 0.9920(2) -0.1576(3) 0.87315(17) 0.0793(9) 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'
B B 0.0013 0.0007 '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'
Ru Ru -1.2594 0.8363 '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'
N N 0.0061 0.0033 '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
C5 Ru1 C6 37.34(17) . . ?
C5 Ru1 C8 112.9(2) . . ?
C6 Ru1 C8 143.10(17) . . ?
C5 Ru1 C9 143.20(17) . . ?
C6 Ru1 C9 179.38(16) . . ?
C8 Ru1 C9 37.03(15) . . ?
C5 Ru1 C4 37.50(15) . . ?
C6 Ru1 C4 67.65(16) . . ?
C8 Ru1 C4 99.97(15) . . ?
C9 Ru1 C4 112.97(15) . . ?
C5 Ru1 C7 99.99(15) . . ?
C6 Ru1 C7 112.93(16) . . ?
C8 Ru1 C7 37.08(14) . . ?
C9 Ru1 C7 66.89(15) . . ?
C4 Ru1 C7 111.44(19) . . ?
C5 Ru1 C1 66.87(18) . . ?
C6 Ru1 C1 37.39(16) . . ?
C8 Ru1 C1 178.63(14) . . ?
C9 Ru1 C1 142.50(17) . . ?
C4 Ru1 C1 79.06(16) . . ?
C7 Ru1 C1 144.18(15) . . ?
C5 Ru1 C12 111.58(15) . . ?
C6 Ru1 C12 100.37(15) . . ?
C8 Ru1 C12 66.64(15) . . ?
C9 Ru1 C12 79.13(15) . . ?
C4 Ru1 C12 140.89(16) . . ?
C7 Ru1 C12 36.81(14) . . ?
C1 Ru1 C12 114.72(15) . . ?
C5 Ru1 C2 78.92(16) . . ?
C6 Ru1 C2 67.11(16) . . ?
C8 Ru1 C2 141.98(15) . . ?
C9 Ru1 C2 113.09(16) . . ?
C4 Ru1 C2 66.76(18) . . ?
C7 Ru1 C2 178.12(15) . . ?
C1 Ru1 C2 36.74(14) . . ?
C12 Ru1 C2 145.02(16) . . ?
C5 Ru1 C10 178.54(15) . . ?
C6 Ru1 C10 142.44(18) . . ?
C8 Ru1 C10 66.56(18) . . ?
C9 Ru1 C10 37.02(15) . . ?
C4 Ru1 C10 143.69(15) . . ?
C7 Ru1 C10 78.79(16) . . ?
C1 Ru1 C10 113.7(2) . . ?
C12 Ru1 C10 66.96(15) . . ?
C2 Ru1 C10 102.33(17) . . ?
C5 Ru1 C3 67.04(16) . . ?
C6 Ru1 C3 79.72(15) . . ?
C8 Ru1 C3 111.87(15) . . ?
C9 Ru1 C3 100.80(15) . . ?
C4 Ru1 C3 36.94(15) . . ?
C7 Ru1 C3 140.97(15) . . ?
C1 Ru1 C3 66.78(15) . . ?
C12 Ru1 C3 177.60(16) . . ?
C2 Ru1 C3 37.19(14) . . ?
C10 Ru1 C3 114.41(16) . . ?
C5 Ru1 C11 142.02(16) . . ?
C6 Ru1 C11 112.69(16) . . ?
C8 Ru1 C11 78.82(16) . . ?
C9 Ru1 C11 66.69(15) . . ?
C4 Ru1 C11 178.39(16) . . ?
C7 Ru1 C11 66.96(18) . . ?
C1 Ru1 C11 102.17(16) . . ?
C12 Ru1 C11 37.65(15) . . ?
C2 Ru1 C11 114.8(2) . . ?
C10 Ru1 C11 36.75(14) . . ?
C3 Ru1 C11 144.50(16) . . ?
C15 Ru2 C16 37.16(14) . . ?
C15 Ru2 C14 37.37(13) . . ?
