data_rudi006
_audit_creation_date               2026-04-30
_audit_creation_method
;
Olex2 1.5
(compiled 2026.04.10 svn.r48fbca5a for OlexSys, GUI svn.r7537)
;
_shelx_SHELXL_version_number       '2019/3'
_audit_contact_author_address      ?
_audit_contact_author_email        ?
_audit_contact_author_name         ''
_audit_contact_author_phone        ?
_publ_contact_author_id_orcid      ?
_publ_section_references
;
Dolomanov, O.V., Bourhis, L.J., Gildea, R.J, Howard, J.A.K. & Puschmann, H.
 (2009), J. Appl. Cryst. 42, 339-341.

Sheldrick, G.M. (2008). Acta Cryst. A64, 112-122.

Sheldrick, G.M. (2015). Acta Cryst. A71, 3-8.
;
_chemical_name_common              ?
_chemical_name_systematic          ?
_chemical_formula_moiety           '1(C9 H23 In N3), C H B11 Cl11'
_chemical_formula_sum              'C10 H24 B11 Cl11 In N3'
_chemical_formula_weight           810.00
_chemical_melting_point            ?
loop_
  _atom_type_symbol
  _atom_type_description
  _atom_type_scat_dispersion_real
  _atom_type_scat_dispersion_imag
  _atom_type_scat_source
 'C' 'C' 0.0181 0.0091 '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' 0.0090 0.0039 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 'Cl' 'Cl' 0.3639 0.7018 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 'In' 'In' 0.0822 5.0449 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
 'N' 'N' 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_space_group_crystal_system        'triclinic'
_space_group_IT_number             2
_space_group_name_H-M_alt          'P -1'
_space_group_name_Hall             '-P 1'
loop_
  _space_group_symop_operation_xyz
 'x, y, z'
 '-x, -y, -z'

_cell_length_a                     15.4516(5)
_cell_length_b                     15.9289(5)
_cell_length_c                     16.4252(6)
_cell_angle_alpha                  105.9970(10)
_cell_angle_beta                   114.8970(10)
_cell_angle_gamma                  105.7150(10)
_cell_volume                       3159.02(19)
_cell_formula_units_Z              4
_cell_measurement_reflns_used      9719
_cell_measurement_temperature      100.00
_cell_measurement_theta_max        74.480
_cell_measurement_theta_min        3.220
_shelx_estimated_absorpt_T_max     0.248
_shelx_estimated_absorpt_T_min     0.130
_exptl_absorpt_coefficient_mu      14.629
_exptl_absorpt_correction_T_max    0.7538
_exptl_absorpt_correction_T_min    0.3225
_exptl_absorpt_correction_type     multi-scan
_exptl_absorpt_process_details
;
SADABS-2016/2 (Bruker,2016/2) was used for absorption correction.
wR2(int) was 0.1564 before and 0.0822 after correction.
The Ratio of minimum to maximum transmission is 0.4278.
The λ/2 correction factor is Not present.
;
_exptl_absorpt_special_details     ?
_exptl_crystal_colour              colourless
_exptl_crystal_colour_primary      colourless
_exptl_crystal_density_diffrn      1.703
_exptl_crystal_density_meas        ?
_exptl_crystal_density_method      ?
_exptl_crystal_description         block
_exptl_crystal_F_000               1584
_exptl_crystal_size_max            0.236
_exptl_crystal_size_mid            0.186
_exptl_crystal_size_min            0.132
_exptl_transmission_factor_max     ?
_exptl_transmission_factor_min     ?
_diffrn_reflns_av_R_equivalents    0.0505
_diffrn_reflns_av_unetI/netI       0.0263
_diffrn_reflns_Laue_measured_fraction_full  0.996
_diffrn_reflns_Laue_measured_fraction_max  0.981
_diffrn_reflns_limit_h_max         19
_diffrn_reflns_limit_h_min         -19
_diffrn_reflns_limit_k_max         19
_diffrn_reflns_limit_k_min         -19
_diffrn_reflns_limit_l_max         20
_diffrn_reflns_limit_l_min         -20
_diffrn_reflns_number              109898
_diffrn_reflns_point_group_measured_fraction_full  0.996
_diffrn_reflns_point_group_measured_fraction_max  0.981
_diffrn_reflns_theta_full          67.679
_diffrn_reflns_theta_max           74.473
_diffrn_reflns_theta_min           3.220
_diffrn_ambient_temperature        100.00
_diffrn_detector_area_resol_mean   ?
_diffrn_measured_fraction_theta_full  0.996
_diffrn_measured_fraction_theta_max  0.981
_diffrn_measurement_device_type    'Bruker Venture Photon III'
_diffrn_measurement_method         ?
_diffrn_radiation_type             CuK\a
_diffrn_radiation_wavelength       1.54178
_diffrn_source                     ?
_diffrn_source_current             1.2
_diffrn_source_power               0.06
_diffrn_source_voltage             50.0
_reflns_Friedel_coverage           0.000
_reflns_Friedel_fraction_full      .
_reflns_Friedel_fraction_max       .
_reflns_number_gt                  12030
_reflns_number_total               12696
_reflns_special_details
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;
_reflns_threshold_expression       'I > 2σ(I)'
_computing_cell_refinement         'SAINT V8.42 (?, 2016)'
_computing_data_collection         ?
_computing_data_reduction          'SAINT V8.42 (?, 2016)'
_computing_molecular_graphics      'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_publication_material    'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_structure_refinement    'XL  (Sheldrick, 2008)'
_computing_structure_solution      'SHELXT 2018/2 (Sheldrick, 2018)'
_refine_diff_density_max           1.211
_refine_diff_density_min           -2.011
_refine_diff_density_rms           0.127
_refine_ls_extinction_coef         .
_refine_ls_extinction_method       none
_refine_ls_goodness_of_fit_ref     1.047
_refine_ls_hydrogen_treatment      mixed
_refine_ls_matrix_type             full
_refine_ls_number_parameters       752
_refine_ls_number_reflns           12696
_refine_ls_number_restraints       477
_refine_ls_R_factor_all            0.0388
_refine_ls_R_factor_gt             0.0365
_refine_ls_restrained_S_all        1.034
_refine_ls_shift/su_max            0.003
_refine_ls_shift/su_mean           0.000
_refine_ls_structure_factor_coef   Fsqd
_refine_ls_weighting_details      
 'w=1/[σ²(Fo²)+(0.0608P)²+5.0646P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme        calc
_refine_ls_wR_factor_gt            0.0959
_refine_ls_wR_factor_ref           0.0974
_refine_special_details            ?
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2. Restrained distances
 C19-H19 \\sim C20-H20
 with sigma of 0.002
 N1-C5 \\sim N1-C5A \\sim N1-C6 \\sim N1-C6A \\sim N3-C9A \\sim N3-C9 \\sim
N3-C8A \\sim N3-C8
 with sigma of 0.002
 N2-C7A \\sim N2-C7
 with sigma of 0.002
 N1-C1A \\sim N1-C1 \\sim N3-C4A \\sim N3-C4
 with sigma of 0.002
 C4-C3 \\sim C4A-C3A \\sim C2-C1 \\sim C2A-C1A
 with sigma of 0.002
 N2-C2 \\sim N2-C2A \\sim N2-C3A \\sim N2-C3
 with sigma of 0.002
3. Uiso/Uaniso restraints and constraints
In1 \\sim N1 \\sim N2 \\sim N3 \\sim C1 \\sim C2 \\sim C3 \\sim C4 \\sim C5
\\sim C6 \\sim C7 \\sim C8 \\sim C9 \\sim C1A \\sim C2A \\sim C3A \\sim C4A
\\sim C5A \\sim C6A \\sim C7A \\sim C8A \\sim C9A: within 2A with sigma of
0.002 and sigma for terminal atoms of 0.004 within 2A
4. Rigid body (RIGU) restrains
 In1, N1, N2, N3, C1, C2, C3, C4, C5, C6, C7, C8, C9, C1A, C2A, C3A, C4A, C5A,
 C6A, C7A, C8A, C9A
 with sigma for 1-2 distances of 0.004 and sigma for 1-3 distances of 0.004
5. Others
 Sof(C1A)=Sof(H1AA)=Sof(H1AB)=Sof(C2A)=Sof(H2AA)=Sof(H2AB)=Sof(C3A)=Sof(H3AA)=
 Sof(H3AB)=Sof(C4A)=Sof(H4AA)=Sof(H4AB)=Sof(C5A)=Sof(H5AA)=Sof(H5AB)=Sof(H5AC)=
 Sof(C6A)=Sof(H6AA)=Sof(H6AB)=Sof(H6AC)=Sof(C7A)=Sof(H7AA)=Sof(H7AB)=Sof(H7AC)=
 Sof(C8A)=Sof(H8AA)=Sof(H8AB)=Sof(H8AC)=Sof(C9A)=Sof(H9AA)=Sof(H9AB)=Sof(H9AC)=
 1-FVAR(1)
 Sof(C1)=Sof(H1A)=Sof(H1B)=Sof(C2)=Sof(H2A)=Sof(H2B)=Sof(C3)=Sof(H3A)=Sof(H3B)=
 Sof(C4)=Sof(H4A)=Sof(H4B)=Sof(C5)=Sof(H5A)=Sof(H5B)=Sof(H5C)=Sof(C6)=Sof(H6A)=
 Sof(H6B)=Sof(H6C)=Sof(C7)=Sof(H7A)=Sof(H7B)=Sof(H7C)=Sof(C8)=Sof(H8A)=Sof(H8B)=
 Sof(H8C)=Sof(C9)=Sof(H9A)=Sof(H9B)=Sof(H9C)=FVAR(1)
6.a Secondary CH2 refined with riding coordinates:
 C1(H1A,H1B), C2(H2A,H2B), C3(H3A,H3B), C4(H4A,H4B), C1A(H1AA,H1AB), C2A(H2AA,
 H2AB), C3A(H3AA,H3AB), C4A(H4AA,H4AB), C10(H10A,H10B), C11(H11A,H11B),
 C12(H12A,H12B), C13(H13A,H13B)
6.b Idealised Me refined as rotating group:
 C5(H5A,H5B,H5C), C6(H6A,H6B,H6C), C7(H7A,H7B,H7C), C8(H8A,H8B,H8C), C9(H9A,
 H9B,H9C), C5A(H5AA,H5AB,H5AC), C6A(H6AA,H6AB,H6AC), C7A(H7AA,H7AB,H7AC),
 C8A(H8AA,H8AB,H8AC), C9A(H9AA,H9AB,H9AC), C14(H14A,H14B,H14C), C15(H15A,H15B,
 H15C), C16(H16A,H16B,H16C), C17(H17A,H17B,H17C), C18(H18A,H18B,H18C)
;
_atom_sites_solution_hydrogens     mixed
_atom_sites_solution_primary       dual
_atom_sites_solution_secondary     ?
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_site_symmetry_order
  _atom_site_calc_flag
  _atom_site_refinement_flags_posn
  _atom_site_refinement_flags_adp
  _atom_site_refinement_flags_occupancy
  _atom_site_disorder_assembly
  _atom_site_disorder_group
 In1 In 0.15508(2) 0.53237(2) 0.70193(2) 0.02009(7) Uani 1 1 d . . . . .
 N1 N 0.3246(2) 0.66109(18) 0.86097(19) 0.0225(5) Uani 1 1 d D U . . .
 N2 N 0.26998(19) 0.45191(16) 0.75548(15) 0.0159(4) Uani 1 1 d D U . . .
 N3 N 0.22014(19) 0.50039(16) 0.58580(18) 0.0220(5) Uani 1 1 d D U . . .
 C1 C 0.3627(3) 0.6054(3) 0.9130(3) 0.0181(6) Uani 0.782(3) 1 d D U P A 1
 H1A H 0.311817 0.575040 0.929813 0.022 Uiso 0.782(3) 1 calc R U P A 1
 H1B H 0.432388 0.649759 0.976364 0.022 Uiso 0.782(3) 1 calc R U P A 1
 C2 C 0.3744(3) 0.5267(2) 0.8472(3) 0.0175(6) Uani 0.782(3) 1 d D U P A 1
 H2A H 0.422120 0.557091 0.827371 0.021 Uiso 0.782(3) 1 calc R U P A 1
 H2B H 0.407761 0.494658 0.886214 0.021 Uiso 0.782(3) 1 calc R U P A 1
 C3 C 0.2839(4) 0.4061(3) 0.6727(3) 0.0186(6) Uani 0.782(3) 1 d D U P A 1
 H3A H 0.218778 0.344897 0.620504 0.022 Uiso 0.782(3) 1 calc R U P A 1
 H3B H 0.343901 0.389208 0.699161 0.022 Uiso 0.782(3) 1 calc R U P A 1
 C4 C 0.3058(3) 0.4722(3) 0.6253(3) 0.0200(6) Uani 0.782(3) 1 d D U P A 1
 H4A H 0.373651 0.531493 0.676120 0.024 Uiso 0.782(3) 1 calc R U P A 1
 H4B H 0.313316 0.438055 0.570247 0.024 Uiso 0.782(3) 1 calc R U P A 1
 C5 C 0.4016(5) 0.7263(3) 0.8483(5) 0.0239(12) Uani 0.782(3) 1 d D U P A 1
 H5A H 0.419977 0.687332 0.806558 0.036 Uiso 0.782(3) 1 calc R U P A 1
 H5B H 0.466123 0.772375 0.914099 0.036 Uiso 0.782(3) 1 calc R U P A 1
 H5C H 0.369588 0.762366 0.815725 0.036 Uiso 0.782(3) 1 calc R U P A 1
 C6 C 0.2909(4) 0.7210(3) 0.9167(3) 0.0234(9) Uani 0.782(3) 1 d D U P A 1
 H6A H 0.264789 0.758559 0.882569 0.035 Uiso 0.782(3) 1 calc R U P A 1
 H6B H 0.351776 0.765754 0.985126 0.035 Uiso 0.782(3) 1 calc R U P A 1
 H6C H 0.234027 0.678258 0.919237 0.035 Uiso 0.782(3) 1 calc R U P A 1
 C7 C 0.2198(4) 0.3759(3) 0.7779(4) 0.0204(9) Uani 0.782(3) 1 d D U P A 1
 H7A H 0.213468 0.406222 0.834467 0.031 Uiso 0.782(3) 1 calc R U P A 1
 H7B H 0.263689 0.341754 0.795183 0.031 Uiso 0.782(3) 1 calc R U P A 1
 H7C H 0.148793 0.329322 0.718883 0.031 Uiso 0.782(3) 1 calc R U P A 1
 C8 C 0.1216(3) 0.4191(3) 0.4934(3) 0.0251(8) Uani 0.782(3) 1 d D U P A 1
 H8A H 0.137077 0.395966 0.441716 0.038 Uiso 0.782(3) 1 calc R U P A 1
 H8B H 0.067311 0.442093 0.469172 0.038 Uiso 0.782(3) 1 calc R U P A 1
 H8C H 0.095240 0.365691 0.508247 0.038 Uiso 0.782(3) 1 calc R U P A 1
 C9 C 0.2514(4) 0.5828(3) 0.5625(3) 0.0283(9) Uani 0.782(3) 1 d D U P A 1
 H9A H 0.316454 0.637743 0.622367 0.042 Uiso 0.782(3) 1 calc R U P A 1
 H9B H 0.194069 0.602694 0.541137 0.042 Uiso 0.782(3) 1 calc R U P A 1
 H9C H 0.264444 0.562491 0.508413 0.042 Uiso 0.782(3) 1 calc R U P A 1
 C1A C 0.3959(7) 0.6160(8) 0.8921(11) 0.0215(11) Uani 0.218(3) 1 d D U P A 2
 H1AA H 0.444952 0.652617 0.965895 0.026 Uiso 0.218(3) 1 calc R U P A 2
 H1AB H 0.439684 0.625153 0.862486 0.026 Uiso 0.218(3) 1 calc R U P A 2
 C2A C 0.3463(10) 0.5085(7) 0.8659(3) 0.0185(11) Uani 0.218(3) 1 d D U P A 2
 H2AA H 0.402585 0.486395 0.887552 0.022 Uiso 0.218(3) 1 calc R U P A 2
 H2AB H 0.308711 0.497884 0.900940 0.022 Uiso 0.218(3) 1 calc R U P A 2
 C3A C 0.3208(9) 0.4323(12) 0.6976(8) 0.0185(10) Uani 0.218(3) 1 d D U P A 2
 H3AA H 0.327951 0.371386 0.692177 0.022 Uiso 0.218(3) 1 calc R U P A 2
 H3AB H 0.392726 0.486397 0.732365 0.022 Uiso 0.218(3) 1 calc R U P A 2
 C4A C 0.2515(12) 0.4227(7) 0.5937(9) 0.0204(10) Uani 0.218(3) 1 d D U P A 2
 H4AA H 0.289527 0.416134 0.558420 0.024 Uiso 0.218(3) 1 calc R U P A 2
 H4AB H 0.185582 0.360923 0.556686 0.024 Uiso 0.218(3) 1 calc R U P A 2
 C5A C 0.4020(18) 0.7451(11) 0.8666(18) 0.019(2) Uani 0.218(3) 1 d D U P A 2
 H5AA H 0.435881 0.721830 0.832641 0.028 Uiso 0.218(3) 1 calc R U P A 2
 H5AB H 0.456468 0.790669 0.937080 0.028 Uiso 0.218(3) 1 calc R U P A 2
 H5AC H 0.364758 0.778283 0.833909 0.028 Uiso 0.218(3) 1 calc R U P A 2
 C6A C 0.3043(14) 0.6990(12) 0.9409(10) 0.0256(19) Uani 0.218(3) 1 d D U P A 2
 H6AA H 0.259719 0.732198 0.921952 0.038 Uiso 0.218(3) 1 calc R U P A 2
 H6AB H 0.372207 0.745059 1.003955 0.038 Uiso 0.218(3) 1 calc R U P A 2
 H6AC H 0.267732 0.644701 0.949679 0.038 Uiso 0.218(3) 1 calc R U P A 2
 C7A C 0.1957(12) 0.3582(7) 0.7379(13) 0.016(2) Uani 0.218(3) 1 d D U P A 2
 H7AA H 0.157084 0.370420 0.770637 0.025 Uiso 0.218(3) 1 calc R U P A 2
 H7AB H 0.235951 0.324486 0.765654 0.025 Uiso 0.218(3) 1 calc R U P A 2
 H7AC H 0.144959 0.317613 0.665614 0.025 Uiso 0.218(3) 1 calc R U P A 2
 C8A C 0.1342(10) 0.4680(13) 0.4812(5) 0.0276(19) Uani 0.218(3) 1 d D U P A 2
 H8AA H 0.152459 0.436351 0.434829 0.041 Uiso 0.218(3) 1 calc R U P A 2
 H8AB H 0.126319 0.524539 0.472730 0.041 Uiso 0.218(3) 1 calc R U P A 2
 H8AC H 0.067165 0.421698 0.467072 0.041 Uiso 0.218(3) 1 calc R U P A 2
 C9A C 0.3195(7) 0.5692(9) 0.6024(11) 0.0245(18) Uani 0.218(3) 1 d D U P A 2
 H9AA H 0.381172 0.573832 0.659262 0.037 Uiso 0.218(3) 1 calc R U P A 2
 H9AB H 0.320875 0.633699 0.616991 0.037 Uiso 0.218(3) 1 calc R U P A 2
 H9AC H 0.321979 0.545632 0.542091 0.037 Uiso 0.218(3) 1 calc R U P A 2
 In2 In 0.65645(2) 1.01037(2) 0.71072(2) 0.01636(6) Uani 1 1 d . . . . .
