#------------------------------------------------------------------------------
#$Date: 2016-02-16 22:30:59 +0200 (Tue, 16 Feb 2016) $
#$Revision: 176467 $
#$URL: svn://www.crystallography.net/cod/cif/4/31/83/4318303.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_4318303
loop_
_publ_author_name
'Yasushi Nishihara'
'Kyoko Nara'
'Kohtaro Osakada'
_publ_contact_author_address
;
Research Laboratory of Resources Utilization, Tokyo Institute of
Technology, 4259 Nagatsuta, Midori-ku, Yokohama 226-8503, Japan
;
_publ_contact_author_email       ' kosakada@res.titech.ac.jp '
_publ_contact_author_fax         ' +81-45-924-5224 '
_publ_contact_author_name        ' Kohtaro Osakada'
_publ_contact_author_phone       ' +81-45-924-5224 '
_publ_section_title
;
 Tetraarylpentaborates, [B5O6Ar4]- (Ar = C6H4OMe-4, C6H3Me2-2,6): Their
 Formation from the Reaction of Arylboronic Acids with an Aryloxorhodium
 Complex, Structure, and Chemical Properties
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              4090
_journal_page_last               4092
_journal_paper_doi               10.1021/ic015630w
_journal_volume                  41
_journal_year                    2002
_chemical_formula_sum            'C44 H72 B5 O6 P4 Rh'
_chemical_formula_weight         977.90
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      62
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   23.704(6)
_cell_length_b                   17.254(8)
_cell_length_c                   13.304(2)
_cell_measurement_reflns_used    19
_cell_measurement_temperature    296.2
_cell_measurement_theta_max      10.7
_cell_measurement_theta_min      9.3
_cell_volume                     5441(3)
_diffrn_ambient_temperature      296.2
_diffrn_measurement_device       'Rigaku AFC5R'
_diffrn_measurement_method       ?w-2?q
_diffrn_orient_matrix_UB_11      -0.02045
_diffrn_orient_matrix_UB_12      -0.00031
_diffrn_orient_matrix_UB_13      -0.06574
_diffrn_orient_matrix_UB_21      -0.01756
_diffrn_orient_matrix_UB_22      -0.05092
_diffrn_orient_matrix_UB_23      0.01773
_diffrn_orient_matrix_UB_31      -0.03245
_diffrn_orient_matrix_UB_32      0.02768
_diffrn_orient_matrix_UB_33      0.03185
_diffrn_radiation_detector       'scintillation counter'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'Rigaku rotating anode'
_diffrn_radiation_type           'Mo K?a'
_diffrn_radiation_wavelength     0.7107
_diffrn_reflns_av_R_equivalents  0.00000
_diffrn_reflns_av_sigmaI/netI    0.072
_diffrn_reflns_limit_h_max       0
_diffrn_reflns_limit_h_min       -28
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_k_min       0
_diffrn_reflns_limit_l_max       0
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_number            5326
_diffrn_reflns_reduction_process 'Lp corrections applied'
_diffrn_reflns_theta_max         25.00
_diffrn_reflns_theta_min         2.51
_diffrn_standards_decay_%        0.48
_diffrn_standards_interval_count 150
_diffrn_standards_number         3
_exptl_absorpt_coefficient_mu    0.470
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            'dark orange'
_exptl_crystal_density_diffrn    1.194
_exptl_crystal_density_meas      ?
_exptl_crystal_description       prismatic
_exptl_crystal_F_000             2056.00
_exptl_crystal_size_max          0.75
_exptl_crystal_size_mid          0.53
_exptl_crystal_size_min          0.40
_refine_diff_density_max         0.99
_refine_diff_density_min         -0.51
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_all   3.639
_refine_ls_goodness_of_fit_ref   3.640
_refine_ls_matrix_type           full
_refine_ls_number_constraints    0
_refine_ls_number_parameters     301
_refine_ls_number_reflns         3311
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0565
_refine_ls_R_factor_gt           0.0560
_refine_ls_shift/su_max          0.0300
_refine_ls_shift/su_mean         0.0020
_refine_ls_structure_factor_coef F
_refine_ls_weighting_details     'w = 1/[?s²(Fo) + 0.00000|Fo|²]'
_refine_ls_weighting_scheme      sigma
_refine_ls_wR_factor_all         0.0500
_refine_ls_wR_factor_ref         0.0500
_reflns_number_gt                3311
_reflns_number_total             5326
_reflns_threshold_expression     I>3.00?s(I)
_cod_data_source_file            ic015630w_1.cif
_cod_data_source_block           form2
_cod_depositor_comments
;
The following automatic conversions were performed:

'_exptl_crystal_density_meas' value 'not measured' was changed to '?'