C16 Ru2 C14 67.33(14) . . ?
C15 Ru2 C20 143.00(15) . . ?
C16 Ru2 C20 113.45(15) . . ?
C14 Ru2 C20 179.01(15) . . ?
C15 Ru2 C22 141.83(16) . . ?
C16 Ru2 C22 178.93(15) . . ?
C14 Ru2 C22 111.96(14) . . ?
C20 Ru2 C22 67.26(14) . . ?
C15 Ru2 C21 179.24(16) . . ?
C16 Ru2 C21 143.54(16) . . ?
C14 Ru2 C21 142.38(15) . . ?
C20 Ru2 C21 37.24(14) . . ?
C22 Ru2 C21 37.46(15) . . ?
C15 Ru2 C23 112.34(16) . . ?
C16 Ru2 C23 141.92(16) . . ?
C14 Ru2 C23 100.31(15) . . ?
C20 Ru2 C23 78.70(15) . . ?
C22 Ru2 C23 37.15(14) . . ?
C21 Ru2 C23 66.91(16) . . ?
C15 Ru2 C13 66.73(15) . . ?
C16 Ru2 C13 79.22(14) . . ?
C14 Ru2 C13 36.83(14) . . ?
C20 Ru2 C13 143.60(16) . . ?
C22 Ru2 C13 100.68(15) . . ?
C21 Ru2 C13 113.40(15) . . ?
C23 Ru2 C13 113.13(15) . . ?
C15 Ru2 C24 100.09(15) . . ?
C16 Ru2 C24 112.23(14) . . ?
C14 Ru2 C24 112.33(17) . . ?
C20 Ru2 C24 66.86(16) . . ?
C22 Ru2 C24 67.20(15) . . ?
C21 Ru2 C24 79.35(15) . . ?
C23 Ru2 C24 36.93(13) . . ?
C13 Ru2 C24 142.34(16) . . ?
C15 Ru2 C19 112.36(15) . . ?
C16 Ru2 C19 100.34(14) . . ?
C14 Ru2 C19 142.14(16) . . ?
C20 Ru2 C19 37.43(15) . . ?
C22 Ru2 C19 79.75(14) . . ?
C21 Ru2 C19 67.51(15) . . ?
C23 Ru2 C19 66.66(15) . . ?
C13 Ru2 C19 178.97(16) . . ?
C24 Ru2 C19 36.98(15) . . ?
C15 Ru2 C17 66.78(17) . . ?
C16 Ru2 C17 37.37(14) . . ?
C14 Ru2 C17 78.90(15) . . ?
C20 Ru2 C17 102.09(16) . . ?
C22 Ru2 C17 143.55(16) . . ?
C21 Ru2 C17 113.98(17) . . ?
C23 Ru2 C17 179.10(16) . . ?
C13 Ru2 C17 66.49(14) . . ?
C24 Ru2 C17 142.98(14) . . ?
C19 Ru2 C17 113.71(15) . . ?
C15 Ru2 C18 78.71(15) . . ?
C16 Ru2 C18 66.90(15) . . ?
C14 Ru2 C18 66.61(17) . . ?
C20 Ru2 C18 114.20(17) . . ?
C22 Ru2 C18 113.65(15) . . ?
C21 Ru2 C18 101.85(16) . . ?
C23 Ru2 C18 143.40(14) . . ?
C13 Ru2 C18 37.02(14) . . ?
C24 Ru2 C18 178.79(15) . . ?
C19 Ru2 C18 143.64(17) . . ?
C17 Ru2 C18 36.66(13) . . ?
C2 C1 C6 120.6(4) . . ?
C2 C1 Ru1 71.9(2) . . ?
C6 C1 Ru1 70.7(2) . . ?
C1 C2 C3 120.4(4) . . ?
C1 C2 Ru1 71.4(2) . . ?
C3 C2 Ru1 71.5(2) . . ?
C4 C3 C2 119.5(4) . . ?