 N4 N 0.58949(19) 0.83595(19) 0.58857(19) 0.0179(5) Uani 1 1 d . . . . .
 N5 N 0.81350(19) 0.97665(18) 0.74971(18) 0.0146(5) Uani 1 1 d . . . . .
 N6 N 0.71539(19) 0.99233(18) 0.87168(18) 0.0157(5) Uani 1 1 d . . . . .
 C10 C 0.6825(2) 0.8347(2) 0.5839(2) 0.0192(6) Uani 1 1 d . . . . .
 H10A H 0.698441 0.874844 0.550963 0.023 Uiso 1 1 calc R U . . .
 H10B H 0.665127 0.767068 0.542590 0.023 Uiso 1 1 calc R U . . .
 C11 C 0.7802(2) 0.8734(2) 0.6872(2) 0.0179(6) Uani 1 1 d . . . . .
 H11A H 0.764322 0.833768 0.720583 0.021 Uiso 1 1 calc R U . . .
 H11B H 0.839249 0.867482 0.680400 0.021 Uiso 1 1 calc R U . . .
 C12 C 0.8720(2) 1.0030(2) 0.8581(2) 0.0181(6) Uani 1 1 d . . . . .
 H12A H 0.907575 1.074893 0.896901 0.022 Uiso 1 1 calc R U . . .
 H12B H 0.927816 0.980127 0.873788 0.022 Uiso 1 1 calc R U . . .
 C13 C 0.7998(2) 0.9595(2) 0.8907(2) 0.0169(6) Uani 1 1 d . . . . .
 H13A H 0.766383 0.887517 0.854040 0.020 Uiso 1 1 calc R U . . .
 H13B H 0.843016 0.978201 0.963212 0.020 Uiso 1 1 calc R U . . .
 C14 C 0.5071(3) 0.8266(3) 0.4929(2) 0.0266(7) Uani 1 1 d . . . . .
 H14A H 0.447345 0.830798 0.498033 0.040 Uiso 1 1 calc R U . . .
 H14B H 0.481774 0.763635 0.438243 0.040 Uiso 1 1 calc R U . . .
 H14C H 0.537741 0.879325 0.479028 0.040 Uiso 1 1 calc R U . . .
 C15 C 0.5430(3) 0.7556(2) 0.6079(2) 0.0230(7) Uani 1 1 d . . . . .
 H15A H 0.596857 0.761630 0.671401 0.035 Uiso 1 1 calc R U . . .
 H15B H 0.519018 0.693135 0.553221 0.035 Uiso 1 1 calc R U . . .
 H15C H 0.482298 0.758537 0.611823 0.035 Uiso 1 1 calc R U . . .
 C16 C 0.8815(3) 1.0411(3) 0.7289(2) 0.0230(7) Uani 1 1 d . . . . .
 H16A H 0.844319 1.021802 0.656676 0.034 Uiso 1 1 calc R U . . .
 H16B H 0.948336 1.035380 0.751014 0.034 Uiso 1 1 calc R U . . .
 H16C H 0.896800 1.108693 0.765065 0.034 Uiso 1 1 calc R U . . .
 C17 C 0.7590(3) 1.0929(2) 0.9490(2) 0.0202(6) Uani 1 1 d . . . . .
 H17A H 0.815537 1.137350 0.947476 0.030 Uiso 1 1 calc R U . . .
 H17B H 0.788062 1.094206 1.015410 0.030 Uiso 1 1 calc R U . . .
 H17C H 0.702018 1.113349 0.935253 0.030 Uiso 1 1 calc R U . . .
 C18 C 0.6300(3) 0.9271(2) 0.8746(2) 0.0219(6) Uani 1 1 d . . . . .
 H18A H 0.576890 0.951858 0.866766 0.033 Uiso 1 1 calc R U . . .
 H18B H 0.660077 0.924274 0.938958 0.033 Uiso 1 1 calc R U . . .
 H18C H 0.596103 0.861620 0.819865 0.033 Uiso 1 1 calc R U . . .
 Cl1 Cl 0.08123(5) 1.11314(5) 0.67177(5) 0.01578(14) Uani 1 1 d . . . . .
 Cl2 Cl -0.05277(5) 0.85491(5) 0.55560(5) 0.01904(14) Uani 1 1 d . . . . .
 Cl3 Cl 0.08754(6) 0.76227(5) 0.45599(6) 0.02563(17) Uani 1 1 d . . . . .
 Cl4 Cl 0.30701(6) 0.96243(6) 0.51118(6) 0.02437(16) Uani 1 1 d . . . . .
 Cl5 Cl 0.30507(6) 1.18281(5) 0.64414(6) 0.02006(15) Uani 1 1 d . . . . .
 Cl6 Cl 0.12463(6) 0.98498(6) 0.83314(5) 0.02191(15) Uani 1 1 d . . . . .
 Cl7 Cl 0.12977(6) 0.76268(5) 0.69691(6) 0.02484(16) Uani 1 1 d . . . . .
 Cl8 Cl 0.35871(6) 0.83676(5) 0.66623(6) 0.02137(15) Uani 1 1 d . . . . .
 Cl9 Cl 0.49461(5) 1.10376(5) 0.78781(6) 0.01972(15) Uani 1 1 d . . . . .
 Cl10 Cl 0.34856(6) 1.19574(5) 0.88915(5) 0.02095(15) Uani 1 1 d . . . . .
 Cl11 Cl 0.38184(6) 0.97668(5) 0.90041(5) 0.01962(15) Uani 1 1 d . . . . .
 C19 C 0.1506(2) 0.9758(2) 0.5750(2) 0.0141(5) Uani 1 1 d D . . . .
 H19 H 0.105(2) 0.978(2) 0.5085(19) 0.017 Uiso 1 1 d D U . . .
 B1 B 0.1548(2) 1.0447(2) 0.6788(2) 0.0129(6) Uani 1 1 d . . . . .
 B2 B 0.0879(2) 0.9143(2) 0.6202(2) 0.0122(6) Uani 1 1 d . . . . .
 B3 B 0.1575(3) 0.8688(2) 0.5706(3) 0.0160(6) Uani 1 1 d . . . . .
 B4 B 0.2681(3) 0.9714(2) 0.5986(2) 0.0148(6) Uani 1 1 d . . . . .
 B5 B 0.2662(3) 1.0800(2) 0.6649(2) 0.0141(6) Uani 1 1 d . . . . .
 B6 B 0.1746(3) 0.9804(2) 0.7530(2) 0.0134(6) Uani 1 1 d . . . . .
 B7 B 0.1768(3) 0.8717(2) 0.6863(2) 0.0142(6) Uani 1 1 d . . . . .
 B8 B 0.2882(3) 0.9069(2) 0.6720(2) 0.0134(6) Uani 1 1 d . . . . .
 B9 B 0.3551(2) 1.0381(2) 0.7308(2) 0.0126(6) Uani 1 1 d . . . . .
 B10 B 0.2849(3) 1.0835(2) 0.7806(2) 0.0130(6) Uani 1 1 d . . . . .
 B11 B 0.2991(3) 0.9764(2) 0.7855(2) 0.0133(6) Uani 1 1 d . . . . .
 Cl12 Cl 0.75185(6) 0.38138(6) 0.64825(6) 0.02861(17) Uani 1 1 d . . . . .
 Cl13 Cl 0.98192(6) 0.60791(6) 0.79001(6) 0.02365(16) Uani 1 1 d . . . . .
 Cl14 Cl 1.06175(5) 0.68728(5) 1.04810(5) 0.01939(15) Uani 1 1 d . . . . .
 Cl15 Cl 0.87995(6) 0.51225(6) 1.06204(6) 0.02127(15) Uani 1 1 d . . . . .
 Cl16 Cl 0.68227(6) 0.32125(5) 0.81341(6) 0.02650(17) Uani 1 1 d . . . . .
 Cl17 Cl 0.71779(6) 0.60665(6) 0.64703(5) 0.02323(16) Uani 1 1 d . . . . .
 Cl18 Cl 0.91998(6) 0.80081(5) 0.90013(6) 0.02135(15) Uani 1 1 d . . . . .
 Cl19 Cl 0.85335(6) 0.74076(6) 1.07523(5) 0.02355(16) Uani 1 1 d . . . . .
 Cl20 Cl 0.61144(6) 0.50707(6) 0.92602(6) 0.02633(17) Uani 1 1 d . . . . .
 Cl21 Cl 0.52877(6) 0.42583(6) 0.66273(6) 0.02412(16) Uani 1 1 d . . . . .
 Cl22 Cl 0.63848(6) 0.68394(5) 0.82597(6) 0.02082(15) Uani 1 1 d . . . . .
 C20 C 0.8651(2) 0.5060(2) 0.8702(2) 0.0145(6) Uani 1 1 d D . . . .
 H20 H 0.911(2) 0.468(2) 0.879(2) 0.017 Uiso 1 1 d D U . . .
 B12 B 0.7680(3) 0.4736(2) 0.7500(3) 0.0163(6) Uani 1 1 d . . . . .
 B13 B 0.8853(3) 0.5875(2) 0.8222(3) 0.0149(6) Uani 1 1 d . . . . .
 B14 B 0.9254(3) 0.6274(2) 0.9511(2) 0.0142(6) Uani 1 1 d . . . . .
 B15 B 0.8328(3) 0.5392(2) 0.9583(3) 0.0151(6) Uani 1 1 d . . . . .
 B16 B 0.7353(3) 0.4433(2) 0.8342(3) 0.0168(7) Uani 1 1 d . . . . .
 B17 B 0.7577(3) 0.5835(3) 0.7540(2) 0.0154(6) Uani 1 1 d . . . . .
 B18 B 0.8560(3) 0.6789(2) 0.8785(3) 0.0147(6) Uani 1 1 d . . . . .
 B19 B 0.8238(3) 0.6497(2) 0.9639(2) 0.0148(6) Uani 1 1 d . . . . .
 B20 B 0.7058(3) 0.5350(3) 0.8910(3) 0.0158(6) Uani 1 1 d . . . . .
 B21 B 0.6654(3) 0.4944(2) 0.7615(3) 0.0155(6) Uani 1 1 d . . . . .
 B22 B 0.7197(3) 0.6214(2) 0.8416(2) 0.0141(6) Uani 1 1 d . . . . .


_geom_special_details
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
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
 In1 N1 2.503(3) . ?
 In1 N2 2.471(2) . ?
 In1 N3 2.503(3) . ?
 N1 C1 1.463(3) . ?
 N1 C5 1.482(3) . ?
 N1 C6 1.486(3) . ?
 N1 C1A 1.465(3) . ?
 N1 C5A 1.483(3) . ?
 N1 C6A 1.483(3) . ?
 N2 C2 1.489(3) . ?
 N2 C3 1.488(3) . ?
 N2 C7 1.476(4) . ?
 N2 C2A 1.488(3) . ?
 N2 C3A 1.488(3) . ?
 N2 C7A 1.477(5) . ?
 N3 C4 1.460(3) . ?
 N3 C8 1.484(3) . ?
 N3 C9 1.481(3) . ?
 N3 C4A 1.464(3) . ?
 N3 C8A 1.483(3) . ?
 N3 C9A 1.484(3) . ?
 C1 H1A 0.9900 . ?
 C1 H1B 0.9900 . ?
 C1 C2 1.521(4) . ?
 C2 H2A 0.9900 . ?
 C2 H2B 0.9900 . ?
 C3 H3A 0.9900 . ?
 C3 H3B 0.9900 . ?
 C3 C4 1.520(4) . ?
 C4 H4A 0.9900 . ?
 C4 H4B 0.9900 . ?
 C5 H5A 0.9800 . ?
 C5 H5B 0.9800 . ?
 C5 H5C 0.9800 . ?
 C6 H6A 0.9800 . ?
 C6 H6B 0.9800 . ?
 C6 H6C 0.9800 . ?
 C7 H7A 0.9800 . ?
 C7 H7B 0.9800 . ?
 C7 H7C 0.9800 . ?
 C8 H8A 0.9800 . ?
 C8 H8B 0.9800 . ?
 C8 H8C 0.9800 . ?
 C9 H9A 0.9800 . ?
 C9 H9B 0.9800 . ?
 C9 H9C 0.9800 . ?
 C1A H1AA 0.9900 . ?
 C1A H1AB 0.9900 . ?
 C1A C2A 1.520(4) . ?
 C2A H2AA 0.9900 . ?
 C2A H2AB 0.9900 . ?
 C3A H3AA 0.9900 . ?
 C3A H3AB 0.9900 . ?
 C3A C4A 1.521(4) . ?
 C4A H4AA 0.9900 . ?
 C4A H4AB 0.9900 . ?
 C5A H5AA 0.9800 . ?
 C5A H5AB 0.9800 . ?
 C5A H5AC 0.9800 . ?
 C6A H6AA 0.9800 . ?
 C6A H6AB 0.9800 . ?
 C6A H6AC 0.9800 . ?
 C7A H7AA 0.9800 . ?
 C7A H7AB 0.9800 . ?
 C7A H7AC 0.9800 . ?
 C8A H8AA 0.9800 . ?
 C8A H8AB 0.9800 . ?
 C8A H8AC 0.9800 . ?
 C9A H9AA 0.9800 . ?