- the value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 3008 2015-01-20 13:52:24Z robertas 
;
_cod_original_cell_volume        5441(2)
_cod_original_formula_sum        'C44 H72 B5 O6 P4 Rh '
_cod_database_code               4318303
loop_
_symmetry_equiv_pos_as_xyz
'   +x,   +y,   +z'
1/2+x,1/2-y,1/2-z
'   -x,1/2+y,   -z'
'1/2-x,   -y,1/2+z'
'   -x,   -y,   -z'
1/2-x,1/2+y,1/2+z
'   +x,1/2-y,   +z'
'1/2+x,   +y,1/2-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_occupancy
_atom_site_refinement_flags
_atom_site_adp_type
_atom_site_calc_flag
_atom_site_calc_attached_atom
Rh(1) 0.14817(2) 0.2500 0.09154(3) 0.0578(1) 0.500 S Uani d ?
P(1) 0.16815(5) 0.12264(7) 0.12391(9) 0.0863(4) 1.000 . Uani d ?
P(2) 0.19055(6) 0.2500 -0.0625(1) 0.0785(6) 0.500 S Uani d ?
P(3) 0.06860(6) 0.2500 0.1895(1) 0.0767(6) 0.500 S Uani d ?
O(1) 0.3541(1) 0.2500 0.5286(2) 0.079(1) 0.500 S Uani d ?
O(2) 0.2730(1) 0.2500 0.6407(2) 0.067(1) 0.500 S Uani d ?
O(3) 0.35695(9) 0.1794(1) 0.6820(2) 0.0697(8) 1.000 . Uani d ?
O(4) 0.2615(1) 0.2500 0.4645(2) 0.068(1) 0.500 S Uani d ?
O(5) 0.4286(1) 0.2500 0.7628(3) 0.080(1) 0.500 S Uani d ?
C(1) 0.2391(2) 0.0958(2) 0.0949(4) 0.135(2) 1.000 . Uani d ?
C(2) 0.1702(2) 0.1020(3) 0.2570(4) 0.178(3) 1.000 . Uani d ?
C(3) 0.1301(2) 0.0386(2) 0.0793(4) 0.156(2) 1.000 . Uani d ?
C(4) 0.2642(3) 0.2500 -0.0797(5) 0.142(3) 0.500 S Uani d ?
C(5) 0.1696(2) 0.3314(3) -0.1418(3) 0.165(2) 1.000 . Uani d ?
C(6) 0.0685(3) 0.2500 0.3204(5) 0.182(4) 0.500 S Uani d ?
C(7) 0.0211(2) 0.1728(3) 0.1595(4) 0.142(2) 1.000 . Uani d ?
C(8) 0.3429(2) 0.2500 0.3399(4) 0.066(2) 0.500 S Uani d ?
C(9) 0.3545(2) 0.3190(3) 0.2904(3) 0.084(2) 1.000 . Uani d ?
C(10) 0.3758(2) 0.3175(3) 0.1934(3) 0.108(2) 1.000 . Uani d ?
C(11) 0.3865(3) 0.2500 0.1460(5) 0.124(4) 0.500 S Uani d ?
C(12) 0.3438(2) 0.3940(3) 0.3410(3) 0.122(2) 1.000 . Uani d ?
C(13) 0.1737(2) 0.2500 0.5743(3) 0.048(1) 0.500 S Uani d ?
C(14) 0.1437(1) 0.1813(2) 0.5820(2) 0.064(1) 1.000 . Uani d ?
