#------------------------------------------------------------------------------
#$Date: 2016-03-23 20:41:30 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179419 $
#$URL: svn://www.crystallography.net/cod/cif/4/33/16/4331653.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_4331653
loop_
_publ_author_name
'Beatriz Calvo'
'Ramón Macías'
'Maria Jose Artigas'
'Fernando J. Lahoz'
'Luis A. Oro'
_publ_contact_author_address
;
  Dr. Fernando J. Lahoz
  Departamento de Química Inorgánica - I.S.Q.C.H.
  Instituto de Síntesis Química y Catálisis Homogénea
  Facultad de Ciencias
  Universidad de Zaragoza - C.S.I.C.
  50009 Zaragoza, Spain
;
_publ_contact_author_email       lahoz@unizar.es
_publ_contact_author_fax         '+34 976 761187'
_publ_contact_author_name        'Dr. Fernando J. Lahoz'
_publ_contact_author_phone       '+34 976 761147'
_publ_section_title
;
 Reactions of 11-Vertex Rhodathiaboranes with HCl: Synthesis and
 Reactivity of New Cl-Ligated Clusters
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              211
_journal_page_last               221
_journal_paper_doi               10.1021/ic301715n
_journal_volume                  52
_journal_year                    2013
_chemical_formula_moiety
;
 C11 H32 B9 Cl N  P2 Rh S, 0.5(C3 H6 O), 0.5(C3 H6 O)
;
_chemical_formula_sum            'C14 H38 B9 Cl N O P2 Rh S'
_chemical_formula_weight         566.11
_chemical_name_systematic
;
 ?
;
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 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                 93.002(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   24.184(5)
_cell_length_b                   15.085(3)
_cell_length_c                   14.588(3)
_cell_measurement_reflns_used    29325
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      29.44
_cell_measurement_theta_min      2.730
_cell_volume                     5314.6(19)
_computing_cell_refinement       'APEX2 v. 2008.4 (Bruker AXS, 2008)'
_computing_data_collection       'APEX2 v. 2008.4 (Bruker AXS, 2008)'
_computing_data_reduction        'APEX2 v. 2008.4 (Bruker AXS, 2008)'
_computing_molecular_graphics    ORTEP
_computing_publication_material  ENCIFER
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      100(2)
_diffrn_detector_area_resol_mean 8.26
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.928
_diffrn_measurement_device_type  'Bruker APEX DUO system'
_diffrn_measurement_method       'ω rotations with narrow frames'
_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  0.0220
_diffrn_reflns_av_sigmaI/netI    0.0188
_diffrn_reflns_limit_h_max       31
_diffrn_reflns_limit_h_min       -32
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_k_min       -20
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            28762
_diffrn_reflns_theta_full        27.50
_diffrn_reflns_theta_max         29.65
_diffrn_reflns_theta_min         1.59
_diffrn_standards_decay_%        0
_exptl_absorpt_coefficient_mu    0.951
_exptl_absorpt_correction_T_max  0.9014
_exptl_absorpt_correction_T_min  0.7621
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
 multi-scan correction included in APEX2 package (Bruker AXS, 2008)
;
_exptl_crystal_colour            Yellow
_exptl_crystal_density_diffrn    1.414
_exptl_crystal_description       Cube
_exptl_crystal_F_000             2320
_exptl_crystal_size_max          0.203
_exptl_crystal_size_mid          0.131
_exptl_crystal_size_min          0.107
_refine_diff_density_max         0.680
_refine_diff_density_min         -0.379
_refine_diff_density_rms         0.073
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.130
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     402
_refine_ls_number_reflns         6964
_refine_ls_number_restraints     20
_refine_ls_restrained_S_all      1.146
_refine_ls_R_factor_all          0.0276
_refine_ls_R_factor_gt           0.0258
_refine_ls_shift/su_max          0.038
_refine_ls_shift/su_mean         0.002
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0279P)²+10.4338P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0677
_refine_ls_wR_factor_ref         0.0685
_reflns_number_gt                6615
_reflns_number_total             6964
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic301715n_si_002_2.cif
_cod_data_source_block           global
_cod_original_cell_volume        5314.8(18)
_cod_database_code               4331653
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -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
Rh8 Rh 0.325935(6) 0.345659(9) 0.288043(9) 0.01462(5) Uani 1 1 d D . .