 C9A H9AB 0.9800 . ?
 C9A H9AC 0.9800 . ?
 In2 N4 2.537(3) . ?
 In2 N5 2.485(2) . ?
 In2 N6 2.537(2) . ?
 N4 C10 1.476(4) . ?
 N4 C14 1.483(4) . ?
 N4 C15 1.474(4) . ?
 N5 C11 1.480(4) . ?
 N5 C12 1.481(4) . ?
 N5 C16 1.478(4) . ?
 N6 C13 1.479(3) . ?
 N6 C17 1.485(4) . ?
 N6 C18 1.470(4) . ?
 C10 H10A 0.9900 . ?
 C10 H10B 0.9900 . ?
 C10 C11 1.516(4) . ?
 C11 H11A 0.9900 . ?
 C11 H11B 0.9900 . ?
 C12 H12A 0.9900 . ?
 C12 H12B 0.9900 . ?
 C12 C13 1.516(4) . ?
 C13 H13A 0.9900 . ?
 C13 H13B 0.9900 . ?
 C14 H14A 0.9800 . ?
 C14 H14B 0.9800 . ?
 C14 H14C 0.9800 . ?
 C15 H15A 0.9800 . ?
 C15 H15B 0.9800 . ?
 C15 H15C 0.9800 . ?
 C16 H16A 0.9800 . ?
 C16 H16B 0.9800 . ?
 C16 H16C 0.9800 . ?
 C17 H17A 0.9800 . ?
 C17 H17B 0.9800 . ?
 C17 H17C 0.9800 . ?
 C18 H18A 0.9800 . ?
 C18 H18B 0.9800 . ?
 C18 H18C 0.9800 . ?
 Cl1 B1 1.768(3) . ?
 Cl2 B2 1.771(3) . ?
 Cl3 B3 1.767(3) . ?
 Cl4 B4 1.762(3) . ?
 Cl5 B5 1.763(3) . ?
 Cl6 B6 1.779(3) . ?
 Cl7 B7 1.779(3) . ?
 Cl8 B8 1.771(3) . ?
 Cl9 B9 1.777(3) . ?
 Cl10 B10 1.777(3) . ?
 Cl11 B11 1.777(3) . ?
 C19 H19 1.04(2) . ?
 C19 B1 1.719(4) . ?
 C19 B2 1.716(4) . ?
 C19 B3 1.722(4) . ?
 C19 B4 1.716(4) . ?
 C19 B5 1.717(4) . ?
 B1 B2 1.791(5) . ?
 B1 B5 1.792(4) . ?
 B1 B6 1.781(5) . ?
 B1 B10 1.774(4) . ?
 B2 B3 1.784(5) . ?
 B2 B6 1.781(4) . ?
 B2 B7 1.783(4) . ?
 B3 B4 1.793(5) . ?
 B3 B7 1.780(5) . ?
 B3 B8 1.779(5) . ?
 B4 B5 1.787(4) . ?
 B4 B8 1.772(5) . ?
 B4 B9 1.774(5) . ?
 B5 B9 1.773(4) . ?
 B5 B10 1.780(5) . ?
 B6 B7 1.793(5) . ?
 B6 B10 1.798(5) . ?
 B6 B11 1.791(4) . ?
 B7 B8 1.795(5) . ?
 B7 B11 1.792(5) . ?
 B8 B9 1.801(4) . ?
 B8 B11 1.797(5) . ?
 B9 B10 1.792(4) . ?
 B9 B11 1.790(5) . ?
 B10 B11 1.796(4) . ?
 Cl12 B12 1.764(3) . ?
 Cl13 B13 1.763(3) . ?
 Cl14 B14 1.771(3) . ?
 Cl15 B15 1.773(3) . ?
 Cl16 B16 1.762(3) . ?
 Cl17 B17 1.782(3) . ?
 Cl18 B18 1.777(3) . ?
 Cl19 B19 1.770(3) . ?
 Cl20 B20 1.776(3) . ?
 Cl21 B21 1.781(3) . ?
 Cl22 B22 1.782(3) . ?
 C20 H20 1.04(2) . ?
 C20 B12 1.715(4) . ?
 C20 B13 1.720(4) . ?
 C20 B14 1.714(4) . ?
 C20 B15 1.718(4) . ?
 C20 B16 1.722(4) . ?
 B12 B13 1.791(5) . ?
 B12 B16 1.797(5) . ?
 B12 B17 1.785(5) . ?
 B12 B21 1.779(5) . ?
 B13 B14 1.792(5) . ?
 B13 B17 1.783(5) . ?
 B13 B18 1.774(5) . ?
 B14 B15 1.784(5) . ?
 B14 B18 1.784(5) . ?
 B14 B19 1.783(4) . ?
 B15 B16 1.791(5) . ?
 B15 B19 1.785(5) . ?
 B15 B20 1.773(5) . ?
 B16 B20 1.782(5) . ?
 B16 B21 1.783(5) . ?
 B17 B18 1.794(5) . ?
 B17 B21 1.793(5) . ?
 B17 B22 1.791(5) . ?
 B18 B19 1.805(5) . ?
 B18 B22 1.795(5) . ?
 B19 B20 1.802(5) . ?
 B19 B22 1.792(5) . ?
 B20 B21 1.798(5) . ?
 B20 B22 1.788(5) . ?
 B21 B22 1.793(5) . ?

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
 N2 In1 N1 73.60(7) . . ?
 N2 In1 N3 72.53(8) . . ?
 N3 In1 N1 100.56(8) . . ?
 C1 N1 In1 103.0(2) . . ?
 C1 N1 C5 116.0(4) . . ?
 C1 N1 C6 108.5(3) . . ?
 C5 N1 In1 115.5(3) . . ?
 C5 N1 C6 108.3(3) . . ?
 C6 N1 In1 104.9(2) . . ?
 C1A N1 In1 107.5(5) . . ?
 C1A N1 C5A 96.2(13) . . ?
 C1A N1 C6A 109.2(10) . . ?
 C5A N1 In1 123.9(10) . . ?
 C6A N1 In1 110.7(7) . . ?
 C6A N1 C5A 107.9(11) . . ?
 C2 N2 In1 108.57(18) . . ?
 C3 N2 In1 108.7(2) . . ?
 C3 N2 C2 110.7(3) . . ?
 C7 N2 In1 110.0(2) . . ?
 C7 N2 C2 109.6(3) . . ?
 C7 N2 C3 109.3(3) . . ?
 C2A N2 In1 108.1(5) . . ?
 C3A N2 In1 114.8(5) . . ?
 C3A N2 C2A 114.1(8) . . ?
 C7A N2 In1 103.3(7) . . ?
 C7A N2 C2A 106.6(8) . . ?
 C7A N2 C3A 109.1(10) . . ?
 C4 N3 In1 110.31(19) . . ?
 C4 N3 C8 112.7(3) . . ?
 C4 N3 C9 112.0(3) . . ?
 C8 N3 In1 100.7(2) . . ?
 C9 N3 In1 112.9(2) . . ?
 C9 N3 C8 107.7(3) . . ?
 C4A N3 In1 105.4(5) . . ?
 C4A N3 C8A 110.2(8) . . ?
 C4A N3 C9A 97.8(9) . . ?
 C8A N3 In1 110.7(7) . . ?
 C8A N3 C9A 107.0(9) . . ?
 C9A N3 In1 124.6(6) . . ?
 N1 C1 H1A 109.6 . . ?
 N1 C1 H1B 109.6 . . ?
 N1 C1 C2 110.3(3) . . ?
 H1A C1 H1B 108.1 . . ?
 C2 C1 H1A 109.6 . . ?
 C2 C1 H1B 109.6 . . ?
 N2 C2 C1 111.9(3) . . ?
 N2 C2 H2A 109.2 . . ?
 N2 C2 H2B 109.2 . . ?
 C1 C2 H2A 109.2 . . ?
 C1 C2 H2B 109.2 . . ?
 H2A C2 H2B 107.9 . . ?
 N2 C3 H3A 109.1 . . ?
 N2 C3 H3B 109.1 . . ?
 N2 C3 C4 112.6(3) . . ?
 H3A C3 H3B 107.8 . . ?
 C4 C3 H3A 109.1 . . ?
 C4 C3 H3B 109.1 . . ?
 N3 C4 C3 111.4(3) . . ?
 N3 C4 H4A 109.3 . . ?
 N3 C4 H4B 109.3 . . ?
 C3 C4 H4A 109.3 . . ?
 C3 C4 H4B 109.3 . . ?
 H4A C4 H4B 108.0 . . ?
 N1 C5 H5A 109.5 . . ?
 N1 C5 H5B 109.5 . . ?
 N1 C5 H5C 109.5 . . ?
 H5A C5 H5B 109.5 . . ?
 H5A C5 H5C 109.5 . . ?
 H5B C5 H5C 109.5 . . ?
 N1 C6 H6A 109.5 . . ?
 N1 C6 H6B 109.5 . . ?
 N1 C6 H6C 109.5 . . ?
 H6A C6 H6B 109.5 . . ?
 H6A C6 H6C 109.5 . . ?
 H6B C6 H6C 109.5 . . ?
 N2 C7 H7A 109.5 . . ?
 N2 C7 H7B 109.5 . . ?
 N2 C7 H7C 109.5 . . ?
 H7A C7 H7B 109.5 . . ?
 H7A C7 H7C 109.5 . . ?
 H7B C7 H7C 109.5 . . ?
 N3 C8 H8A 109.5 . . ?
 N3 C8 H8B 109.5 . . ?
 N3 C8 H8C 109.5 . . ?
 H8A C8 H8B 109.5 . . ?
 H8A C8 H8C 109.5 . . ?
 H8B C8 H8C 109.5 . . ?
 N3 C9 H9A 109.5 . . ?
 N3 C9 H9B 109.5 . . ?
 N3 C9 H9C 109.5 . . ?
 H9A C9 H9B 109.5 . . ?
 H9A C9 H9C 109.5 . . ?
 H9B C9 H9C 109.5 . . ?
 N1 C1A H1AA 107.8 . . ?
 N1 C1A H1AB 107.8 . . ?
 N1 C1A C2A 118.1(9) . . ?
 H1AA C1A H1AB 107.1 . . ?
 C2A C1A H1AA 107.8 . . ?
 C2A C1A H1AB 107.8 . . ?
 N2 C2A C1A 108.9(8) . . ?
 N2 C2A H2AA 109.9 . . ?
 N2 C2A H2AB 109.9 . . ?
 C1A C2A H2AA 109.9 . . ?
 C1A C2A H2AB 109.9 . . ?
 H2AA C2A H2AB 108.3 . . ?
 N2 C3A H3AA 110.0 . . ?
 N2 C3A H3AB 110.0 . . ?
 N2 C3A C4A 108.5(8) . . ?
 H3AA C3A H3AB 108.4 . . ?
 C4A C3A H3AA 110.0 . . ?
 C4A C3A H3AB 110.0 . . ?
 N3 C4A C3A 118.4(9) . . ?
 N3 C4A H4AA 107.7 . . ?
 N3 C4A H4AB 107.7 . . ?
 C3A C4A H4AA 107.7 . . ?
 C3A C4A H4AB 107.7 . . ?
 H4AA C4A H4AB 107.1 . . ?
 N1 C5A H5AA 109.5 . . ?
 N1 C5A H5AB 109.5 . . ?
 N1 C5A H5AC 109.5 . . ?
 H5AA C5A H5AB 109.5 . . ?
 H5AA C5A H5AC 109.5 . . ?
 H5AB C5A H5AC 109.5 . . ?
 N1 C6A H6AA 109.5 . . ?
 N1 C6A H6AB 109.5 . . ?
 N1 C6A H6AC 109.5 . . ?
 H6AA C6A H6AB 109.5 . . ?
 H6AA C6A H6AC 109.5 . . ?
 H6AB C6A H6AC 109.5 . . ?
 N2 C7A H7AA 109.5 . . ?
 N2 C7A H7AB 109.5 . . ?
 N2 C7A H7AC 109.5 . . ?
 H7AA C7A H7AB 109.5 . . ?
 H7AA C7A H7AC 109.5 . . ?
 H7AB C7A H7AC 109.5 . . ?
 N3 C8A H8AA 109.5 . . ?
 N3 C8A H8AB 109.5 . . ?
 N3 C8A H8AC 109.5 . . ?
 H8AA C8A H8AB 109.5 . . ?
 H8AA C8A H8AC 109.5 . . ?
 H8AB C8A H8AC 109.5 . . ?
 N3 C9A H9AA 109.5 . . ?
 N3 C9A H9AB 109.5 . . ?
 N3 C9A H9AC 109.5 . . ?
 H9AA C9A H9AB 109.5 . . ?
 H9AA C9A H9AC 109.5 . . ?
 H9AB C9A H9AC 109.5 . . ?
 N5 In2 N4 72.51(8) . . ?
 N5 In2 N6 72.70(8) . . ?
 N6 In2 N4 99.45(8) . . ?
 C10 N4 In2 104.04(17) . . ?
 C10 N4 C14 110.2(2) . . ?
 C14 N4 In2 102.87(18) . . ?
 C15 N4 In2 119.32(19) . . ?
 C15 N4 C10 110.9(2) . . ?
 C15 N4 C14 109.0(2) . . ?
 C11 N5 In2 110.86(17) . . ?
 C11 N5 C12 112.0(2) . . ?
 C12 N5 In2 107.20(17) . . ?
 C16 N5 In2 107.29(18) . . ?
 C16 N5 C11 110.1(2) . . ?
 C16 N5 C12 109.3(2) . . ?
 C13 N6 In2 109.13(17) . . ?
 C13 N6 C17 110.6(2) . . ?
 C17 N6 In2 103.30(17) . . ?
 C18 N6 In2 115.19(18) . . ?
 C18 N6 C13 109.8(2) . . ?
 C18 N6 C17 108.6(2) . . ?
 N4 C10 H10A 109.2 . . ?
 N4 C10 H10B 109.2 . . ?
 N4 C10 C11 112.0(2) . . ?
 H10A C10 H10B 107.9 . . ?
 C11 C10 H10A 109.2 . . ?
 C11 C10 H10B 109.2 . . ?
 N5 C11 C10 111.2(2) . . ?
 N5 C11 H11A 109.4 . . ?
 N5 C11 H11B 109.4 . . ?
 C10 C11 H11A 109.4 . . ?
 C10 C11 H11B 109.4 . . ?
 H11A C11 H11B 108.0 . . ?
 N5 C12 H12A 109.1 . . ?
 N5 C12 H12B 109.1 . . ?
 N5 C12 C13 112.6(2) . . ?
 H12A C12 H12B 107.8 . . ?
 C13 C12 H12A 109.1 . . ?
 C13 C12 H12B 109.1 . . ?
 N6 C13 C12 112.2(2) . . ?
 N6 C13 H13A 109.2 . . ?
 N6 C13 H13B 109.2 . . ?
 C12 C13 H13A 109.2 . . ?
 C12 C13 H13B 109.2 . . ?
 H13A C13 H13B 107.9 . . ?
 N4 C14 H14A 109.5 . . ?
 N4 C14 H14B 109.5 . . ?
 N4 C14 H14C 109.5 . . ?
 H14A C14 H14B 109.5 . . ?
 H14A C14 H14C 109.5 . . ?
 H14B C14 H14C 109.5 . . ?
 N4 C15 H15A 109.5 . . ?
 N4 C15 H15B 109.5 . . ?
 N4 C15 H15C 109.5 . . ?
 H15A C15 H15B 109.5 . . ?
 H15A C15 H15C 109.5 . . ?
 H15B C15 H15C 109.5 . . ?
 N5 C16 H16A 109.5 . . ?
 N5 C16 H16B 109.5 . . ?
 N5 C16 H16C 109.5 . . ?
 H16A C16 H16B 109.5 . . ?
 H16A C16 H16C 109.5 . . ?
 H16B C16 H16C 109.5 . . ?
 N6 C17 H17A 109.5 . . ?
 N6 C17 H17B 109.5 . . ?
 N6 C17 H17C 109.5 . . ?
 H17A C17 H17B 109.5 . . ?
 H17A C17 H17C 109.5 . . ?
 H17B C17 H17C 109.5 . . ?
 N6 C18 H18A 109.5 . . ?
 N6 C18 H18B 109.5 . . ?
 N6 C18 H18C 109.5 . . ?
 H18A C18 H18B 109.5 . . ?
 H18A C18 H18C 109.5 . . ?