C(15) 0.0860(2) 0.1821(2) 0.5970(3) 0.083(2) 1.000 . Uani d ?
C(16) 0.0576(3) 0.2500 0.6046(5) 0.099(3) 0.500 S Uani d ?
C(17) 0.1741(2) 0.1051(2) 0.5746(3) 0.103(2) 1.000 . Uani d ?
C(18) 0.4368(1) 0.1054(2) 0.7682(3) 0.066(1) 1.000 . Uani d ?
C(19) 0.4834(2) 0.0813(3) 0.7132(4) 0.094(2) 1.000 . Uani d ?
C(20) 0.5151(3) 0.0197(4) 0.7426(6) 0.145(3) 1.000 . Uani d ?
C(21) 0.5033(3) -0.0175(4) 0.8286(6) 0.138(3) 1.000 . Uani d ?
C(22) 0.4582(3) 0.0041(3) 0.8854(4) 0.116(2) 1.000 . Uani d ?
C(23) 0.4246(2) 0.0668(2) 0.8557(3) 0.081(2) 1.000 . Uani d ?
C(24) 0.4977(2) 0.1214(4) 0.6169(4) 0.177(3) 1.000 . Uani d ?
C(25) 0.3751(2) 0.0910(2) 0.9179(3) 0.134(2) 1.000 . Uani d ?
B(1) 0.3346(2) 0.2500 0.6339(5) 0.067(2) 0.500 S Uani d ?
B(2) 0.3184(3) 0.2500 0.4507(5) 0.066(2) 0.500 S Uani d ?
B(3) 0.2391(2) 0.2500 0.5607(4) 0.055(2) 0.500 S Uani d ?
B(4) 0.4051(2) 0.1809(3) 0.7359(3) 0.059(1) 1.000 . Uani d ?
H(1) 0.2390 0.0496 0.0559 0.162 1.000 . Uiso c ?
H(2) 0.2566 0.1362 0.0579 0.162 1.000 . Uiso c ?
H(3) 0.2593 0.0871 0.1555 0.162 1.000 . Uiso c ?
H(4) 0.2052 0.0785 0.2735 0.214 1.000 . Uiso c ?
H(5) 0.1662 0.1490 0.2937 0.214 1.000 . Uiso c ?
H(6) 0.1402 0.0679 0.2739 0.214 1.000 . Uiso c ?
H(7) 0.0993 0.0549 0.0387 0.187 1.000 . Uiso c ?
H(8) 0.1546 0.0070 0.0406 0.187 1.000 . Uiso c ?
H(9) 0.1163 0.0099 0.1350 0.187 1.000 . Uiso c ?
H(10) 0.2750 0.2954 -0.1151 0.170 1.000 . Uiso c ?
H(11) 0.2749 0.2055 -0.1172 0.170 1.000 . Uiso c ?
H(12) 0.2823 0.2500 -0.0160 0.170 0.500 S Uiso d ?
H(13) 0.2002 0.3458 -0.1838 0.198 1.000 . Uiso c ?
H(14) 0.1383 0.3167 -0.1822 0.198 1.000 . Uiso c ?
H(15) 0.1592 0.3741 -0.1006 0.198 1.000 . Uiso c ?
H(16) 0.1062 0.2500 0.3443 0.219 0.500 S Uiso d ?
H(17) 0.0490 0.2945 0.3441 0.219 1.000 . Uiso c ?
H(18) 0.0501 0.2046 0.3441 0.219 1.000 . Uiso c ?
H(19) 0.0068 0.1509 0.2199 0.170 1.000 . Uiso c ?
H(20) -0.0093 0.1924 0.1204 0.170 1.000 . Uiso c ?
H(21) 0.0406 0.1341 0.1224 0.170 1.000 . Uiso c ?
H(22) 0.3829 0.3650 0.1596 0.129 1.000 . Uiso c ?
H(23) 0.399(2) 0.2500 0.075(4) 0.11(2) 0.500 S Uiso d ?
H(24) 0.3319 0.3848 0.4082 0.147 1.000 . Uiso c ?