Cl1 Cl 0.28950(2) 0.49270(3) 0.34031(3) 0.02492(10) Uani 1 1 d . A .
P1 P 0.34434(3) 0.42444(4) 0.15954(4) 0.02185(14) Uani 0.9262(17) 1 d PD A 1
C1 C 0.39336(12) 0.51247(17) 0.1861(2) 0.0392(6) Uani 0.9262(17) 1 d PD A 1
H1A H 0.3958 0.5512 0.1325 0.059 Uiso 0.9262(17) 1 calc PR A 1
H1B H 0.4298 0.4869 0.2022 0.059 Uiso 0.9262(17) 1 calc PR A 1
H1C H 0.3810 0.5471 0.2380 0.059 Uiso 0.9262(17) 1 calc PR A 1
C2 C 0.3723(3) 0.3737(4) 0.0584(3) 0.043(2) Uani 0.9262(17) 1 d PD A 1
H2A H 0.3714 0.4168 0.0081 0.064 Uiso 0.9262(17) 1 calc PR A 1
H2B H 0.3500 0.3219 0.0400 0.064 Uiso 0.9262(17) 1 calc PR A 1
H2C H 0.4107 0.3552 0.0728 0.064 Uiso 0.9262(17) 1 calc PR A 1
C3 C 0.28542(11) 0.48331(15) 0.10609(16) 0.0296(5) Uani 0.9262(17) 1 d PD A 1
H3A H 0.2657 0.5146 0.1533 0.044 Uiso 0.9262(17) 1 calc PR A 1
H3B H 0.2604 0.4408 0.0745 0.044 Uiso 0.9262(17) 1 calc PR A 1
H3C H 0.2985 0.5262 0.0617 0.044 Uiso 0.9262(17) 1 calc PR A 1
P1B P 0.3759(4) 0.4190(5) 0.1753(5) 0.0262(18) Uiso 0.0738(17) 1 d PD A 2
C1B C 0.3656(14) 0.5376(13) 0.159(2) 0.039(7) Uiso 0.0738(17) 1 d PD A 2
C2B C 0.369(3) 0.375(4) 0.058(2) 0.020(17) Uiso 0.0738(17) 1 d PD A 2
C3B C 0.4512(8) 0.414(2) 0.196(2) 0.033(6) Uiso 0.0738(17) 1 d PD A 2
P2 P 0.23604(2) 0.30051(4) 0.23640(4) 0.01701(13) Uani 0.9262(17) 1 d PD A 1
C4 C 0.22211(14) 0.2616(3) 0.1191(2) 0.0266(6) Uani 0.9262(17) 1 d PD A 1
H4A H 0.1830 0.2454 0.1102 0.040 Uiso 0.9262(17) 1 calc PR A 1
H4B H 0.2452 0.2096 0.1080 0.040 Uiso 0.9262(17) 1 calc PR A 1
H4C H 0.2307 0.3088 0.0759 0.040 Uiso 0.9262(17) 1 calc PR A 1
C5 C 0.18061(9) 0.37983(16) 0.24928(18) 0.0290(5) Uani 0.9262(17) 1 d PD A 1
H5A H 0.1453 0.3535 0.2272 0.044 Uiso 0.9262(17) 1 calc PR A 1
H5B H 0.1878 0.4331 0.2134 0.044 Uiso 0.9262(17) 1 calc PR A 1
H5C H 0.1787 0.3958 0.3142 0.044 Uiso 0.9262(17) 1 calc PR A 1
C6 C 0.21079(9) 0.20695(15) 0.30075(16) 0.0253(4) Uani 0.9262(17) 1 d PD A 1
H6A H 0.2128 0.2212 0.3664 0.038 Uiso 0.9262(17) 1 calc PR A 1
H6B H 0.2337 0.1547 0.2900 0.038 Uiso 0.9262(17) 1 calc PR A 1