 H18B C18 H18C 109.5 . . ?
 B1 C19 H19 117.0(19) . . ?
 B1 C19 B3 114.7(2) . . ?
 B2 C19 H19 119.2(19) . . ?
 B2 C19 B1 62.83(18) . . ?
 B2 C19 B3 62.50(18) . . ?
 B2 C19 B4 114.6(2) . . ?
 B2 C19 B5 115.0(2) . . ?
 B3 C19 H19 119.1(19) . . ?
 B4 C19 H19 117.2(19) . . ?
 B4 C19 B1 114.7(2) . . ?
 B4 C19 B3 62.86(18) . . ?
 B4 C19 B5 62.75(18) . . ?
 B5 C19 H19 115.6(19) . . ?
 B5 C19 B1 62.87(18) . . ?
 B5 C19 B3 115.0(2) . . ?
 Cl1 B1 B2 120.4(2) . . ?
 Cl1 B1 B5 120.2(2) . . ?
 Cl1 B1 B6 125.2(2) . . ?
 Cl1 B1 B10 124.9(2) . . ?
 C19 B1 Cl1 121.4(2) . . ?
 C19 B1 B2 58.51(17) . . ?
 C19 B1 B5 58.51(17) . . ?
 C19 B1 B6 104.4(2) . . ?
 C19 B1 B10 104.6(2) . . ?
 B2 B1 B5 107.8(2) . . ?
 B6 B1 B2 59.80(18) . . ?
 B6 B1 B5 108.3(2) . . ?
 B10 B1 B2 108.4(2) . . ?
 B10 B1 B5 59.88(18) . . ?
 B10 B1 B6 60.77(18) . . ?
 Cl2 B2 B1 119.1(2) . . ?
 Cl2 B2 B3 121.0(2) . . ?
 Cl2 B2 B6 124.5(2) . . ?
 Cl2 B2 B7 125.9(2) . . ?
 C19 B2 Cl2 121.1(2) . . ?
 C19 B2 B1 58.66(17) . . ?
 C19 B2 B3 58.91(17) . . ?
 C19 B2 B6 104.6(2) . . ?
 C19 B2 B7 104.7(2) . . ?
 B3 B2 B1 108.3(2) . . ?
 B6 B2 B1 59.84(18) . . ?
 B6 B2 B3 108.4(2) . . ?
 B6 B2 B7 60.43(18) . . ?
 B7 B2 B1 108.2(2) . . ?
 B7 B2 B3 59.88(18) . . ?
 Cl3 B3 B2 120.7(2) . . ?
 Cl3 B3 B4 120.2(2) . . ?
 Cl3 B3 B7 125.3(2) . . ?
 Cl3 B3 B8 124.7(2) . . ?
 C19 B3 Cl3 121.6(2) . . ?
 C19 B3 B2 58.59(17) . . ?
 C19 B3 B4 58.42(17) . . ?
 C19 B3 B7 104.5(2) . . ?
 C19 B3 B8 104.3(2) . . ?
 B2 B3 B4 107.7(2) . . ?
 B7 B3 B2 60.04(18) . . ?
 B7 B3 B4 107.9(2) . . ?
 B8 B3 B2 108.4(2) . . ?
 B8 B3 B4 59.49(18) . . ?
 B8 B3 B7 60.59(18) . . ?
 Cl4 B4 B3 118.7(2) . . ?
 Cl4 B4 B5 122.2(2) . . ?
 Cl4 B4 B8 122.9(2) . . ?
 Cl4 B4 B9 125.5(2) . . ?
 C19 B4 Cl4 122.2(2) . . ?
 C19 B4 B3 58.72(18) . . ?
 C19 B4 B5 58.64(17) . . ?
 C19 B4 B8 104.8(2) . . ?
 C19 B4 B9 104.5(2) . . ?
 B5 B4 B3 108.2(2) . . ?
 B8 B4 B3 59.86(18) . . ?
 B8 B4 B5 108.8(2) . . ?
 B8 B4 B9 61.04(18) . . ?
 B9 B4 B3 108.5(2) . . ?
 B9 B4 B5 59.72(18) . . ?
 Cl5 B5 B1 121.2(2) . . ?
 Cl5 B5 B4 119.8(2) . . ?
 Cl5 B5 B9 124.4(2) . . ?
 Cl5 B5 B10 125.3(2) . . ?
 C19 B5 Cl5 121.8(2) . . ?
 C19 B5 B1 58.62(17) . . ?
 C19 B5 B4 58.61(18) . . ?
 C19 B5 B9 104.5(2) . . ?
 C19 B5 B10 104.4(2) . . ?
 B4 B5 B1 107.8(2) . . ?
 B9 B5 B1 108.0(2) . . ?
 B9 B5 B4 59.75(18) . . ?
 B9 B5 B10 60.59(18) . . ?
 B10 B5 B1 59.56(18) . . ?
 B10 B5 B4 108.2(2) . . ?
 Cl6 B6 B1 121.3(2) . . ?
 Cl6 B6 B2 121.4(2) . . ?
 Cl6 B6 B7 121.8(2) . . ?
 Cl6 B6 B10 121.9(2) . . ?
 Cl6 B6 B11 122.6(2) . . ?
 B1 B6 B7 108.2(2) . . ?
 B1 B6 B10 59.42(18) . . ?
 B1 B6 B11 107.5(2) . . ?
 B2 B6 B1 60.36(18) . . ?
 B2 B6 B7 59.85(18) . . ?
 B2 B6 B10 107.8(2) . . ?
 B2 B6 B11 107.6(2) . . ?
 B7 B6 B10 108.1(2) . . ?
 B11 B6 B7 59.98(18) . . ?
 B11 B6 B10 60.04(18) . . ?
 Cl7 B7 B2 121.7(2) . . ?
 Cl7 B7 B3 121.4(2) . . ?
 Cl7 B7 B6 121.9(2) . . ?
 Cl7 B7 B8 121.8(2) . . ?
 Cl7 B7 B11 122.4(2) . . ?
 B2 B7 B6 59.73(17) . . ?
 B2 B7 B8 107.7(2) . . ?
 B2 B7 B11 107.5(2) . . ?
 B3 B7 B2 60.08(18) . . ?
 B3 B7 B6 108.0(2) . . ?
 B3 B7 B8 59.68(18) . . ?
 B3 B7 B11 107.7(2) . . ?
 B6 B7 B8 108.1(2) . . ?
 B11 B7 B6 59.96(18) . . ?
 B11 B7 B8 60.12(18) . . ?
 Cl8 B8 B3 121.4(2) . . ?
 Cl8 B8 B4 120.1(2) . . ?
 Cl8 B8 B7 123.3(2) . . ?
 Cl8 B8 B9 121.2(2) . . ?
 Cl8 B8 B11 123.4(2) . . ?
 B3 B8 B7 59.74(18) . . ?
 B3 B8 B9 107.9(2) . . ?
 B3 B8 B11 107.5(2) . . ?
 B4 B8 B3 60.65(18) . . ?
 B4 B8 B7 108.1(2) . . ?
 B4 B8 B9 59.52(18) . . ?
 B4 B8 B11 107.3(2) . . ?
 B7 B8 B9 107.7(2) . . ?
 B7 B8 B11 59.84(18) . . ?
 B11 B8 B9 59.66(18) . . ?
 Cl9 B9 B8 122.2(2) . . ?
 Cl9 B9 B10 121.5(2) . . ?
 Cl9 B9 B11 122.6(2) . . ?
 B4 B9 Cl9 121.4(2) . . ?
 B4 B9 B8 59.44(18) . . ?
 B4 B9 B10 108.2(2) . . ?
 B4 B9 B11 107.6(2) . . ?
 B5 B9 Cl9 120.8(2) . . ?
 B5 B9 B4 60.53(18) . . ?
 B5 B9 B8 108.1(2) . . ?
 B5 B9 B10 59.89(17) . . ?
 B5 B9 B11 108.0(2) . . ?
 B10 B9 B8 108.3(2) . . ?
 B11 B9 B8 60.06(18) . . ?
 B11 B9 B10 60.18(18) . . ?
 Cl10 B10 B5 121.5(2) . . ?
 Cl10 B10 B6 121.3(2) . . ?
 Cl10 B10 B9 123.0(2) . . ?
 Cl10 B10 B11 123.1(2) . . ?
 B1 B10 Cl10 120.4(2) . . ?
 B1 B10 B5 60.56(18) . . ?
 B1 B10 B6 59.81(18) . . ?
 B1 B10 B9 107.9(2) . . ?
 B1 B10 B11 107.6(2) . . ?
 B5 B10 B6 108.1(2) . . ?
 B5 B10 B9 59.52(18) . . ?
 B5 B10 B11 107.5(2) . . ?
 B9 B10 B6 107.8(2) . . ?
 B9 B10 B11 59.84(18) . . ?
 B11 B10 B6 59.79(18) . . ?
 Cl11 B11 B6 122.3(2) . . ?
 Cl11 B11 B7 121.6(2) . . ?
 Cl11 B11 B8 120.9(2) . . ?
 Cl11 B11 B9 121.1(2) . . ?
 Cl11 B11 B10 121.9(2) . . ?
 B6 B11 B7 60.06(18) . . ?
 B6 B11 B8 108.2(2) . . ?
 B6 B11 B10 60.17(17) . . ?
 B7 B11 B8 60.04(18) . . ?
 B7 B11 B10 108.3(2) . . ?
 B9 B11 B6 108.2(2) . . ?
 B9 B11 B7 108.3(2) . . ?
 B9 B11 B8 60.27(18) . . ?
 B9 B11 B10 59.98(17) . . ?
 B10 B11 B8 108.3(2) . . ?
 B12 C20 H20 117.2(19) . . ?
 B12 C20 B13 62.85(19) . . ?
 B12 C20 B15 115.0(2) . . ?
 B12 C20 B16 63.04(19) . . ?
 B13 C20 H20 118.3(19) . . ?
 B13 C20 B16 115.2(2) . . ?
 B14 C20 H20 118.2(18) . . ?
 B14 C20 B12 115.1(2) . . ?
 B14 C20 B13 62.92(19) . . ?
 B14 C20 B15 62.65(18) . . ?
 B14 C20 B16 115.0(2) . . ?
 B15 C20 H20 117.4(19) . . ?
 B15 C20 B13 114.8(2) . . ?
 B15 C20 B16 62.77(19) . . ?
 B16 C20 H20 116.5(18) . . ?
 Cl12 B12 B13 119.2(2) . . ?
 Cl12 B12 B16 120.0(2) . . ?
 Cl12 B12 B17 126.2(2) . . ?
 Cl12 B12 B21 126.9(2) . . ?
 C20 B12 Cl12 119.7(2) . . ?
 C20 B12 B13 58.71(18) . . ?
 C20 B12 B16 58.66(18) . . ?
 C20 B12 B17 104.5(2) . . ?
 C20 B12 B21 104.3(2) . . ?
 B13 B12 B16 108.2(2) . . ?
 B17 B12 B13 59.80(19) . . ?
 B17 B12 B16 108.3(2) . . ?
 B21 B12 B13 108.1(2) . . ?
 B21 B12 B16 59.82(19) . . ?
 B21 B12 B17 60.40(18) . . ?
 Cl13 B13 B12 120.3(2) . . ?
 Cl13 B13 B14 120.2(2) . . ?
 Cl13 B13 B17 125.4(2) . . ?
 Cl13 B13 B18 125.0(2) . . ?
 C20 B13 Cl13 121.3(2) . . ?
 C20 B13 B12 58.45(18) . . ?
 C20 B13 B14 58.37(18) . . ?
 C20 B13 B17 104.4(2) . . ?
 C20 B13 B18 104.6(2) . . ?
 B12 B13 B14 107.7(2) . . ?
 B17 B13 B12 59.94(19) . . ?
 B17 B13 B14 108.2(2) . . ?
 B18 B13 B12 108.5(2) . . ?
 B18 B13 B14 60.04(18) . . ?
 B18 B13 B17 60.58(18) . . ?
 Cl14 B14 B13 121.0(2) . . ?
 Cl14 B14 B15 119.4(2) . . ?
 Cl14 B14 B18 125.6(2) . . ?
 Cl14 B14 B19 124.2(2) . . ?
 C20 B14 Cl14 121.3(2) . . ?
 C20 B14 B13 58.71(18) . . ?
 C20 B14 B15 58.78(18) . . ?
 C20 B14 B18 104.4(2) . . ?
 C20 B14 B19 105.0(2) . . ?
 B15 B14 B13 108.2(2) . . ?
 B18 B14 B13 59.47(18) . . ?
 B18 B14 B15 108.4(2) . . ?
 B19 B14 B13 108.5(2) . . ?
 B19 B14 B15 60.06(18) . . ?
 B19 B14 B18 60.79(18) . . ?
 Cl15 B15 B14 119.1(2) . . ?
 Cl15 B15 B16 120.4(2) . . ?
 Cl15 B15 B19 124.8(2) . . ?
 C20 B15 Cl15 120.6(2) . . ?
 C20 B15 B14 58.56(18) . . ?
 C20 B15 B16 58.72(18) . . ?
 C20 B15 B19 104.7(2) . . ?
 C20 B15 B20 104.6(2) . . ?
 B14 B15 B16 108.3(2) . . ?
 B14 B15 B19 59.93(18) . . ?
 B19 B15 B16 108.9(2) . . ?
 B20 B15 Cl15 126.1(2) . . ?
 B20 B15 B14 108.5(2) . . ?
 B20 B15 B16 60.01(19) . . ?
 B20 B15 B19 60.86(18) . . ?
 Cl16 B16 B12 120.5(2) . . ?
 Cl16 B16 B15 120.7(2) . . ?
 Cl16 B16 B20 125.2(2) . . ?
 Cl16 B16 B21 125.1(2) . . ?
 C20 B16 Cl16 122.0(2) . . ?
 C20 B16 B12 58.30(18) . . ?
 C20 B16 B15 58.50(18) . . ?
 C20 B16 B20 104.0(2) . . ?
 C20 B16 B21 103.9(2) . . ?
 B15 B16 B12 107.6(2) . . ?
 B20 B16 B12 107.9(2) . . ?
 B20 B16 B15 59.48(19) . . ?
 B20 B16 B21 60.57(18) . . ?
 B21 B16 B12 59.59(19) . . ?
 B21 B16 B15 107.8(2) . . ?
 Cl17 B17 B12 121.8(2) . . ?
 Cl17 B17 B13 121.9(2) . . ?
 Cl17 B17 B18 121.8(2) . . ?
 Cl17 B17 B21 121.7(2) . . ?
 Cl17 B17 B22 122.1(2) . . ?
 B12 B17 B18 107.8(2) . . ?
 B12 B17 B21 59.62(18) . . ?
 B12 B17 B22 107.5(2) . . ?
 B13 B17 B12 60.27(18) . . ?
 B13 B17 B18 59.46(18) . . ?
 B13 B17 B21 107.9(2) . . ?
 B13 B17 B22 107.4(2) . . ?
 B21 B17 B18 108.2(2) . . ?
 B22 B17 B18 60.09(18) . . ?
 B22 B17 B21 60.04(19) . . ?
 Cl18 B18 B14 121.7(2) . . ?
 Cl18 B18 B17 121.3(2) . . ?
 Cl18 B18 B19 122.5(2) . . ?
 Cl18 B18 B22 123.1(2) . . ?
 B13 B18 Cl18 120.5(2) . . ?
 B13 B18 B14 60.49(18) . . ?
 B13 B18 B17 59.95(18) . . ?
 B13 B18 B19 108.3(2) . . ?
 B13 B18 B22 107.6(2) . . ?
 B14 B18 B17 108.1(2) . . ?
 B14 B18 B19 59.57(18) . . ?
 B14 B18 B22 107.0(2) . . ?
 B17 B18 B19 108.1(2) . . ?
 B17 B18 B22 59.89(18) . . ?
 B22 B18 B19 59.72(18) . . ?
 Cl19 B19 B14 121.8(2) . . ?
 Cl19 B19 B15 121.7(2) . . ?
 Cl19 B19 B18 122.3(2) . . ?
 Cl19 B19 B20 122.2(2) . . ?
 Cl19 B19 B22 122.8(2) . . ?
 B14 B19 B15 60.01(18) . . ?
 B14 B19 B18 59.64(18) . . ?
 B14 B19 B20 107.2(2) . . ?
 B14 B19 B22 107.2(2) . . ?