H(25) 0.3151 0.4213 0.3059 0.147 1.000 . Uiso c ?
H(26) 0.3774 0.4239 0.3415 0.147 1.000 . Uiso c ?
H(27) 0.0661 0.1345 0.6020 0.100 1.000 . Uiso c ?
H(28) 0.013(2) 0.2500 0.610(4) 0.14(2) 0.500 S Uiso d ?
H(29) 0.2119 0.1138 0.5534 0.123 1.000 . Uiso c ?
H(30) 0.1555 0.0728 0.5272 0.123 1.000 . Uiso c ?
H(31) 0.1743 0.0805 0.6385 0.123 1.000 . Uiso c ?
H(32) 0.5457 0.0029 0.7019 0.174 1.000 . Uiso c ?
H(33) 0.5267 -0.0591 0.8500 0.165 1.000 . Uiso c ?
H(34) 0.4494 -0.0235 0.9452 0.139 1.000 . Uiso c ?
H(35) 0.3870 0.1004 0.9850 0.160 1.000 . Uiso c ?
H(36) 0.3475 0.0510 0.9175 0.160 1.000 . Uiso c ?
H(37) 0.3592 0.1370 0.8907 0.160 1.000 . Uiso c ?
H(38) 0.5198 0.0879 0.5761 0.213 1.000 . Uiso c ?
H(39) 0.5185 0.1672 0.6310 0.213 1.000 . Uiso c ?
H(40) 0.4639 0.1345 0.5824 0.213 1.000 . Uiso c ?
loop_
_atom_type_symbol
_atom_type_oxidation_number
_atom_type_number_in_cell
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C 0 176 0.002 0.002
;International Tables for Crystallography
(1992, Vol. C, Table 6.1.1.2)
;
H 0 288 0.000 0.000
;International Tables for Crystallography
(1992, Vol. C, Table 6.1.1.2)
;
O 0 24 0.008 0.006
;International Tables for Crystallography
(1992, Vol. C, Table 6.1.1.2)
;
B 0 20 0.000 0.001
;International Tables for Crystallography
(1992, Vol. C, Table 6.1.1.2)
;
P 0 16 0.090 0.095
;International Tables for Crystallography
(1992, Vol. C, Table 6.1.1.2)
;
Rh 0 4 -1.287 0.919
;International Tables for Crystallography
(1992, Vol. C, Tables 4.2.6.8 and 6.1.1.1)
;
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_2
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
P(1) Rh(1) P(1) 147.5(1) . . . no
P(1) Rh(1) P(2) 94.47(6) . . . no
P(1) Rh(1) P(3) 93.63(6) . . . no
P(1) Rh(1) P(2) 94.47(6) 7 7 7 no
P(1) Rh(1) P(3) 93.63(6) 7 7 7 no
P(2) Rh(1) P(3) 150.7(1) . . . no
Rh(1) P(1) C(1) 113.8(3) . . . no
Rh(1) P(1) C(2) 112.3(3) . . . no
Rh(1) P(1) C(3) 127.2(3) . . . no
C(1) P(1) C(2) 97.8(4) . . . no
C(1) P(1) C(3) 101.0(4) . . . no
C(2) P(1) C(3) 100.2(5) . . . no
Rh(1) P(2) C(4) 123.6(4) . . . no
Rh(1) P(2) C(5) 113.5(3) . . . no
Rh(1) P(2) C(5) 113.5(3) . . . no
C(4) P(2) C(5) 101.3(4) . . . no
C(4) P(2) C(5) 101.3(4) . . . no
C(5) P(2) C(5) 100.6(6) . . . no
Rh(1) P(3) C(6) 124.7(5) . . . no
Rh(1) P(3) C(7) 113.0(3) . . . no
Rh(1) P(3) C(7) 113.0(3) . . . no
C(6) P(3) C(7) 102.8(4) . . . no