H6C H 0.1723 0.1945 0.2806 0.038 Uiso 0.9262(17) 1 calc PR A 1
P2B P 0.2465(3) 0.3320(6) 0.2102(6) 0.0255(18) Uiso 0.0738(17) 1 d PD A 2
C4B C 0.226(2) 0.242(2) 0.132(3) 0.043(19) Uiso 0.0738(17) 1 d PD A 2
C5B C 0.1924(12) 0.329(2) 0.2895(19) 0.037(7) Uiso 0.0738(17) 1 d PD A 2
C6B C 0.2303(15) 0.4290(16) 0.142(2) 0.043(8) Uiso 0.0738(17) 1 d PD A 2
B3 B 0.3898(4) 0.3602(6) 0.4068(6) 0.0198(13) Uani 0.9262(17) 1 d PD A 1
B4 B 0.41441(9) 0.30923(15) 0.30522(15) 0.0180(4) Uani 0.9262(17) 1 d PD A 1
S7 S 0.31608(3) 0.30242(4) 0.44218(3) 0.01794(12) Uani 0.9262(17) 1 d PD A 1
B3B B 0.328(4) 0.290(7) 0.439(5) 0.13(6) Uiso 0.0738(17) 1 d PD A 2
B4B B 0.3141(13) 0.2133(19) 0.346(2) 0.023(6) Uiso 0.0738(17) 1 d PD A 2
S7B S 0.3952(12) 0.3694(19) 0.412(2) 0.023(5) Uiso 0.0738(17) 1 d PD A 2
B1 B 0.44186(9) 0.27916(15) 0.41862(15) 0.0219(4) Uani 1 1 d . . .
B2 B 0.39042(9) 0.27244(16) 0.49959(15) 0.0224(4) Uani 1 1 d . A .
B5 B 0.42923(9) 0.19550(14) 0.33420(14) 0.0194(4) Uani 1 1 d . A .
B6 B 0.41329(10) 0.17503(15) 0.44923(15) 0.0222(4) Uani 1 1 d . A .
B9 B 0.36816(8) 0.22167(13) 0.26504(13) 0.0161(4) Uani 1 1 d . A .
B10 B 0.36756(9) 0.13663(14) 0.35920(14) 0.0195(4) Uani 1 1 d D . .
B11 B 0.34230(10) 0.18399(15) 0.46261(15) 0.0219(4) Uani 1 1 d . A .
N1 N 0.37150(6) 0.17267(10) 0.17088(10) 0.0163(3) Uani 1 1 d . . .
C51 C 0.41594(8) 0.18510(13) 0.11985(13) 0.0209(4) Uani 1 1 d . A .
C52 C 0.42201(9) 0.13999(15) 0.03871(14) 0.0260(4) Uani 1 1 d . . .
C53 C 0.38246(9) 0.07796(14) 0.01015(14) 0.0270(4) Uani 1 1 d . A .
C54 C 0.33774(9) 0.06334(13) 0.06345(14) 0.0233(4) Uani 1 1 d . . .
C55 C 0.33315(8) 0.11156(12) 0.14319(13) 0.0192(3) Uani 1 1 d . A .
O61 O 0.5000 0.3100(4) 0.7500 0.081(3) Uani 0.50 2 d SP . .
C62 C 0.5323(3) 0.3102(5) 0.6962(7) 0.071(2) Uani 0.50 1 d P . .
C63 C 0.5286(3) 0.3868(6) 0.6284(5) 0.067(2) Uani 0.50 1 d P . .
C64 C 0.5655(3) 0.2528(6) 0.6768(7) 0.085(3) Uani 0.50 1 d P . .
C71 C 0.46249(18) 0.0448(3) 0.6872(3) 0.0789(12) Uani 1 1 d . . .