 B15 B19 B18 107.5(2) . . ?
 B15 B19 B20 59.23(18) . . ?
 B15 B19 B22 106.9(2) . . ?
 B20 B19 B18 107.5(2) . . ?
 B22 B19 B18 59.86(18) . . ?
 B22 B19 B20 59.68(18) . . ?
 Cl20 B20 B16 121.2(2) . . ?
 Cl20 B20 B19 121.9(2) . . ?
 Cl20 B20 B21 121.5(2) . . ?
 Cl20 B20 B22 122.1(2) . . ?
 B15 B20 Cl20 121.9(2) . . ?
 B15 B20 B16 60.52(18) . . ?
 B15 B20 B19 59.90(18) . . ?
 B15 B20 B21 107.9(2) . . ?
 B15 B20 B22 107.6(2) . . ?
 B16 B20 B19 108.6(2) . . ?
 B16 B20 B21 59.73(19) . . ?
 B16 B20 B22 107.9(2) . . ?
 B21 B20 B19 108.2(2) . . ?
 B22 B20 B19 59.89(19) . . ?
 B22 B20 B21 60.00(18) . . ?
 Cl21 B21 B16 122.0(2) . . ?
 Cl21 B21 B17 121.4(2) . . ?
 Cl21 B21 B20 121.6(2) . . ?
 Cl21 B21 B22 121.5(2) . . ?
 B12 B21 Cl21 122.2(2) . . ?
 B12 B21 B16 60.60(19) . . ?
 B12 B21 B17 59.98(19) . . ?
 B12 B21 B20 108.0(2) . . ?
 B12 B21 B22 107.7(2) . . ?
 B16 B21 B17 108.5(2) . . ?
 B16 B21 B20 59.70(19) . . ?
 B16 B21 B22 107.6(2) . . ?
 B17 B21 B20 108.0(2) . . ?
 B17 B21 B22 59.94(18) . . ?
 B22 B21 B20 59.74(18) . . ?
 Cl22 B22 B17 121.7(2) . . ?
 Cl22 B22 B18 122.1(2) . . ?
 Cl22 B22 B19 121.1(2) . . ?
 Cl22 B22 B20 120.9(2) . . ?
 Cl22 B22 B21 121.2(2) . . ?
 B17 B22 B18 60.03(18) . . ?
 B17 B22 B19 108.8(2) . . ?
 B17 B22 B21 60.02(18) . . ?
 B19 B22 B18 60.41(18) . . ?
 B19 B22 B21 108.8(2) . . ?
 B20 B22 B17 108.5(2) . . ?
 B20 B22 B18 108.5(2) . . ?
 B20 B22 B19 60.43(18) . . ?
 B20 B22 B21 60.26(19) . . ?
 B21 B22 B18 108.2(2) . . ?

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
 In1 N1 C1 C2 56.4(3) . . . . ?
 In1 N1 C1A C2A -30.9(13) . . . . ?
 In1 N2 C2 C1 33.6(3) . . . . ?
 In1 N2 C3 C4 44.0(4) . . . . ?
 In1 N2 C2A C1A -48.0(11) . . . . ?
 In1 N2 C3A C4A -26.3(12) . . . . ?
 In1 N3 C4 C3 39.2(3) . . . . ?
 In1 N3 C4A C3A -47.6(12) . . . . ?
 N1 C1 C2 N2 -65.1(4) . . . . ?
 N1 C1A C2A N2 56.2(16) . . . . ?
 N2 C3 C4 N3 -58.2(4) . . . . ?
 N2 C3A C4A N3 52.1(16) . . . . ?
 C2 N2 C3 C4 -75.2(4) . . . . ?
 C3 N2 C2 C1 152.9(3) . . . . ?
 C5 N1 C1 C2 -70.7(4) . . . . ?
 C6 N1 C1 C2 167.2(3) . . . . ?
 C7 N2 C2 C1 -86.5(4) . . . . ?
 C7 N2 C3 C4 164.0(4) . . . . ?
 C8 N3 C4 C3 -72.5(4) . . . . ?
 C9 N3 C4 C3 165.9(3) . . . . ?
 C2A N2 C3A C4A -151.9(9) . . . . ?
 C3A N2 C2A C1A 81.0(13) . . . . ?
 C5A N1 C1A C2A -159.4(14) . . . . ?
 C6A N1 C1A C2A 89.2(14) . . . . ?
 C7A N2 C2A C1A -158.5(11) . . . . ?
 C7A N2 C3A C4A 89.0(13) . . . . ?
 C8A N3 C4A C3A -167.1(12) . . . . ?
 C9A N3 C4A C3A 81.6(13) . . . . ?
 In2 N4 C10 C11 53.3(3) . . . . ?
 In2 N5 C11 C10 34.1(3) . . . . ?
 In2 N5 C12 C13 49.3(3) . . . . ?
 In2 N6 C13 C12 35.4(3) . . . . ?
 N4 C10 C11 N5 -62.6(3) . . . . ?
 N5 C12 C13 N6 -60.0(3) . . . . ?
 C11 N5 C12 C13 -72.6(3) . . . . ?
 C12 N5 C11 C10 153.8(2) . . . . ?
 C14 N4 C10 C11 163.0(3) . . . . ?
 C15 N4 C10 C11 -76.2(3) . . . . ?
 C16 N5 C11 C10 -84.5(3) . . . . ?
 C16 N5 C12 C13 165.2(2) . . . . ?
 C17 N6 C13 C12 -77.6(3) . . . . ?
 C18 N6 C13 C12 162.6(2) . . . . ?
 Cl1 B1 B2 Cl2 -0.3(3) . . . . ?
 Cl1 B1 B2 C19 110.5(2) . . . . ?
 Cl1 B1 B2 B3 143.4(2) . . . . ?
 Cl1 B1 B2 B6 -115.5(3) . . . . ?
 Cl1 B1 B2 B7 -153.1(2) . . . . ?
 Cl1 B1 B5 Cl5 0.1(3) . . . . ?
 Cl1 B1 B5 C19 -110.6(2) . . . . ?
 Cl1 B1 B5 B4 -143.7(2) . . . . ?
 Cl1 B1 B5 B9 153.2(2) . . . . ?
 Cl1 B1 B5 B10 115.3(3) . . . . ?
 Cl1 B1 B6 Cl6 -3.0(4) . . . . ?
 Cl1 B1 B6 B2 107.8(3) . . . . ?
 Cl1 B1 B6 B7 145.2(2) . . . . ?
 Cl1 B1 B6 B10 -114.1(3) . . . . ?
 Cl1 B1 B6 B11 -151.5(2) . . . . ?
 Cl1 B1 B10 Cl10 3.6(4) . . . . ?
 Cl1 B1 B10 B5 -107.7(3) . . . . ?
 Cl1 B1 B10 B6 114.5(3) . . . . ?
 Cl1 B1 B10 B9 -145.0(2) . . . . ?
 Cl1 B1 B10 B11 151.8(2) . . . . ?
 Cl2 B2 B3 Cl3 -0.6(4) . . . . ?
 Cl2 B2 B3 C19 110.0(2) . . . . ?
 Cl2 B2 B3 B4 142.9(2) . . . . ?
 Cl2 B2 B3 B7 -116.3(3) . . . . ?
 Cl2 B2 B3 B8 -154.2(2) . . . . ?
 Cl2 B2 B6 Cl6 4.2(4) . . . . ?
 Cl2 B2 B6 B1 -106.5(3) . . . . ?
 Cl2 B2 B6 B7 115.3(3) . . . . ?
 Cl2 B2 B6 B10 -143.6(2) . . . . ?
 Cl2 B2 B6 B11 153.1(2) . . . . ?
 Cl2 B2 B7 Cl7 -2.1(4) . . . . ?
 Cl2 B2 B7 B3 108.4(3) . . . . ?
 Cl2 B2 B7 B6 -113.2(3) . . . . ?
 Cl2 B2 B7 B8 145.7(2) . . . . ?
 Cl2 B2 B7 B11 -150.9(2) . . . . ?
 Cl3 B3 B4 Cl4 -1.5(3) . . . . ?
 Cl3 B3 B4 C19 110.7(3) . . . . ?
 Cl3 B3 B4 B5 143.5(2) . . . . ?
 Cl3 B3 B4 B8 -115.0(3) . . . . ?
 Cl3 B3 B4 B9 -153.3(2) . . . . ?
 Cl3 B3 B7 Cl7 2.7(4) . . . . ?
 Cl3 B3 B7 B2 -108.3(3) . . . . ?
 Cl3 B3 B7 B6 -145.3(2) . . . . ?
 Cl3 B3 B7 B8 113.8(3) . . . . ?
 Cl3 B3 B7 B11 151.4(2) . . . . ?
 Cl3 B3 B8 Cl8 -1.7(4) . . . . ?
 Cl3 B3 B8 B4 107.6(3) . . . . ?
 Cl3 B3 B8 B7 -114.5(3) . . . . ?
 Cl3 B3 B8 B9 145.1(2) . . . . ?
 Cl3 B3 B8 B11 -152.0(2) . . . . ?
 Cl4 B4 B5 Cl5 -0.5(4) . . . . ?
 Cl4 B4 B5 C19 110.7(3) . . . . ?
 Cl4 B4 B5 B1 143.9(2) . . . . ?
 Cl4 B4 B5 B9 -115.3(3) . . . . ?
 Cl4 B4 B5 B10 -153.1(2) . . . . ?
 Cl4 B4 B8 Cl8 4.8(4) . . . . ?
 Cl4 B4 B8 B3 -106.6(3) . . . . ?
 Cl4 B4 B8 B7 -144.1(2) . . . . ?
 Cl4 B4 B8 B9 115.6(3) . . . . ?
 Cl4 B4 B8 B11 152.7(2) . . . . ?
 Cl4 B4 B9 Cl9 -0.2(4) . . . . ?
 Cl4 B4 B9 B5 109.9(3) . . . . ?
 Cl4 B4 B9 B8 -111.6(3) . . . . ?
 Cl4 B4 B9 B10 147.5(2) . . . . ?
 Cl4 B4 B9 B11 -148.9(2) . . . . ?
 Cl5 B5 B9 Cl9 3.7(4) . . . . ?
 Cl5 B5 B9 B4 -107.4(3) . . . . ?
 Cl5 B5 B9 B8 -144.3(2) . . . . ?
 Cl5 B5 B9 B10 114.7(3) . . . . ?
 Cl5 B5 B9 B11 152.2(2) . . . . ?
 Cl5 B5 B10 Cl10 -0.9(4) . . . . ?
 Cl5 B5 B10 B1 108.7(3) . . . . ?
 Cl5 B5 B10 B6 146.3(2) . . . . ?
 Cl5 B5 B10 B9 -113.3(3) . . . . ?
 Cl5 B5 B10 B11 -150.5(2) . . . . ?
 Cl6 B6 B7 Cl7 -0.3(4) . . . . ?
 Cl6 B6 B7 B2 110.3(3) . . . . ?
 Cl6 B6 B7 B3 147.6(2) . . . . ?
 Cl6 B6 B7 B8 -149.3(2) . . . . ?
 Cl6 B6 B7 B11 -112.0(3) . . . . ?
 Cl6 B6 B10 Cl10 -0.7(3) . . . . ?
 Cl6 B6 B10 B1 -110.0(3) . . . . ?
 Cl6 B6 B10 B5 -148.0(2) . . . . ?
 Cl6 B6 B10 B9 149.1(2) . . . . ?
 Cl6 B6 B10 B11 112.0(2) . . . . ?
 Cl6 B6 B11 Cl11 0.1(4) . . . . ?
 Cl6 B6 B11 B7 110.7(3) . . . . ?
 Cl6 B6 B11 B8 148.0(2) . . . . ?
 Cl6 B6 B11 B9 -148.2(2) . . . . ?
 Cl6 B6 B11 B10 -110.9(3) . . . . ?
 Cl7 B7 B8 Cl8 0.5(4) . . . . ?
 Cl7 B7 B8 B3 110.3(3) . . . . ?
 Cl7 B7 B8 B4 148.3(2) . . . . ?
 Cl7 B7 B8 B9 -148.8(2) . . . . ?
 Cl7 B7 B8 B11 -111.8(3) . . . . ?
 Cl7 B7 B11 Cl11 0.9(4) . . . . ?
 Cl7 B7 B11 B6 -110.9(3) . . . . ?
 Cl7 B7 B11 B8 110.8(3) . . . . ?
 Cl7 B7 B11 B9 148.3(2) . . . . ?
 Cl7 B7 B11 B10 -148.2(2) . . . . ?
 Cl8 B8 B9 Cl9 -1.2(4) . . . . ?
 Cl8 B8 B9 B4 108.8(3) . . . . ?
 Cl8 B8 B9 B5 146.2(2) . . . . ?
 Cl8 B8 B9 B10 -150.4(2) . . . . ?
 Cl8 B8 B9 B11 -113.0(3) . . . . ?
 Cl8 B8 B11 Cl11 -1.0(4) . . . . ?
 Cl8 B8 B11 B6 -149.5(2) . . . . ?
 Cl8 B8 B11 B7 -112.2(3) . . . . ?
 Cl8 B8 B11 B9 109.5(3) . . . . ?
 Cl8 B8 B11 B10 146.8(2) . . . . ?
 Cl9 B9 B10 Cl10 -0.1(4) . . . . ?
 Cl9 B9 B10 B1 147.6(2) . . . . ?
 Cl9 B9 B10 B5 109.8(3) . . . . ?
 Cl9 B9 B10 B6 -149.2(2) . . . . ?
 Cl9 B9 B10 B11 -112.1(3) . . . . ?
 Cl9 B9 B11 Cl11 -0.9(3) . . . . ?
 Cl9 B9 B11 B6 147.9(2) . . . . ?
 Cl9 B9 B11 B7 -148.5(2) . . . . ?
 Cl9 B9 B11 B8 -111.2(2) . . . . ?
 Cl9 B9 B11 B10 110.5(3) . . . . ?
 Cl10 B10 B11 Cl11 -1.9(4) . . . . ?
 Cl10 B10 B11 B6 109.8(3) . . . . ?
 Cl10 B10 B11 B7 147.0(2) . . . . ?
 Cl10 B10 B11 B8 -149.4(2) . . . . ?
 Cl10 B10 B11 B9 -111.9(3) . . . . ?
 C19 B1 B2 Cl2 -110.7(2) . . . . ?
 C19 B1 B2 B3 33.0(2) . . . . ?
 C19 B1 B2 B6 134.0(2) . . . . ?
 C19 B1 B2 B7 96.4(2) . . . . ?
 C19 B1 B5 Cl5 110.6(3) . . . . ?
 C19 B1 B5 B4 -33.1(2) . . . . ?
 C19 B1 B5 B9 -96.3(2) . . . . ?
 C19 B1 B5 B10 -134.1(2) . . . . ?
 C19 B1 B6 Cl6 -150.1(2) . . . . ?
 C19 B1 B6 B2 -39.3(2) . . . . ?
 C19 B1 B6 B7 -1.9(3) . . . . ?
 C19 B1 B6 B10 98.8(2) . . . . ?
 C19 B1 B6 B11 61.4(3) . . . . ?
 C19 B1 B10 Cl10 150.6(2) . . . . ?
 C19 B1 B10 B5 39.2(2) . . . . ?
 C19 B1 B10 B6 -98.6(2) . . . . ?
 C19 B1 B10 B9 1.9(3) . . . . ?
 C19 B1 B10 B11 -61.3(3) . . . . ?
 C19 B2 B3 Cl3 -110.6(3) . . . . ?
 C19 B2 B3 B4 32.9(2) . . . . ?
 C19 B2 B3 B7 133.7(2) . . . . ?
 C19 B2 B3 B8 95.8(2) . . . . ?
 C19 B2 B6 Cl6 150.1(2) . . . . ?
 C19 B2 B6 B1 39.4(2) . . . . ?
 C19 B2 B6 B7 -98.8(2) . . . . ?
 C19 B2 B6 B10 2.3(3) . . . . ?
 C19 B2 B6 B11 -61.1(3) . . . . ?
 C19 B2 B7 Cl7 -150.3(2) . . . . ?
 C19 B2 B7 B3 -39.7(2) . . . . ?
 C19 B2 B7 B6 98.7(2) . . . . ?
 C19 B2 B7 B8 -2.4(3) . . . . ?
 C19 B2 B7 B11 61.0(3) . . . . ?
 C19 B3 B4 Cl4 -112.2(2) . . . . ?