C(6) P(3) C(7) 102.8(4) . . . no
C(7) P(3) C(7) 96.3(6) . . . no
B(1) O(1) B(2) 122.5(8) . . . no
B(1) O(2) B(3) 123.5(8) . . . no
B(1) O(3) B(4) 121.3(6) . . . no
B(2) O(4) B(3) 120.3(8) . . . no
B(4) O(5) B(4) 121.9(8) . . . no
P(1) C(1) H(1) 109.5 . . . no
P(1) C(1) H(2) 109.5 . . . no
P(1) C(1) H(3) 109.5 . . . no
H(1) C(1) H(2) 109.5 . . . no
H(1) C(1) H(3) 109.5 . . . no
H(2) C(1) H(3) 109.5 . . . no
P(1) C(2) H(4) 109.5 . . . no
P(1) C(2) H(5) 109.5 . . . no
P(1) C(2) H(6) 109.5 . . . no
H(4) C(2) H(5) 109.5 . . . no
H(4) C(2) H(6) 109.5 . . . no
H(5) C(2) H(6) 109.5 . . . no
P(1) C(3) H(7) 109.5 . . . no
P(1) C(3) H(8) 109.5 . . . no
P(1) C(3) H(9) 109.5 . . . no
H(7) C(3) H(8) 109.5 . . . no
H(7) C(3) H(9) 109.5 . . . no
H(8) C(3) H(9) 109.5 . . . no
P(2) C(4) H(10) 109.5 . . . no
P(2) C(4) H(11) 109.5 . . . no
P(2) C(4) H(11) 109.5 . . . no
P(2) C(4) H(12) 109.5 . . . no
P(2) C(4) H(12) 109.5 . . . no
H(10) C(4) H(11) 110.3 . . . no
H(10) C(4) H(11) 110.3 . . . no
H(10) C(4) H(12) 108.6 . . . no
H(10) C(4) H(12) 108.6 . . . no
H(11) C(4) H(11) 107.8 . . . no
H(11) C(4) H(12) 109.5 . . . no
H(11) C(4) H(12) 1.9 . . . no
H(11) C(4) H(12) 1.9 7 7 7 no
H(11) C(4) H(12) 109.5 7 7 7 no
H(12) C(4) H(12) 111.1 . . . no
P(2) C(5) H(13) 109.5 . . . no
P(2) C(5) H(14) 109.5 . . . no
P(2) C(5) H(15) 109.5 . . . no
H(13) C(5) H(14) 109.5 . . . no
H(13) C(5) H(15) 109.5 . . . no
H(14) C(5) H(15) 109.5 . . . no
P(3) C(6) H(16) 109.5 . . . no
P(3) C(6) H(17) 109.4 . . . no
P(3) C(6) H(17) 109.4 . . . no
P(3) C(6) H(18) 109.4 . . . no
P(3) C(6) H(18) 109.4 . . . no
H(16) C(6) H(17) 110.3 . . . no
H(16) C(6) H(17) 110.3 . . . no
H(16) C(6) H(18) 108.7 . . . no
H(16) C(6) H(18) 108.7 . . . no
H(17) C(6) H(17) 107.8 . . . no
H(17) C(6) H(18) 109.5 . . . no
H(17) C(6) H(18) 1.9 . . . no
H(17) C(6) H(18) 1.9 7 7 7 no
H(17) C(6) H(18) 109.5 7 7 7 no
H(18) C(6) H(18) 111.1 . . . no
P(3) C(7) H(19) 109.5 . . . no
P(3) C(7) H(20) 109.5 . . . no
P(3) C(7) H(21) 109.5 . . . no
H(19) C(7) H(20) 109.5 . . . no
H(19) C(7) H(21) 109.5 . . . no
H(20) C(7) H(21) 109.5 . . . no
C(9) C(8) C(9) 118(1) . . . no
C(9) C(8) B(2) 120.9(5) . . . no
C(9) C(8) B(2) 120.9(5) 7 7 7 no
C(8) C(9) C(10) 120(1) . . . no
C(8) C(9) C(12) 120.0(7) . . . no
C(10) C(9) C(12) 120.1(9) . . . no
C(9) C(10) C(11) 121(1) . . . no
C(9) C(10) H(22) 119.3 . . . no