C72 C 0.5164(2) 0.0670(4) 0.7184(3) 0.0374(11) Uani 0.50 1 d P . .
O73 O 0.5478(2) 0.0992(4) 0.6658(3) 0.0758(16) Uani 0.50 1 d P . .
H3 H 0.3947(11) 0.427(2) 0.4294(18) 0.022(6) Uiso 0.9262(17) 1 d P A 1
H1 H 0.4803(11) 0.2978(17) 0.4377(18) 0.030(7) Uiso 1 1 d . . .
H2 H 0.3944(10) 0.2921(16) 0.5659(17) 0.023(6) Uiso 1 1 d . . .
H4 H 0.4418(11) 0.3407(17) 0.2592(19) 0.032(7) Uiso 1 1 d . . .
H5 H 0.4614(11) 0.1617(16) 0.3061(18) 0.025(6) Uiso 1 1 d . . .
H6 H 0.4363(11) 0.1232(18) 0.4877(18) 0.030(7) Uiso 1 1 d . . .
H10 H 0.3675(10) 0.0641(16) 0.3421(16) 0.020(6) Uiso 1 1 d . . .
H11 H 0.3212(11) 0.1490(16) 0.5135(18) 0.026(6) Uiso 1 1 d . . .
H51 H 0.4434(10) 0.2244(16) 0.1429(16) 0.021(6) Uiso 1 1 d . . .
H52 H 0.4522(12) 0.1514(18) 0.007(2) 0.033(7) Uiso 1 1 d . . .
H53 H 0.3846(10) 0.0472(17) -0.0444(17) 0.025(6) Uiso 1 1 d . . .
H54 H 0.3117(10) 0.0211(17) 0.0487(16) 0.021(6) Uiso 1 1 d . . .
H55 H 0.3033(9) 0.1029(15) 0.1797(15) 0.015(5) Uiso 1 1 d . . .
H910 H 0.3308(10) 0.1825(18) 0.3146(19) 0.038(7) Uiso 1 1 d 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'
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'
Rh Rh -1.1178 0.9187 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 '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'
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
B9 Rh8 P2B 104.3(2) . .
B9 Rh8 B4B 49.2(9) . .
P2B Rh8 B4B 89.3(8) . .
B9 Rh8 B4 48.81(8) . .
P2B Rh8 B4 148.5(2) . .
B4B Rh8 B4 82.8(8) . .
B9 Rh8 P1 102.04(6) . .
P2B Rh8 P1 80.0(3) . .
B4B Rh8 P1 145.8(8) . .
B4 Rh8 P1 89.62(6) . .
B9 Rh8 B3B 82(3) . .
P2B Rh8 B3B 115.3(18) . .
B4B Rh8 B3B 46.5(14) . .
B4 Rh8 B3B 80(3) . .
P1 Rh8 B3B 163.2(10) . .
B9 Rh8 P2 97.76(6) . .
P2B Rh8 P2 16.3(3) . .
B4B Rh8 P2 74.0(8) . .
B4 Rh8 P2 146.43(6) . .
P1 Rh8 P2 95.96(2) . .
B3B Rh8 P2 99.8(16) . .
B9 Rh8 S7 88.91(5) . .
P2B Rh8 S7 109.8(3) . .
B4B Rh8 S7 50.1(8) . .
B4 Rh8 S7 88.21(6) . .
P1 Rh8 S7 163.30(2) . .
B3B Rh8 S7 8(3) . .
P2 Rh8 S7 94.98(2) . .
B9 Rh8 P1B 91.9(2) . .
P2B Rh8 P1B 98.6(3) . .
B4B Rh8 P1B 140.9(9) . .
B4 Rh8 P1B 70.6(2) . .
P1 Rh8 P1B 19.5(2) . .
B3B Rh8 P1B 146.1(17) . .
P2 Rh8 P1B 114.1(2) . .
S7 Rh8 P1B 150.5(2) . .
B9 Rh8 S7B 86.0(8) . .
P2B Rh8 S7B 162.5(8) . .