 C19 B3 B4 B5 32.7(2) . . . . ?
 C19 B3 B4 B8 134.3(2) . . . . ?
 C19 B3 B4 B9 96.0(2) . . . . ?
 C19 B3 B7 Cl7 150.6(2) . . . . ?
 C19 B3 B7 B2 39.6(2) . . . . ?
 C19 B3 B7 B6 2.5(3) . . . . ?
 C19 B3 B7 B8 -98.4(2) . . . . ?
 C19 B3 B7 B11 -60.8(3) . . . . ?
 C19 B3 B8 Cl8 -148.3(2) . . . . ?
 C19 B3 B8 B4 -39.0(2) . . . . ?
 C19 B3 B8 B7 98.9(2) . . . . ?
 C19 B3 B8 B9 -1.5(3) . . . . ?
 C19 B3 B8 B11 61.4(3) . . . . ?
 C19 B4 B5 Cl5 -111.2(3) . . . . ?
 C19 B4 B5 B1 33.1(2) . . . . ?
 C19 B4 B5 B9 134.0(2) . . . . ?
 C19 B4 B5 B10 96.1(2) . . . . ?
 C19 B4 B8 Cl8 150.6(2) . . . . ?
 C19 B4 B8 B3 39.3(2) . . . . ?
 C19 B4 B8 B7 1.7(3) . . . . ?
 C19 B4 B8 B9 -98.6(2) . . . . ?
 C19 B4 B8 B11 -61.5(3) . . . . ?
 C19 B4 B9 Cl9 -149.5(2) . . . . ?
 C19 B4 B9 B5 -39.4(2) . . . . ?
 C19 B4 B9 B8 99.1(2) . . . . ?
 C19 B4 B9 B10 -1.8(3) . . . . ?
 C19 B4 B9 B11 61.8(3) . . . . ?
 C19 B5 B9 Cl9 150.4(2) . . . . ?
 C19 B5 B9 B4 39.4(2) . . . . ?
 C19 B5 B9 B8 2.5(3) . . . . ?
 C19 B5 B9 B10 -98.6(2) . . . . ?
 C19 B5 B9 B11 -61.1(3) . . . . ?
 C19 B5 B10 Cl10 -148.9(2) . . . . ?
 C19 B5 B10 B1 -39.3(2) . . . . ?
 C19 B5 B10 B6 -1.6(3) . . . . ?
 C19 B5 B10 B9 98.7(2) . . . . ?
 C19 B5 B10 B11 61.5(3) . . . . ?
 B1 C19 B2 Cl2 107.3(2) . . . . ?
 B1 C19 B2 B3 -142.9(2) . . . . ?
 B1 C19 B2 B6 -40.0(2) . . . . ?
 B1 C19 B2 B7 -102.7(2) . . . . ?
 B1 C19 B3 Cl3 145.3(2) . . . . ?
 B1 C19 B3 B2 36.2(2) . . . . ?
 B1 C19 B3 B4 -106.3(3) . . . . ?
 B1 C19 B3 B7 -4.0(3) . . . . ?
 B1 C19 B3 B8 -66.8(3) . . . . ?
 B1 C19 B4 Cl4 -147.3(2) . . . . ?
 B1 C19 B4 B3 106.4(3) . . . . ?
 B1 C19 B4 B5 -36.7(2) . . . . ?
 B1 C19 B4 B8 66.5(3) . . . . ?
 B1 C19 B4 B9 3.2(3) . . . . ?
 B1 C19 B5 Cl5 -109.7(2) . . . . ?
 B1 C19 B5 B4 142.4(2) . . . . ?
 B1 C19 B5 B9 102.5(2) . . . . ?
 B1 C19 B5 B10 39.7(2) . . . . ?
 B1 B2 B3 Cl3 -143.5(2) . . . . ?
 B1 B2 B3 C19 -32.9(2) . . . . ?
 B1 B2 B3 B4 0.0(3) . . . . ?
 B1 B2 B3 B7 100.9(2) . . . . ?
 B1 B2 B3 B8 62.9(3) . . . . ?
 B1 B2 B6 Cl6 110.7(2) . . . . ?
 B1 B2 B6 B7 -138.2(2) . . . . ?
 B1 B2 B6 B10 -37.1(2) . . . . ?
 B1 B2 B6 B11 -100.5(2) . . . . ?
 B1 B2 B7 Cl7 148.4(2) . . . . ?
 B1 B2 B7 B3 -101.1(2) . . . . ?
 B1 B2 B7 B6 37.4(2) . . . . ?
 B1 B2 B7 B8 -63.7(3) . . . . ?
 B1 B2 B7 B11 -0.3(3) . . . . ?
 B1 B5 B9 Cl9 -148.4(2) . . . . ?
 B1 B5 B9 B4 100.6(2) . . . . ?
 B1 B5 B9 B8 63.7(3) . . . . ?
 B1 B5 B9 B10 -37.4(2) . . . . ?
 B1 B5 B9 B11 0.1(3) . . . . ?
 B1 B5 B10 Cl10 -109.6(2) . . . . ?
 B1 B5 B10 B6 37.6(2) . . . . ?
 B1 B5 B10 B9 138.0(2) . . . . ?
 B1 B5 B10 B11 100.7(2) . . . . ?
 B1 B6 B7 Cl7 -148.2(2) . . . . ?
 B1 B6 B7 B2 -37.6(2) . . . . ?
 B1 B6 B7 B3 -0.4(3) . . . . ?
 B1 B6 B7 B8 62.7(3) . . . . ?
 B1 B6 B7 B11 100.1(2) . . . . ?
 B1 B6 B10 Cl10 109.4(2) . . . . ?
 B1 B6 B10 B5 -37.9(2) . . . . ?
 B1 B6 B10 B9 -100.8(2) . . . . ?
 B1 B6 B10 B11 -138.0(2) . . . . ?
 B1 B6 B11 Cl11 148.1(2) . . . . ?
 B1 B6 B11 B7 -101.3(2) . . . . ?
 B1 B6 B11 B8 -64.0(3) . . . . ?
 B1 B6 B11 B9 -0.2(3) . . . . ?
 B1 B6 B11 B10 37.2(2) . . . . ?
 B1 B10 B11 Cl11 -149.0(2) . . . . ?
 B1 B10 B11 B6 -37.4(2) . . . . ?
 B1 B10 B11 B7 -0.1(3) . . . . ?
 B1 B10 B11 B8 63.5(3) . . . . ?
 B1 B10 B11 B9 100.9(2) . . . . ?
 B2 C19 B1 Cl1 -108.7(3) . . . . ?
 B2 C19 B1 B5 142.8(2) . . . . ?
 B2 C19 B1 B6 39.9(2) . . . . ?
 B2 C19 B1 B10 102.9(2) . . . . ?
 B2 C19 B3 Cl3 109.0(3) . . . . ?
 B2 C19 B3 B4 -142.6(2) . . . . ?
 B2 C19 B3 B7 -40.3(2) . . . . ?
 B2 C19 B3 B8 -103.1(2) . . . . ?
 B2 C19 B4 Cl4 142.7(2) . . . . ?
 B2 C19 B4 B3 36.4(2) . . . . ?
 B2 C19 B4 B5 -106.7(3) . . . . ?
 B2 C19 B4 B8 -3.5(3) . . . . ?
 B2 C19 B4 B9 -66.8(3) . . . . ?
 B2 C19 B5 Cl5 -146.0(2) . . . . ?
 B2 C19 B5 B1 -36.4(2) . . . . ?
 B2 C19 B5 B4 106.1(2) . . . . ?
 B2 C19 B5 B9 66.1(3) . . . . ?
 B2 C19 B5 B10 3.3(3) . . . . ?
 B2 B1 B5 Cl5 143.4(2) . . . . ?
 B2 B1 B5 C19 32.8(2) . . . . ?
 B2 B1 B5 B4 -0.4(3) . . . . ?
 B2 B1 B5 B9 -63.5(3) . . . . ?
 B2 B1 B5 B10 -101.4(2) . . . . ?
 B2 B1 B6 Cl6 -110.8(3) . . . . ?
 B2 B1 B6 B7 37.3(2) . . . . ?
 B2 B1 B6 B10 138.1(2) . . . . ?
 B2 B1 B6 B11 100.7(2) . . . . ?
 B2 B1 B10 Cl10 -148.3(2) . . . . ?
 B2 B1 B10 B5 100.4(2) . . . . ?
 B2 B1 B10 B6 -37.5(2) . . . . ?
 B2 B1 B10 B9 63.0(3) . . . . ?
 B2 B1 B10 B11 -0.1(3) . . . . ?
 B2 B3 B4 Cl4 -145.2(2) . . . . ?
 B2 B3 B4 C19 -33.0(2) . . . . ?
 B2 B3 B4 B5 -0.3(3) . . . . ?
 B2 B3 B4 B8 101.3(2) . . . . ?
 B2 B3 B4 B9 63.0(3) . . . . ?
 B2 B3 B7 Cl7 111.0(3) . . . . ?
 B2 B3 B7 B6 -37.1(2) . . . . ?
 B2 B3 B7 B8 -138.0(2) . . . . ?
 B2 B3 B7 B11 -100.4(2) . . . . ?
 B2 B3 B8 Cl8 150.5(2) . . . . ?
 B2 B3 B8 B4 -100.2(2) . . . . ?
 B2 B3 B8 B7 37.7(2) . . . . ?
 B2 B3 B8 B9 -62.7(3) . . . . ?
 B2 B3 B8 B11 0.2(3) . . . . ?
 B2 B6 B7 Cl7 -110.6(3) . . . . ?
 B2 B6 B7 B3 37.2(2) . . . . ?
 B2 B6 B7 B8 100.3(2) . . . . ?
 B2 B6 B7 B11 137.7(2) . . . . ?
 B2 B6 B10 Cl10 146.9(2) . . . . ?
 B2 B6 B10 B1 37.6(2) . . . . ?
 B2 B6 B10 B5 -0.4(3) . . . . ?
 B2 B6 B10 B9 -63.3(3) . . . . ?
 B2 B6 B10 B11 -100.4(2) . . . . ?
 B2 B6 B11 Cl11 -148.3(2) . . . . ?
 B2 B6 B11 B7 -37.7(2) . . . . ?
 B2 B6 B11 B8 -0.3(3) . . . . ?
 B2 B6 B11 B9 63.4(3) . . . . ?
 B2 B6 B11 B10 100.8(2) . . . . ?
 B2 B7 B8 Cl8 -147.3(2) . . . . ?
 B2 B7 B8 B3 -37.5(2) . . . . ?
 B2 B7 B8 B4 0.5(3) . . . . ?
 B2 B7 B8 B9 63.3(3) . . . . ?
 B2 B7 B8 B11 100.4(2) . . . . ?
 B2 B7 B11 Cl11 149.3(2) . . . . ?
 B2 B7 B11 B6 37.6(2) . . . . ?
 B2 B7 B11 B8 -100.8(2) . . . . ?
 B2 B7 B11 B9 -63.3(3) . . . . ?
 B2 B7 B11 B10 0.3(3) . . . . ?
 B3 C19 B1 Cl1 -144.8(2) . . . . ?
 B3 C19 B1 B2 -36.1(2) . . . . ?
 B3 C19 B1 B5 106.7(3) . . . . ?
 B3 C19 B1 B6 3.8(3) . . . . ?
 B3 C19 B1 B10 66.8(3) . . . . ?
 B3 C19 B2 Cl2 -109.8(3) . . . . ?
 B3 C19 B2 B1 142.9(2) . . . . ?
 B3 C19 B2 B6 102.9(2) . . . . ?
 B3 C19 B2 B7 40.2(2) . . . . ?
 B3 C19 B4 Cl4 106.3(3) . . . . ?
 B3 C19 B4 B5 -143.0(2) . . . . ?
 B3 C19 B4 B8 -39.8(2) . . . . ?
 B3 C19 B4 B9 -103.1(2) . . . . ?
 B3 C19 B5 Cl5 144.1(2) . . . . ?
 B3 C19 B5 B1 -106.2(3) . . . . ?
 B3 C19 B5 B4 36.2(2) . . . . ?
 B3 C19 B5 B9 -3.7(3) . . . . ?
 B3 C19 B5 B10 -66.5(3) . . . . ?
 B3 B2 B6 Cl6 -148.4(2) . . . . ?
 B3 B2 B6 B1 101.0(2) . . . . ?
 B3 B2 B6 B7 -37.2(2) . . . . ?
 B3 B2 B6 B10 63.8(3) . . . . ?
 B3 B2 B6 B11 0.5(3) . . . . ?
 B3 B2 B7 Cl7 -110.5(3) . . . . ?
 B3 B2 B7 B6 138.4(2) . . . . ?
 B3 B2 B7 B8 37.3(2) . . . . ?
 B3 B2 B7 B11 100.7(2) . . . . ?
 B3 B4 B5 Cl5 -144.0(2) . . . . ?
 B3 B4 B5 C19 -32.8(2) . . . . ?
 B3 B4 B5 B1 0.4(3) . . . . ?
 B3 B4 B5 B9 101.2(2) . . . . ?
 B3 B4 B5 B10 63.4(3) . . . . ?
 B3 B4 B8 Cl8 111.4(3) . . . . ?
 B3 B4 B8 B7 -37.6(2) . . . . ?
 B3 B4 B8 B9 -137.8(2) . . . . ?
 B3 B4 B8 B11 -100.7(2) . . . . ?
 B3 B4 B9 Cl9 149.1(2) . . . . ?
 B3 B4 B9 B5 -100.7(2) . . . . ?
 B3 B4 B9 B8 37.8(2) . . . . ?
 B3 B4 B9 B10 -63.2(3) . . . . ?
 B3 B4 B9 B11 0.4(3) . . . . ?
 B3 B7 B8 Cl8 -109.7(3) . . . . ?
 B3 B7 B8 B4 38.0(2) . . . . ?
 B3 B7 B8 B9 100.9(2) . . . . ?
 B3 B7 B8 B11 137.9(2) . . . . ?
 B3 B7 B11 Cl11 -147.3(2) . . . . ?
 B3 B7 B11 B6 100.9(2) . . . . ?
 B3 B7 B11 B8 -37.4(2) . . . . ?
 B3 B7 B11 B9 0.1(3) . . . . ?
 B3 B7 B11 B10 63.6(3) . . . . ?
 B3 B8 B9 Cl9 -148.0(2) . . . . ?
 B3 B8 B9 B4 -38.0(2) . . . . ?
 B3 B8 B9 B5 -0.6(3) . . . . ?
 B3 B8 B9 B10 62.8(3) . . . . ?
 B3 B8 B9 B11 100.2(2) . . . . ?
 B3 B8 B11 Cl11 148.5(2) . . . . ?
 B3 B8 B11 B6 0.1(3) . . . . ?
 B3 B8 B11 B7 37.4(2) . . . . ?
 B3 B8 B11 B9 -100.9(2) . . . . ?
 B3 B8 B11 B10 -63.6(3) . . . . ?
 B4 C19 B1 Cl1 145.1(2) . . . . ?
 B4 C19 B1 B2 -106.2(2) . . . . ?
 B4 C19 B1 B5 36.6(2) . . . . ?
 B4 C19 B1 B6 -66.3(3) . . . . ?
 B4 C19 B1 B10 -3.3(3) . . . . ?
 B4 C19 B2 Cl2 -146.3(2) . . . . ?
 B4 C19 B2 B1 106.4(2) . . . . ?
 B4 C19 B2 B3 -36.5(2) . . . . ?
 B4 C19 B2 B6 66.4(3) . . . . ?
 B4 C19 B2 B7 3.7(3) . . . . ?
 B4 C19 B3 Cl3 -108.4(3) . . . . ?
 B4 C19 B3 B2 142.6(2) . . . . ?
 B4 C19 B3 B7 102.3(2) . . . . ?
 B4 C19 B3 B8 39.5(2) . . . . ?
 B4 C19 B5 Cl5 107.9(3) . . . . ?
 B4 C19 B5 B1 -142.4(2) . . . . ?
 B4 C19 B5 B9 -39.9(2) . . . . ?
 B4 C19 B5 B10 -102.7(2) . . . . ?
 B4 B3 B7 Cl7 -148.4(2) . . . . ?
 B4 B3 B7 B2 100.6(2) . . . . ?
 B4 B3 B7 B6 63.5(3) . . . . ?
 B4 B3 B7 B8 -37.4(2) . . . . ?