C(11) C(10) H(22) 119.3 . . . no
C(10) C(11) C(10) 119(1) . . . no
C(10) C(11) H(40) 120.2 . . . no
C(10) C(11) H(40) 120.2 7 7 7 no
C(9) C(12) H(23) 109.5(9) . . . no
C(9) C(12) H(24) 109.5 . . . no
C(9) C(12) H(25) 109.5 . . . no
H(23) C(12) H(24) 109.5 . . . no
H(23) C(12) H(25) 109.5 . . . no
H(24) C(12) H(25) 109.5 . . . no
C(14) C(13) C(14) 117.5(8) . . . no
C(14) C(13) B(3) 121.2(4) . . . no
C(14) C(13) B(3) 121.2(4) 7 7 7 no
C(13) C(14) C(15) 120.7(7) . . . no
C(13) C(14) C(17) 119.7(6) . . . no
C(15) C(14) C(17) 119.6(7) . . . no
C(14) C(15) C(16) 120.7(9) . . . no
C(14) C(15) H(38) 119.6 . . . no
C(16) C(15) H(38) 119.6 . . . no
C(15) C(16) C(15) 120(1) . . . no
C(15) C(16) H(39) 120.1 . . . no
C(15) C(16) H(39) 120.1 7 7 7 no
C(14) C(17) H(26) 109.5 . . . no
C(14) C(17) H(27) 109.5 . . . no
C(14) C(17) H(28) 109.5(7) . . . no
H(26) C(17) H(27) 109.5 . . . no
H(26) C(17) H(28) 109.5 . . . no
H(27) C(17) H(28) 109.5 . . . no
C(19) C(18) C(23) 118.0(8) . . . no
C(19) C(18) B(4) 119.1(8) . . . no
C(23) C(18) B(4) 122.5(7) . . . no
C(18) C(19) C(20) 121(1) . . . no
C(18) C(19) C(24) 119.6(9) . . . no
C(20) C(19) C(24) 119(1) . . . no
C(19) C(20) C(21) 120(1) . . . no
C(19) C(20) H(35) 119.8 . . . no
C(21) C(20) H(35) 119.8 . . . no
C(20) C(21) C(22) 120(1) . . . no
C(20) C(21) H(36) 119.8 . . . no
C(22) C(21) H(36) 119.9 . . . no
C(21) C(22) C(23) 120(1) . . . no
C(21) C(22) H(37) 119.9 . . . no
C(23) C(22) H(37) 120.0 . . . no
C(18) C(23) C(22) 119.7(8) . . . no
C(18) C(23) C(25) 119.9(8) . . . no
C(22) C(23) C(25) 120.4(9) . . . no
C(19) C(24) H(29) 109.5 . . . no
C(19) C(24) H(30) 109.5 . . . no
C(19) C(24) H(31) 109.5 . . . no
H(29) C(24) H(30) 109.5 . . . no
H(29) C(24) H(31) 109.5 . . . no
H(30) C(24) H(31) 109.5 . . . no
C(23) C(25) H(32) 109.5 . . . no
C(23) C(25) H(33) 109.5 . . . no
C(23) C(25) H(34) 109.5 . . . no
H(32) C(25) H(33) 109.5 . . . no
H(32) C(25) H(34) 109.5 . . . no
H(33) C(25) H(34) 109.5 . . . no
O(1) B(1) O(2) 111.9(8) . . . yes
O(1) B(1) O(3) 107.5(6) . . . yes
O(1) B(1) O(3) 107.5(6) . . . yes
O(2) B(1) O(3) 109.3(6) . . . yes
O(2) B(1) O(3) 109.3(6) . . . yes
O(3) B(1) O(3) 111.4(8) . . . yes
O(1) B(2) O(4) 121(1) . . . no
O(1) B(2) C(8) 119.4(9) . . . no
O(4) B(2) C(8) 119.2(9) . . . no
O(2) B(3) O(4) 120.4(8) . . . no
O(2) B(3) C(13) 120.4(9) . . . no
O(4) B(3) C(13) 119.2(8) . . . no