B4B Rh8 S7B 86.8(9) . .
B4 Rh8 S7B 47.6(8) . .
P1 Rh8 S7B 112.2(7) . .
B3B Rh8 S7B 51.4(12) . .
P2 Rh8 S7B 150.3(7) . .
S7 Rh8 S7B 55.5(7) . .
P1B Rh8 S7B 95.2(7) . .
B9 Rh8 Cl1 169.26(5) . .
P2B Rh8 Cl1 85.9(2) . .
B4B Rh8 Cl1 129.0(8) . .
B4 Rh8 Cl1 122.44(6) . .
P1 Rh8 Cl1 82.91(2) . .
B3B Rh8 Cl1 91(2) . .
P2 Rh8 Cl1 91.13(2) . .
S7 Rh8 Cl1 84.31(2) . .
P1B Rh8 Cl1 89.90(19) . .
S7B Rh8 Cl1 83.3(8) . .
C1 P1 C3 102.89(12) . .
C1 P1 C2 102.4(3) . .
C3 P1 C2 100.0(2) . .
C1 P1 Rh8 111.11(10) . .
C3 P1 Rh8 115.09(9) . .
C2 P1 Rh8 122.9(2) . .
C1B P1B C2B 103.0(19) . .
C1B P1B C3B 100.7(13) . .
C2B P1B C3B 100.5(19) . .
C1B P1B Rh8 118.6(12) . .
C2B P1B Rh8 117(2) . .
C3B P1B Rh8 114.1(10) . .
C5 P2 C6 100.87(12) . .
C5 P2 C4 102.04(15) . .
C6 P2 C4 100.60(15) . .
C5 P2 Rh8 116.70(8) . .
C6 P2 Rh8 112.78(8) . .
C4 P2 Rh8 120.89(11) . .
C5B P2B C6B 103.6(14) . .
C5B P2B C4B 101.7(17) . .
C6B P2B C4B 102.5(16) . .
C5B P2B Rh8 108.5(12) . .
C6B P2B Rh8 111.7(13) . .
C4B P2B Rh8 126.3(18) . .
B1 B3 B4 61.1(3) . .
B1 B3 B2 57.6(3) . .
B4 B3 B2 107.4(5) . .
B1 B3 S7 107.7(4) . .
B4 B3 S7 110.6(4) . .
B2 B3 S7 60.2(3) . .
B3 B4 B5 106.5(3) . .
B3 B4 B1 58.3(3) . .
B5 B4 B1 59.10(12) . .
B3 B4 B9 110.7(3) . .
B5 B4 B9 59.45(12) . .
B1 B4 B9 107.73(15) . .
B3 B4 Rh8 68.1(3) . .
B5 B4 Rh8 116.33(13) . .
B1 B4 Rh8 118.23(13) . .
B9 B4 Rh8 64.30(9) . .
B11 S7 B2 55.88(10) . .
B11 S7 B3 98.6(3) . .
B2 S7 B3 55.4(3) . .
B11 S7 Rh8 110.88(7) . .
B2 S7 Rh8 109.16(7) . .
B3 S7 Rh8 61.1(3) . .
B11 B3B B2 65(5) . .
B11 B3B B4B 64(3) . .
B2 B3B B4B 114(6) . .
B11 B3B S7B 116(6) . .
B2 B3B S7B 61(2) . .
B4B B3B S7B 110(2) . .
B11 B3B Rh8 122(2) . .
B2 B3B Rh8 120(2) . .
B4B B3B Rh8 62(3) . .
S7B B3B Rh8 66(2) . .
B10 B4B B3B 104(5) . .
B10 B4B B9 63.9(11) . .
B3B B4B B9 109.6(19) . .
B10 B4B B11 60.4(10) . .
B3B B4B B11 55(4) . .
B9 B4B B11 111.9(16) . .
B10 B4B Rh8 122.4(15) . .
B3B B4B Rh8 71(4) . .
B9 B4B Rh8 64.5(9) . .
B11 B4B Rh8 121.6(13) . .