 B4 B3 B7 B11 0.2(3) . . . . ?
 B4 B3 B8 Cl8 -109.3(3) . . . . ?
 B4 B3 B8 B7 137.9(2) . . . . ?
 B4 B3 B8 B9 37.5(2) . . . . ?
 B4 B3 B8 B11 100.4(2) . . . . ?
 B4 B5 B9 Cl9 111.0(3) . . . . ?
 B4 B5 B9 B8 -36.9(2) . . . . ?
 B4 B5 B9 B10 -138.0(2) . . . . ?
 B4 B5 B9 B11 -100.4(2) . . . . ?
 B4 B5 B10 Cl10 149.9(2) . . . . ?
 B4 B5 B10 B1 -100.5(2) . . . . ?
 B4 B5 B10 B6 -62.8(3) . . . . ?
 B4 B5 B10 B9 37.5(2) . . . . ?
 B4 B5 B10 B11 0.3(3) . . . . ?
 B4 B8 B9 Cl9 -110.0(3) . . . . ?
 B4 B8 B9 B5 37.4(2) . . . . ?
 B4 B8 B9 B10 100.8(2) . . . . ?
 B4 B8 B9 B11 138.2(2) . . . . ?
 B4 B8 B11 Cl11 -147.6(2) . . . . ?
 B4 B8 B11 B6 64.0(3) . . . . ?
 B4 B8 B11 B7 101.3(2) . . . . ?
 B4 B8 B11 B9 -37.0(2) . . . . ?
 B4 B8 B11 B10 0.2(3) . . . . ?
 B4 B9 B10 Cl10 -147.7(2) . . . . ?
 B4 B9 B10 B1 -0.1(3) . . . . ?
 B4 B9 B10 B5 -37.9(2) . . . . ?
 B4 B9 B10 B6 63.1(3) . . . . ?
 B4 B9 B10 B11 100.3(2) . . . . ?
 B4 B9 B11 Cl11 147.3(2) . . . . ?
 B4 B9 B11 B6 -63.9(3) . . . . ?
 B4 B9 B11 B7 -0.3(3) . . . . ?
 B4 B9 B11 B8 37.1(2) . . . . ?
 B4 B9 B11 B10 -101.3(2) . . . . ?
 B5 C19 B1 Cl1 108.4(3) . . . . ?
 B5 C19 B1 B2 -142.8(2) . . . . ?
 B5 C19 B1 B6 -102.9(2) . . . . ?
 B5 C19 B1 B10 -39.9(2) . . . . ?
 B5 C19 B2 Cl2 143.7(2) . . . . ?
 B5 C19 B2 B1 36.4(2) . . . . ?
 B5 C19 B2 B3 -106.5(2) . . . . ?
 B5 C19 B2 B6 -3.6(3) . . . . ?
 B5 C19 B2 B7 -66.3(3) . . . . ?
 B5 C19 B3 Cl3 -144.6(2) . . . . ?
 B5 C19 B3 B2 106.4(2) . . . . ?
 B5 C19 B3 B4 -36.2(2) . . . . ?
 B5 C19 B3 B7 66.1(3) . . . . ?
 B5 C19 B3 B8 3.4(3) . . . . ?
 B5 C19 B4 Cl4 -110.7(3) . . . . ?
 B5 C19 B4 B3 143.0(2) . . . . ?
 B5 C19 B4 B8 103.2(2) . . . . ?
 B5 C19 B4 B9 39.9(2) . . . . ?
 B5 B1 B2 Cl2 -143.5(2) . . . . ?
 B5 B1 B2 C19 -32.8(2) . . . . ?
 B5 B1 B2 B3 0.2(3) . . . . ?
 B5 B1 B2 B6 101.2(2) . . . . ?
 B5 B1 B2 B7 63.6(3) . . . . ?
 B5 B1 B6 Cl6 148.8(2) . . . . ?
 B5 B1 B6 B2 -100.4(2) . . . . ?
 B5 B1 B6 B7 -63.1(3) . . . . ?
 B5 B1 B6 B10 37.7(2) . . . . ?
 B5 B1 B6 B11 0.3(3) . . . . ?
 B5 B1 B10 Cl10 111.3(3) . . . . ?
 B5 B1 B10 B6 -137.9(2) . . . . ?
 B5 B1 B10 B9 -37.3(2) . . . . ?
 B5 B1 B10 B11 -100.5(2) . . . . ?
 B5 B4 B8 Cl8 -148.0(2) . . . . ?
 B5 B4 B8 B3 100.7(2) . . . . ?
 B5 B4 B8 B7 63.1(3) . . . . ?
 B5 B4 B8 B9 -37.2(2) . . . . ?
 B5 B4 B8 B11 -0.1(3) . . . . ?
 B5 B4 B9 Cl9 -110.1(3) . . . . ?
 B5 B4 B9 B8 138.5(2) . . . . ?
 B5 B4 B9 B10 37.6(2) . . . . ?
 B5 B4 B9 B11 101.2(2) . . . . ?
 B5 B9 B10 Cl10 -109.9(3) . . . . ?
 B5 B9 B10 B1 37.8(2) . . . . ?
 B5 B9 B10 B6 101.0(2) . . . . ?
 B5 B9 B10 B11 138.1(2) . . . . ?
 B5 B9 B11 Cl11 -148.7(2) . . . . ?
 B5 B9 B11 B6 0.0(3) . . . . ?
 B5 B9 B11 B7 63.6(3) . . . . ?
 B5 B9 B11 B8 101.0(2) . . . . ?
 B5 B9 B11 B10 -37.4(2) . . . . ?
 B5 B10 B11 Cl11 147.1(2) . . . . ?
 B5 B10 B11 B6 -101.2(2) . . . . ?
 B5 B10 B11 B7 -63.9(3) . . . . ?
 B5 B10 B11 B8 -0.3(3) . . . . ?
 B5 B10 B11 B9 37.1(2) . . . . ?
 B6 B1 B2 Cl2 115.3(2) . . . . ?
 B6 B1 B2 C19 -134.0(2) . . . . ?
 B6 B1 B2 B3 -101.0(2) . . . . ?
 B6 B1 B2 B7 -37.6(2) . . . . ?
 B6 B1 B5 Cl5 -153.4(2) . . . . ?
 B6 B1 B5 C19 96.0(2) . . . . ?
 B6 B1 B5 B4 62.9(3) . . . . ?
 B6 B1 B5 B9 -0.3(3) . . . . ?
 B6 B1 B5 B10 -38.1(2) . . . . ?
 B6 B1 B10 Cl10 -110.8(3) . . . . ?
 B6 B1 B10 B5 137.9(2) . . . . ?
 B6 B1 B10 B9 100.5(2) . . . . ?
 B6 B1 B10 B11 37.3(2) . . . . ?
 B6 B2 B3 Cl3 153.1(2) . . . . ?
 B6 B2 B3 C19 -96.3(2) . . . . ?
 B6 B2 B3 B4 -63.4(3) . . . . ?
 B6 B2 B3 B7 37.5(2) . . . . ?
 B6 B2 B3 B8 -0.5(3) . . . . ?
 B6 B2 B7 Cl7 111.1(3) . . . . ?
 B6 B2 B7 B3 -138.4(2) . . . . ?
 B6 B2 B7 B8 -101.1(2) . . . . ?
 B6 B2 B7 B11 -37.7(2) . . . . ?
 B6 B7 B8 Cl8 149.6(2) . . . . ?
 B6 B7 B8 B3 -100.6(2) . . . . ?
 B6 B7 B8 B4 -62.6(3) . . . . ?
 B6 B7 B8 B9 0.2(3) . . . . ?
 B6 B7 B8 B11 37.3(2) . . . . ?
 B6 B7 B11 Cl11 111.7(3) . . . . ?
 B6 B7 B11 B8 -138.3(2) . . . . ?
 B6 B7 B11 B9 -100.9(2) . . . . ?
 B6 B7 B11 B10 -37.3(2) . . . . ?
 B6 B10 B11 Cl11 -111.7(3) . . . . ?
 B6 B10 B11 B7 37.3(2) . . . . ?
 B6 B10 B11 B8 100.9(2) . . . . ?
 B6 B10 B11 B9 138.3(2) . . . . ?
 B7 B2 B3 Cl3 115.6(3) . . . . ?
 B7 B2 B3 C19 -133.7(2) . . . . ?
 B7 B2 B3 B4 -100.8(2) . . . . ?
 B7 B2 B3 B8 -37.9(2) . . . . ?
 B7 B2 B6 Cl6 -111.1(3) . . . . ?
 B7 B2 B6 B1 138.2(2) . . . . ?
 B7 B2 B6 B10 101.1(2) . . . . ?
 B7 B2 B6 B11 37.7(2) . . . . ?
 B7 B3 B4 Cl4 151.4(2) . . . . ?
 B7 B3 B4 C19 -96.4(2) . . . . ?
 B7 B3 B4 B5 -63.7(3) . . . . ?
 B7 B3 B4 B8 37.9(2) . . . . ?
 B7 B3 B4 B9 -0.4(3) . . . . ?
 B7 B3 B8 Cl8 112.9(3) . . . . ?
 B7 B3 B8 B4 -137.9(2) . . . . ?
 B7 B3 B8 B9 -100.4(2) . . . . ?
 B7 B3 B8 B11 -37.4(2) . . . . ?
 B7 B6 B10 Cl10 -149.8(2) . . . . ?
 B7 B6 B10 B1 100.8(2) . . . . ?
 B7 B6 B10 B5 62.9(3) . . . . ?
 B7 B6 B10 B9 0.0(3) . . . . ?
 B7 B6 B10 B11 -37.2(2) . . . . ?
 B7 B6 B11 Cl11 -110.6(3) . . . . ?
 B7 B6 B11 B8 37.3(2) . . . . ?
 B7 B6 B11 B9 101.1(2) . . . . ?
 B7 B6 B11 B10 138.4(2) . . . . ?
 B7 B8 B9 Cl9 148.9(2) . . . . ?
 B7 B8 B9 B4 -101.0(2) . . . . ?
 B7 B8 B9 B5 -63.7(3) . . . . ?
 B7 B8 B9 B10 -0.2(3) . . . . ?
 B7 B8 B9 B11 37.1(2) . . . . ?
 B7 B8 B11 Cl11 111.1(3) . . . . ?
 B7 B8 B11 B6 -37.3(2) . . . . ?
 B7 B8 B11 B9 -138.3(2) . . . . ?
 B7 B8 B11 B10 -101.0(2) . . . . ?
 B8 B3 B4 Cl4 113.5(2) . . . . ?
 B8 B3 B4 C19 -134.3(2) . . . . ?
 B8 B3 B4 B5 -101.6(2) . . . . ?
 B8 B3 B4 B9 -38.3(2) . . . . ?
 B8 B3 B7 Cl7 -111.0(3) . . . . ?
 B8 B3 B7 B2 138.0(2) . . . . ?
 B8 B3 B7 B6 100.9(2) . . . . ?
 B8 B3 B7 B11 37.6(2) . . . . ?
 B8 B4 B5 Cl5 152.6(2) . . . . ?
 B8 B4 B5 C19 -96.2(2) . . . . ?
 B8 B4 B5 B1 -63.1(3) . . . . ?
 B8 B4 B5 B9 37.8(2) . . . . ?
 B8 B4 B5 B10 -0.1(3) . . . . ?
 B8 B4 B9 Cl9 111.4(2) . . . . ?
 B8 B4 B9 B5 -138.5(2) . . . . ?
 B8 B4 B9 B10 -100.9(2) . . . . ?
 B8 B4 B9 B11 -37.3(2) . . . . ?
 B8 B7 B11 Cl11 -109.9(3) . . . . ?
 B8 B7 B11 B6 138.3(2) . . . . ?
 B8 B7 B11 B9 37.5(2) . . . . ?
 B8 B7 B11 B10 101.0(2) . . . . ?
 B8 B9 B10 Cl10 149.3(2) . . . . ?
 B8 B9 B10 B1 -63.0(3) . . . . ?
 B8 B9 B10 B5 -100.8(2) . . . . ?
 B8 B9 B10 B6 0.2(3) . . . . ?
 B8 B9 B10 B11 37.3(2) . . . . ?
 B8 B9 B11 Cl11 110.3(2) . . . . ?
 B8 B9 B11 B6 -101.0(2) . . . . ?
 B8 B9 B11 B7 -37.4(2) . . . . ?
 B8 B9 B11 B10 -138.4(2) . . . . ?
 B9 B4 B5 Cl5 114.8(3) . . . . ?
 B9 B4 B5 C19 -134.0(2) . . . . ?
 B9 B4 B5 B1 -100.8(2) . . . . ?
 B9 B4 B5 B10 -37.9(2) . . . . ?
 B9 B4 B8 Cl8 -110.8(2) . . . . ?
 B9 B4 B8 B3 137.8(2) . . . . ?
 B9 B4 B8 B7 100.2(2) . . . . ?
 B9 B4 B8 B11 37.1(2) . . . . ?
 B9 B5 B10 Cl10 112.4(2) . . . . ?
 B9 B5 B10 B1 -138.0(2) . . . . ?
 B9 B5 B10 B6 -100.4(2) . . . . ?
 B9 B5 B10 B11 -37.2(2) . . . . ?
 B9 B8 B11 Cl11 -110.5(3) . . . . ?
 B9 B8 B11 B6 101.0(2) . . . . ?
 B9 B8 B11 B7 138.3(2) . . . . ?
 B9 B8 B11 B10 37.3(2) . . . . ?
 B9 B10 B11 Cl11 110.0(3) . . . . ?
 B9 B10 B11 B6 -138.3(2) . . . . ?
 B9 B10 B11 B7 -101.0(2) . . . . ?
 B9 B10 B11 B8 -37.4(2) . . . . ?
 B10 B1 B2 Cl2 153.2(2) . . . . ?
 B10 B1 B2 C19 -96.1(2) . . . . ?
 B10 B1 B2 B3 -63.1(3) . . . . ?
 B10 B1 B2 B6 37.9(2) . . . . ?
 B10 B1 B2 B7 0.3(3) . . . . ?
 B10 B1 B5 Cl5 -115.3(3) . . . . ?
 B10 B1 B5 C19 134.1(2) . . . . ?
 B10 B1 B5 B4 101.0(2) . . . . ?
 B10 B1 B5 B9 37.8(2) . . . . ?
 B10 B1 B6 Cl6 111.1(3) . . . . ?
 B10 B1 B6 B2 -138.1(2) . . . . ?
 B10 B1 B6 B7 -100.8(2) . . . . ?
 B10 B1 B6 B11 -37.4(2) . . . . ?
 B10 B5 B9 Cl9 -111.0(2) . . . . ?
 B10 B5 B9 B4 138.0(2) . . . . ?
 B10 B5 B9 B8 101.1(2) . . . . ?
 B10 B5 B9 B11 37.5(2) . . . . ?
 B10 B6 B7 Cl7 148.9(2) . . . . ?
 B10 B6 B7 B2 -100.4(2) . . . . ?
 B10 B6 B7 B3 -63.2(3) . . . . ?
 B10 B6 B7 B8 -0.1(3) . . . . ?
 B10 B6 B7 B11 37.2(2) . . . . ?
 B10 B6 B11 Cl11 111.0(3) . . . . ?
 B10 B6 B11 B7 -138.4(2) . . . . ?
 B10 B6 B11 B8 -101.1(2) . . . . ?
 B10 B6 B11 B9 -37.3(2) . . . . ?
 B10 B9 B11 Cl11 -111.4(3) . . . . ?
 B10 B9 B11 B6 37.4(2) . . . . ?
 B10 B9 B11 B7 101.0(2) . . . . ?
 B10 B9 B11 B8 138.4(2) . . . . ?
 B11 B6 B7 Cl7 111.7(3) . . . . ?
 B11 B6 B7 B2 -137.7(2) . . . . ?
 B11 B6 B7 B3 -100.5(2) . . . . ?
 B11 B6 B7 B8 -37.3(2) . . . . ?
 B11 B6 B10 Cl10 -112.6(3) . . . . ?
 B11 B6 B10 B1 138.0(2) . . . . ?
 B11 B6 B10 B5 100.1(2) . . . . ?
 B11 B6 B10 B9 37.2(2) . . . . ?
 B11 B7 B8 Cl8 112.4(3) . . . . ?
 B11 B7 B8 B3 -137.9(2) . . . . ?
 B11 B7 B8 B4 -99.9(2) . . . . ?