O(3) B(4) O(5) 120.1(7) . . . no
O(3) B(4) C(18) 122.5(7) . . . no
O(5) B(4) C(18) 117.4(6) . . . no
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Rh(1) P(1) 2.289(2) . . no
Rh(1) P(1) 2.289(2) . . no
Rh(1) P(2) 2.283(3) . . no
Rh(1) P(3) 2.292(3) . . no
P(1) C(1) 1.786(7) . . no
P(1) C(2) 1.807(9) . . no
P(1) C(3) 1.808(8) . . no
P(2) C(4) 1.76(1) . . no
P(2) C(5) 1.826(8) . . no
P(2) C(5) 1.826(8) . . no
P(3) C(6) 1.74(1) . . no
P(3) C(7) 1.790(8) . . no
P(3) C(7) 1.790(8) . . no
O(1) B(1) 1.47(1) . . yes
O(1) B(2) 1.34(1) . . yes
O(2) B(1) 1.46(1) . . yes
O(2) B(3) 1.33(1) . . yes
O(3) B(1) 1.474(7) . . yes
O(3) B(4) 1.348(7) . . yes
O(4) B(2) 1.36(1) . . yes
O(4) B(3) 1.39(1) . . yes
O(5) B(4) 1.363(8) . . yes
O(5) B(4) 1.363(8) . . yes
C(1) H(1) 0.95 . . no
C(1) H(2) 0.95 . . no
C(1) H(3) 0.95 . . no
C(2) H(4) 0.95 . . no
C(2) H(5) 0.95 . . no
C(2) H(6) 0.95 . . no
C(3) H(7) 0.95 . . no
C(3) H(8) 0.95 . . no
C(3) H(9) 0.95 . . no
C(4) H(10) 0.95 . . no
C(4) H(11) 0.95 . . no
C(4) H(11) 0.95 . . no
C(4) H(12) 0.95 . . no
C(4) H(12) 0.95 . . no
C(5) H(13) 0.95 . . no
C(5) H(14) 0.95 . . no
C(5) H(15) 0.95 . . no
C(6) H(16) 0.95 . . no
C(6) H(17) 0.95 . . no
C(6) H(17) 0.95 . . no
C(6) H(18) 0.95 . . no
C(6) H(18) 0.95 . . no
C(7) H(19) 0.95 . . no
C(7) H(20) 0.95 . . no
C(7) H(21) 0.95 . . no
C(8) C(9) 1.388(8) . . no
C(8) C(9) 1.388(8) . . no
C(8) B(2) 1.58(1) . . no
C(9) C(10) 1.386(9) . . no
C(9) C(12) 1.48(1) . . no
C(10) C(11) 1.35(1) . . no
C(10) H(22) 0.95 . . no
C(11) H(40) 0.99 . . no
C(12) H(23) 0.950(8) . . no
C(12) H(24) 0.95 . . no
C(12) H(25) 0.95 . . no
C(13) C(14) 1.387(7) . . no
C(13) C(14) 1.387(7) . . no
C(13) B(3) 1.56(1) . . no
C(14) C(15) 1.380(8) . . no
C(14) C(17) 1.504(9) . . no
C(15) C(16) 1.355(8) . . no
C(15) H(38) 0.95 . . no
C(16) H(39) 1.06 . . no
C(17) H(26) 0.95 . . no
C(17) H(27) 0.95 . . no
C(17) H(28) 0.950(7) . . no
C(18) C(19) 1.389(9) . . no
C(18) C(23) 1.372(9) . . no
C(18) B(4) 1.565(9) . . no
C(19) C(20) 1.36(1) . . no
C(19) C(24) 1.49(1) . . no
C(20) C(21) 1.34(1) . . no
C(20) H(35) 0.95 . . no
C(21) C(22) 1.36(1) . . no
C(21) H(36) 0.95 . . no
C(22) C(23) 1.40(1) . . no
C(22) H(37) 0.95 . . no
C(23) C(25) 1.50(1) . . no
C(24) H(29) 0.95 . . no
C(24) H(30) 0.95 . . no
C(24) H(31) 0.95 . . no
C(25) H(32) 0.95 . . no
C(25) H(33) 0.95 . . no
C(25) H(34) 0.95 . . no