B1 S7B B2 56.3(9) . .
B1 S7B B3B 93(4) . .
B2 S7B B3B 51(4) . .
B1 S7B Rh8 110.0(12) . .
B2 S7B Rh8 108.4(10) . .
B3B S7B Rh8 63(3) . .
B3 B1 B2 65.1(3) . .
B2 B1 S7B 67.1(10) . .
B3 B1 B5 109.2(3) . .
B2 B1 B5 108.75(16) . .
S7B B1 B5 115.0(8) . .
B3 B1 B6 110.6(3) . .
B2 B1 B6 59.00(13) . .
S7B B1 B6 116.0(8) . .
B5 B1 B6 59.55(12) . .
B3 B1 B4 60.6(3) . .
B2 B1 B4 112.92(16) . .
S7B B1 B4 63.4(10) . .
B5 B1 B4 60.19(12) . .
B6 B1 B4 108.77(15) . .
B6 B2 B3B 102(2) . .
B6 B2 B1 61.06(13) . .
B3B B2 B1 106.2(15) . .
B6 B2 B11 58.24(13) . .
B3B B2 B11 56(3) . .
B1 B2 B11 107.70(15) . .
B6 B2 B3 106.2(3) . .
B3B B2 B3 63(3) . .
B1 B2 B3 57.3(3) . .
B11 B2 B3 108.5(3) . .
B6 B2 S7B 108.9(9) . .
B3B B2 S7B 68(2) . .
B1 B2 S7B 56.5(10) . .
B11 B2 S7B 114.3(7) . .
B6 B2 S7 108.21(13) . .
B1 B2 S7 110.96(13) . .
B11 B2 S7 59.82(10) . .
B3 B2 S7 64.4(3) . .
S7B B2 S7 68.8(8) . .
B6 B5 B1 60.33(13) . .
B6 B5 B9 111.06(15) . .
B1 B5 B9 109.93(15) . .
B6 B5 B10 59.65(12) . .
B1 B5 B10 109.02(15) . .
B9 B5 B10 63.40(12) . .
B6 B5 B4 109.82(15) . .
B1 B5 B4 60.71(12) . .
B9 B5 B4 60.55(12) . .
B10 B5 B4 111.31(15) . .
B11 B6 B2 63.39(13) . .
B11 B6 B5 110.95(15) . .
B2 B6 B5 110.00(16) . .
B11 B6 B10 61.81(13) . .
B2 B6 B10 112.86(16) . .
B5 B6 B10 60.77(12) . .
B11 B6 B1 110.90(16) . .
B2 B6 B1 59.94(13) . .
B5 B6 B1 60.11(12) . .
B10 B6 B1 109.75(15) . .
N1 B9 B5 108.16(14) . .
N1 B9 B4 124.73(15) . .
B5 B9 B4 60.00(12) . .
N1 B9 B4B 127.8(9) . .
B5 B9 B4B 102.5(10) . .
B4 B9 B4B 107.1(9) . .
N1 B9 B10 108.75(14) . .
B5 B9 B10 58.33(12) . .
B4 B9 B10 106.85(14) . .
B4B B9 B10 56.0(10) . .
N1 B9 Rh8 126.17(13) . .
B5 B9 Rh8 119.04(12) . .
B4 B9 Rh8 66.90(10) . .
B4B B9 Rh8 66.3(10) . .
B10 B9 Rh8 117.03(12) . .
B4B B10 B6 107.1(9) . .
B4B B10 B5 105.7(9) . .
B6 B10 B5 59.58(12) . .
B4B B10 B11 62.9(10) . .
B6 B10 B11 58.37(13) . .
B5 B10 B11 107.22(15) . .
B4B B10 B9 60.1(10) . .
B6 B10 B9 106.89(15) . .
B5 B10 B9 58.27(11) . .
B11 B10 B9 110.89(14) . .
B3B B11 B6 104(2) . .
B3B B11 B10 106.6(15) . .
B6 B11 B10 59.81(13) . .