C4 C3 Ru1 70.9(2) . . ?
C2 C3 Ru1 71.3(2) . . ?
C3 C4 C5 119.9(4) . . ?
C3 C4 Ru1 72.1(2) . . ?
C5 C4 Ru1 70.8(2) . . ?
C6 C5 C4 120.7(4) . . ?
C6 C5 Ru1 71.5(2) . . ?
C4 C5 Ru1 71.7(2) . . ?
C5 C6 C1 118.9(4) . . ?
C5 C6 Ru1 71.2(2) . . ?
C1 C6 Ru1 71.9(2) . . ?
C12 C7 C8 120.2(4) . . ?
C12 C7 Ru1 72.0(2) . . ?
C8 C7 Ru1 71.1(2) . . ?
C9 C8 C7 120.6(4) . . ?
C9 C8 Ru1 71.6(2) . . ?
C7 C8 Ru1 71.9(2) . . ?
C8 C9 C10 119.9(4) . . ?
C8 C9 Ru1 71.37(19) . . ?
C10 C9 Ru1 72.2(2) . . ?
C11 C10 C9 120.3(4) . . ?
C11 C10 Ru1 71.8(2) . . ?
C9 C10 Ru1 70.8(2) . . ?
C10 C11 C12 119.5(4) . . ?
C10 C11 Ru1 71.5(2) . . ?
C12 C11 Ru1 71.0(2) . . ?
C7 C12 C11 119.5(4) . . ?
C7 C12 Ru1 71.2(2) . . ?
C11 C12 Ru1 71.4(2) . . ?
C14 C13 C18 120.4(4) . . ?
C14 C13 Ru2 71.1(2) . . ?
C18 C13 Ru2 72.2(2) . . ?
C13 C14 C15 119.8(4) . . ?
C13 C14 Ru2 72.0(2) . . ?
C15 C14 Ru2 71.1(2) . . ?
C16 C15 C14 120.6(4) . . ?
C16 C15 Ru2 71.6(2) . . ?
C14 C15 Ru2 71.56(19) . . ?
C15 C16 C17 119.3(4) . . ?
C15 C16 Ru2 71.26(19) . . ?
C17 C16 Ru2 72.1(2) . . ?
C18 C17 C16 120.2(4) . . ?
C18 C17 Ru2 72.0(2) . . ?
C16 C17 Ru2 70.5(2) . . ?
C17 C18 C13 119.7(4) . . ?
C17 C18 Ru2 71.3(2) . . ?
C13 C18 Ru2 70.8(2) . . ?
C24 C19 C20 119.1(4) . . ?
C24 C19 Ru2 71.4(2) . . ?
C20 C19 Ru2 70.8(2) . . ?
C21 C20 C19 120.8(4) . . ?
C21 C20 Ru2 71.6(2) . . ?
C19 C20 Ru2 71.8(2) . . ?
C20 C21 C22 119.5(4) . . ?
C20 C21 Ru2 71.20(19) . . ?
C22 C21 Ru2 71.1(2) . . ?
C23 C22 C21 119.2(4) . . ?
C23 C22 Ru2 71.60(19) . . ?
C21 C22 Ru2 71.4(2) . . ?
C24 C23 C22 121.2(4) . . ?
C24 C23 Ru2 71.8(2) . . ?
C22 C23 Ru2 71.2(2) . . ?
C23 C24 C19 120.1(4) . . ?
C23 C24 Ru2 71.3(2) . . ?
C19 C24 Ru2 71.6(2) . . ?
F3 B1 F4 116.3(5) . . ?
F3 B1 F1 110.0(4) . . ?
F4 B1 F1 108.3(4) . . ?
F3 B1 F2 108.5(4) . . ?
F4 B1 F2 107.6(4) . . ?
F1 B1 F2 105.6(5) . . ?
F6 B2 F7 110.4(4) . . ?
F6 B2 F8 109.0(3) . . ?
F7 B2 F8 109.0(3) . . ?
F6 B2 F5 109.3(3) . . ?