B3B B11 B2 59(3) . .
B6 B11 B2 58.37(13) . .
B10 B11 B2 107.26(15) . .
B3B B11 B4B 61(2) . .
B6 B11 B4B 103.5(10) . .
B10 B11 B4B 56.8(10) . .
B2 B11 B4B 107.1(8) . .
B6 B11 S7 112.03(14) . .
B10 B11 S7 111.31(13) . .
B2 B11 S7 64.30(10) . .
B4B B11 S7 62.0(9) . .
C51 N1 C55 118.81(16) . .
C51 N1 B9 119.77(15) . .
C55 N1 B9 121.13(16) . .
N1 C51 C52 121.81(18) . .
C51 C52 C53 119.2(2) . .
C54 C53 C52 119.10(19) . .
C55 C54 C53 119.30(19) . .
N1 C55 C54 121.71(18) . .
C62 O61 C62 179.7(11) . 2_656
O61 C62 C64 129.9(11) . .
O61 C62 C63 115.6(7) . .
C64 C62 C63 113.9(10) . .
C72 C71 C72 51.2(4) . 2_656
O73 C72 C72 156.1(4) . 2_656
O73 C72 C71 119.6(5) . .
C72 C72 C71 67.8(5) 2_656 .
O73 C72 C71 118.9(5) . 2_656
C72 C72 C71 61.0(4) 2_656 2_656
C71 C72 C71 121.2(4) . 2_656
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Rh8 B9 2.166(2) .
Rh8 P2B 2.189(7) .
Rh8 B4B 2.20(3) .
Rh8 B4 2.211(2) .
Rh8 P1 2.2830(6) .
Rh8 B3B 2.36(10) .
Rh8 P2 2.3635(7) .
Rh8 S7 2.3654(7) .
Rh8 P1B 2.366(7) .
Rh8 S7B 2.43(3) .
Rh8 Cl1 2.5196(6) .
P1 C1 1.808(3) .
P1 C3 1.820(2) .
P1 C2 1.824(4) .
P1B C1B 1.821(18) .
P1B C2B 1.828(18) .
P1B C3B 1.832(17) .
P2 C5 1.814(2) .
P2 C6 1.818(2) .
P2 C4 1.824(2) .
P2B C5B 1.792(17) .
P2B C6B 1.800(18) .
P2B C4B 1.818(19) .
B3 B1 1.757(10) .
B3 B4 1.798(9) .
B3 B2 1.893(9) .
B3 S7 2.073(9) .
B4 B5 1.799(3) .
B4 B1 1.808(3) .
B4 B9 1.809(3) .
S7 B11 1.914(2) .
S7 B2 1.995(2) .
B3B B11 1.67(13) .
B3B B2 1.73(12) .
B3B B4B 1.80(2) .
B3B S7B 2.07(2) .
B4B B10 1.74(3) .
B4B B9 1.82(3) .
B4B B11 1.85(3) .
S7B B1 1.77(3) .
S7B B2 1.95(3) .
B1 B2 1.763(3) .
B1 B5 1.779(3) .
B1 B6 1.782(3) .
B2 B6 1.746(3) .
B2 B11 1.833(3) .
B5 B6 1.768(3) .
B5 B9 1.789(3) .
B5 B10 1.790(3) .
B6 B11 1.743(3) .
B6 B10 1.770(3) .
B9 N1 1.566(2) .
B9 B10 1.880(3) .
B10 B11 1.805(3) .
N1 C51 1.352(2) .
N1 C55 1.354(2) .
C51 C52 1.380(3) .
C52 C53 1.386(3) .
C53 C54 1.382(3) .
C54 C55 1.382(3) .
O61 C62 1.136(10) .
O61 C62 1.136(10) 2_656
C62 C64 1.223(10) .
C62 C63 1.521(13) .
C71 C72 1.399(7) .
C71 C72 1.482(6) 2_656
C72 O73 1.209(7) .
C72 C72 1.248(10) 2_656
C72 C71 1.482(6) 2_656