F7 B2 F5 108.7(3) . . ?
F8 B2 F5 110.4(4) . . ?
F12 B3 F11 109.8(4) . . ?
F12 B3 F9 110.2(4) . . ?
F11 B3 F9 108.5(3) . . ?
F12 B3 F10 108.9(4) . . ?
F11 B3 F10 111.4(4) . . ?
F9 B3 F10 108.0(4) . . ?
F16 B4 F15 109.4(4) . . ?
F16 B4 F14 108.7(4) . . ?
F15 B4 F14 112.8(4) . . ?
F16 B4 F13 109.4(4) . . ?
F15 B4 F13 108.6(4) . . ?
F14 B4 F13 107.9(3) . . ?
O1 N1 O2 125.5(4) . . ?
O1 N1 C1S 117.7(4) . . ?
O2 N1 C1S 116.7(4) . . ?
O3 N2 O4 125.6(4) . . ?
O3 N2 C2S 116.8(4) . . ?
O4 N2 C2S 117.5(4) . . ?
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
Ru1 C5 2.193(3) . ?
Ru1 C6 2.196(3) . ?
Ru1 C8 2.198(3) . ?
Ru1 C9 2.201(3) . ?
Ru1 C4 2.205(4) . ?
Ru1 C7 2.208(3) . ?
Ru1 C1 2.212(4) . ?
Ru1 C12 2.218(4) . ?
Ru1 C2 2.218(4) . ?
Ru1 C10 2.219(4) . ?
Ru1 C3 2.220(4) . ?
Ru1 C11 2.223(4) . ?
Ru2 C15 2.196(3) . ?
Ru2 C16 2.200(3) . ?
Ru2 C14 2.202(3) . ?
Ru2 C20 2.203(3) . ?
Ru2 C22 2.203(3) . ?
Ru2 C21 2.207(3) . ?
Ru2 C23 2.208(3) . ?
Ru2 C13 2.213(4) . ?
Ru2 C24 2.214(3) . ?
Ru2 C19 2.216(3) . ?
Ru2 C17 2.221(4) . ?
Ru2 C18 2.231(4) . ?
C1 C2 1.396(5) . ?
C1 C6 1.413(6) . ?
C2 C3 1.415(6) . ?
C3 C4 1.402(6) . ?
C4 C5 1.414(5) . ?
C5 C6 1.405(6) . ?
C7 C12 1.397(5) . ?
C7 C8 1.401(5) . ?
C8 C9 1.397(6) . ?
C9 C10 1.403(6) . ?
C10 C11 1.400(5) . ?
C11 C12 1.433(6) . ?
C13 C14 1.395(5) . ?
C13 C18 1.411(5) . ?
C14 C15 1.409(5) . ?
C15 C16 1.400(5) . ?
C16 C17 1.417(6) . ?
C17 C18 1.400(5) . ?
C19 C24 1.405(6) . ?
C19 C20 1.418(6) . ?
C20 C21 1.408(5) . ?
C21 C22 1.416(6) . ?
C22 C23 1.405(5) . ?
C23 C24 1.400(5) . ?
B1 F3 1.319(5) . ?
B1 F4 1.337(5) . ?
B1 F1 1.345(6) . ?
B1 F2 1.351(5) . ?
B2 F6 1.365(5) . ?
B2 F7 1.368(5) . ?
B2 F8 1.378(5) . ?
B2 F5 1.390(5) . ?
B3 F12 1.341(5) . ?
B3 F11 1.356(5) . ?
B3 F9 1.359(5) . ?
B3 F10 1.370(5) . ?
B4 F16 1.336(6) . ?
B4 F15 1.348(5) . ?
B4 F14 1.354(5) . ?
B4 F13 1.366(5) . ?
C1S N1 1.471(6) . ?
N1 O1 1.205(4) . ?
N1 O2 1.221(4) . ?
C2S N2 1.470(6) . ?
N2 O3 1.210(4) . ?
N2 O4 1.220(4) . ?