 B11 B7 B8 B9 -37.0(2) . . . . ?
 B11 B8 B9 Cl9 111.8(3) . . . . ?
 B11 B8 B9 B4 -138.2(2) . . . . ?
 B11 B8 B9 B5 -100.8(2) . . . . ?
 B11 B8 B9 B10 -37.4(2) . . . . ?
 B11 B9 B10 Cl10 112.0(3) . . . . ?
 B11 B9 B10 B1 -100.3(2) . . . . ?
 B11 B9 B10 B5 -138.1(2) . . . . ?
 B11 B9 B10 B6 -37.1(2) . . . . ?
 Cl12 B12 B13 Cl13 1.4(4) . . . . ?
 Cl12 B12 B13 C20 -109.0(2) . . . . ?
 Cl12 B12 B13 B14 -141.6(2) . . . . ?
 Cl12 B12 B13 B17 117.2(3) . . . . ?
 Cl12 B12 B13 B18 154.9(2) . . . . ?
 Cl12 B12 B16 Cl16 -2.4(4) . . . . ?
 Cl12 B12 B16 C20 108.6(3) . . . . ?
 Cl12 B12 B16 B15 141.5(2) . . . . ?
 Cl12 B12 B16 B20 -155.7(2) . . . . ?
 Cl12 B12 B16 B21 -117.8(3) . . . . ?
 Cl12 B12 B17 Cl17 5.4(4) . . . . ?
 Cl12 B12 B17 B13 -105.8(3) . . . . ?
 Cl12 B12 B17 B18 -142.9(2) . . . . ?
 Cl12 B12 B17 B21 116.1(3) . . . . ?
 Cl12 B12 B17 B22 153.8(2) . . . . ?
 Cl12 B12 B21 Cl21 -4.7(4) . . . . ?
 Cl12 B12 B21 B16 106.6(3) . . . . ?
 Cl12 B12 B21 B17 -115.0(3) . . . . ?
 Cl12 B12 B21 B20 144.2(2) . . . . ?
 Cl12 B12 B21 B22 -152.7(2) . . . . ?
 Cl13 B13 B14 Cl14 -0.2(4) . . . . ?
 Cl13 B13 B14 C20 -110.4(2) . . . . ?
 Cl13 B13 B14 B15 -143.4(2) . . . . ?
 Cl13 B13 B14 B18 115.5(3) . . . . ?
 Cl13 B13 B14 B19 152.9(2) . . . . ?
 Cl13 B13 B17 Cl17 -3.4(4) . . . . ?
 Cl13 B13 B17 B12 107.7(3) . . . . ?
 Cl13 B13 B17 B18 -114.0(3) . . . . ?
 Cl13 B13 B17 B21 144.9(2) . . . . ?
 Cl13 B13 B17 B22 -151.7(2) . . . . ?
 Cl13 B13 B18 Cl18 3.8(4) . . . . ?
 Cl13 B13 B18 B14 -107.8(3) . . . . ?
 Cl13 B13 B18 B17 114.6(3) . . . . ?
 Cl13 B13 B18 B19 -144.6(2) . . . . ?
 Cl13 B13 B18 B22 152.3(2) . . . . ?
 Cl14 B14 B15 Cl15 -0.8(3) . . . . ?
 Cl14 B14 B15 C20 -110.9(2) . . . . ?
 Cl14 B14 B15 B16 -143.4(2) . . . . ?
 Cl14 B14 B15 B19 114.9(3) . . . . ?
 Cl14 B14 B15 B20 153.0(2) . . . . ?
 Cl14 B14 B18 Cl18 -1.4(4) . . . . ?
 Cl14 B14 B18 B13 108.2(3) . . . . ?
 Cl14 B14 B18 B17 146.1(2) . . . . ?
 Cl14 B14 B18 B19 -113.1(3) . . . . ?
 Cl14 B14 B18 B22 -150.8(2) . . . . ?
 Cl14 B14 B19 Cl19 3.8(4) . . . . ?
 Cl14 B14 B19 B15 -107.1(3) . . . . ?
 Cl14 B14 B19 B18 115.2(3) . . . . ?
 Cl14 B14 B19 B20 -144.2(2) . . . . ?
 Cl14 B14 B19 B22 153.0(2) . . . . ?
 Cl15 B15 B16 Cl16 1.4(3) . . . . ?
 Cl15 B15 B16 C20 -109.5(2) . . . . ?
 Cl15 B15 B16 B12 -142.4(2) . . . . ?
 Cl15 B15 B16 B20 116.8(3) . . . . ?
 Cl15 B15 B16 B21 154.8(2) . . . . ?
 Cl15 B15 B19 Cl19 -4.6(4) . . . . ?
 Cl15 B15 B19 B14 106.4(3) . . . . ?
 Cl15 B15 B19 B18 143.9(2) . . . . ?
 Cl15 B15 B19 B20 -115.7(3) . . . . ?
 Cl15 B15 B19 B22 -153.2(2) . . . . ?
 Cl15 B15 B20 Cl20 2.8(4) . . . . ?
 Cl15 B15 B20 B16 -107.6(3) . . . . ?
 Cl15 B15 B20 B19 113.7(3) . . . . ?
 Cl15 B15 B20 B21 -145.2(2) . . . . ?
 Cl15 B15 B20 B22 151.4(2) . . . . ?
 Cl16 B16 B20 Cl20 -3.5(4) . . . . ?
 Cl16 B16 B20 B15 108.0(3) . . . . ?
 Cl16 B16 B20 B19 145.1(2) . . . . ?
 Cl16 B16 B20 B21 -114.3(3) . . . . ?
 Cl16 B16 B20 B22 -151.5(2) . . . . ?
 Cl16 B16 B21 Cl21 3.8(4) . . . . ?
 Cl16 B16 B21 B12 -107.9(3) . . . . ?
 Cl16 B16 B21 B17 -145.2(2) . . . . ?
 Cl16 B16 B21 B20 114.3(3) . . . . ?
 Cl16 B16 B21 B22 151.4(2) . . . . ?
 Cl17 B17 B18 Cl18 -1.3(4) . . . . ?
 Cl17 B17 B18 B13 -110.9(3) . . . . ?
 Cl17 B17 B18 B14 -149.0(2) . . . . ?
 Cl17 B17 B18 B19 148.0(2) . . . . ?
 Cl17 B17 B18 B22 111.4(3) . . . . ?
 Cl17 B17 B21 Cl21 -0.8(4) . . . . ?
 Cl17 B17 B21 B12 110.8(3) . . . . ?
 Cl17 B17 B21 B16 148.5(2) . . . . ?
 Cl17 B17 B21 B20 -148.3(2) . . . . ?
 Cl17 B17 B21 B22 -111.5(3) . . . . ?
 Cl17 B17 B22 Cl22 0.5(4) . . . . ?
 Cl17 B17 B22 B18 -110.9(3) . . . . ?
 Cl17 B17 B22 B19 -147.9(2) . . . . ?
 Cl17 B17 B22 B20 147.9(2) . . . . ?
 Cl17 B17 B22 B21 110.7(3) . . . . ?
 Cl18 B18 B19 Cl19 0.2(4) . . . . ?
 Cl18 B18 B19 B14 -110.4(3) . . . . ?
 Cl18 B18 B19 B15 -148.1(2) . . . . ?
 Cl18 B18 B19 B20 149.5(2) . . . . ?
 Cl18 B18 B19 B22 112.2(3) . . . . ?
 Cl18 B18 B22 Cl22 -1.0(4) . . . . ?
 Cl18 B18 B22 B17 109.8(3) . . . . ?
 Cl18 B18 B22 B19 -111.2(3) . . . . ?
 Cl18 B18 B22 B20 -149.2(2) . . . . ?
 Cl18 B18 B22 B21 147.0(2) . . . . ?
 Cl19 B19 B20 Cl20 0.6(4) . . . . ?
 Cl19 B19 B20 B15 -110.4(3) . . . . ?
 Cl19 B19 B20 B16 -147.7(2) . . . . ?
 Cl19 B19 B20 B21 149.0(2) . . . . ?
 Cl19 B19 B20 B22 112.0(3) . . . . ?
 Cl19 B19 B22 Cl22 -0.6(4) . . . . ?
 Cl19 B19 B22 B17 148.0(2) . . . . ?
 Cl19 B19 B22 B18 111.1(3) . . . . ?
 Cl19 B19 B22 B20 -110.9(3) . . . . ?
 Cl19 B19 B22 B21 -148.2(2) . . . . ?
 Cl20 B20 B21 Cl21 0.9(4) . . . . ?
 Cl20 B20 B21 B12 -148.1(2) . . . . ?
 Cl20 B20 B21 B16 -110.2(3) . . . . ?
 Cl20 B20 B21 B17 148.4(2) . . . . ?
 Cl20 B20 B21 B22 111.5(3) . . . . ?
 Cl20 B20 B22 Cl22 0.2(4) . . . . ?
 Cl20 B20 B22 B17 -147.5(2) . . . . ?
 Cl20 B20 B22 B18 148.8(2) . . . . ?
 Cl20 B20 B22 B19 110.9(3) . . . . ?
 Cl20 B20 B22 B21 -110.5(3) . . . . ?
 Cl21 B21 B22 Cl22 0.5(4) . . . . ?
 Cl21 B21 B22 B17 -110.6(3) . . . . ?
 Cl21 B21 B22 B18 -147.9(2) . . . . ?
 Cl21 B21 B22 B19 148.1(2) . . . . ?
 Cl21 B21 B22 B20 110.7(3) . . . . ?
 C20 B12 B13 Cl13 110.4(3) . . . . ?
 C20 B12 B13 B14 -32.6(2) . . . . ?
 C20 B12 B13 B17 -133.8(2) . . . . ?
 C20 B12 B13 B18 -96.1(2) . . . . ?
 C20 B12 B16 Cl16 -111.0(3) . . . . ?
 C20 B12 B16 B15 32.9(2) . . . . ?
 C20 B12 B16 B20 95.7(2) . . . . ?
 C20 B12 B16 B21 133.6(2) . . . . ?
 C20 B12 B17 Cl17 150.8(2) . . . . ?
 C20 B12 B17 B13 39.6(2) . . . . ?
 C20 B12 B17 B18 2.6(3) . . . . ?
 C20 B12 B17 B21 -98.5(2) . . . . ?
 C20 B12 B17 B22 -60.8(3) . . . . ?
 C20 B12 B21 Cl21 -151.0(2) . . . . ?
 C20 B12 B21 B16 -39.7(2) . . . . ?
 C20 B12 B21 B17 98.7(2) . . . . ?
 C20 B12 B21 B20 -2.1(3) . . . . ?
 C20 B12 B21 B22 61.0(3) . . . . ?
 C20 B13 B14 Cl14 110.2(3) . . . . ?
 C20 B13 B14 B15 -33.1(2) . . . . ?
 C20 B13 B14 B18 -134.1(2) . . . . ?
 C20 B13 B14 B19 -96.7(2) . . . . ?
 C20 B13 B17 Cl17 -150.5(2) . . . . ?
 C20 B13 B17 B12 -39.4(2) . . . . ?
 C20 B13 B17 B18 98.9(2) . . . . ?
 C20 B13 B17 B21 -2.2(3) . . . . ?
 C20 B13 B17 B22 61.2(3) . . . . ?
 C20 B13 B18 Cl18 150.7(2) . . . . ?
 C20 B13 B18 B14 39.2(2) . . . . ?
 C20 B13 B18 B17 -98.5(2) . . . . ?
 C20 B13 B18 B19 2.3(3) . . . . ?
 C20 B13 B18 B22 -60.8(3) . . . . ?
 C20 B14 B15 Cl15 110.1(2) . . . . ?
 C20 B14 B15 B16 -32.5(2) . . . . ?
 C20 B14 B15 B19 -134.3(2) . . . . ?
 C20 B14 B15 B20 -96.1(2) . . . . ?
 C20 B14 B18 Cl18 -149.0(2) . . . . ?
 C20 B14 B18 B13 -39.3(2) . . . . ?
 C20 B14 B18 B17 -1.5(3) . . . . ?
 C20 B14 B18 B19 99.3(2) . . . . ?
 C20 B14 B18 B22 61.7(3) . . . . ?
 C20 B14 B19 Cl19 150.2(2) . . . . ?
 C20 B14 B19 B15 39.3(2) . . . . ?
 C20 B14 B19 B18 -98.4(2) . . . . ?
 C20 B14 B19 B20 2.2(3) . . . . ?
 C20 B14 B19 B22 -60.6(3) . . . . ?
 C20 B15 B16 Cl16 111.0(3) . . . . ?
 C20 B15 B16 B12 -32.8(2) . . . . ?
 C20 B15 B16 B20 -133.7(2) . . . . ?
 C20 B15 B16 B21 -95.7(2) . . . . ?
 C20 B15 B19 Cl19 -150.2(2) . . . . ?
 C20 B15 B19 B14 -39.2(2) . . . . ?
 C20 B15 B19 B18 -1.7(3) . . . . ?
 C20 B15 B19 B20 98.7(2) . . . . ?
 C20 B15 B19 B22 61.3(3) . . . . ?
 C20 B15 B20 Cl20 150.1(2) . . . . ?
 C20 B15 B20 B16 39.7(2) . . . . ?
 C20 B15 B20 B19 -99.0(2) . . . . ?
 C20 B15 B20 B21 2.0(3) . . . . ?
 C20 B15 B20 B22 -61.3(3) . . . . ?
 C20 B16 B20 Cl20 -151.0(2) . . . . ?
 C20 B16 B20 B15 -39.5(2) . . . . ?
 C20 B16 B20 B19 -2.4(3) . . . . ?
 C20 B16 B20 B21 98.3(2) . . . . ?
 C20 B16 B20 B22 61.0(3) . . . . ?
 C20 B16 B21 Cl21 151.1(2) . . . . ?
 C20 B16 B21 B12 39.4(2) . . . . ?
 C20 B16 B21 B17 2.0(3) . . . . ?
 C20 B16 B21 B20 -98.4(2) . . . . ?
 C20 B16 B21 B22 -61.4(3) . . . . ?
 B12 C20 B13 Cl13 -108.6(3) . . . . ?
 B12 C20 B13 B14 142.9(2) . . . . ?
 B12 C20 B13 B17 40.2(2) . . . . ?
 B12 C20 B13 B18 103.0(2) . . . . ?
 B12 C20 B14 Cl14 -145.9(2) . . . . ?
 B12 C20 B14 B13 -36.3(2) . . . . ?
 B12 C20 B14 B15 106.4(2) . . . . ?
 B12 C20 B14 B18 3.4(3) . . . . ?
 B12 C20 B14 B19 66.4(3) . . . . ?
 B12 C20 B15 Cl15 145.9(2) . . . . ?
 B12 C20 B15 B14 -106.6(3) . . . . ?
 B12 C20 B15 B16 36.7(2) . . . . ?
 B12 C20 B15 B19 -66.8(3) . . . . ?
 B12 C20 B15 B20 -3.7(3) . . . . ?
 B12 C20 B16 Cl16 108.5(3) . . . . ?
 B12 C20 B16 B15 -142.6(2) . . . . ?
 B12 C20 B16 B20 -102.6(2) . . . . ?
 B12 C20 B16 B21 -40.0(2) . . . . ?
 B12 B13 B14 Cl14 142.8(2) . . . . ?
 B12 B13 B14 C20 32.6(2) . . . . ?
 B12 B13 B14 B15 -0.4(3) . . . . ?
 B12 B13 B14 B18 -101.5(2) . . . . ?
 B12 B13 B14 B19 -64.1(3) . . . . ?
 B12 B13 B17 Cl17 -111.0(3) . . . . ?
 B12 B13 B17 B18 138.3(2) . . . . ?
 B12 B13 B17 B21 37.3(2) . . . . ?
 B12 B13 B17 B22 100.6(2) . . . . ?
 B12 B13 B18 Cl18 -148.1(2) . . . . ?
 B12 B13 B18 B14 100.3(2) . . . . ?
 B12 B13 B18 B17 -37.4(2) . . . . ?
 B12 B13 B18 B19 63.4(3) . . . . ?
 B12 B13 B18 B22 0.3(3) . . . . ?
 B12 B16 B20 Cl20 148.2(2) . . . . ?
 B12 B16 B20 B15 -100.2(2) . . . . ?
 B12 B16 B20 B19 -63.1(3) . . . . ?
 B12 B16 B20 B21 37.5(2) . . . . ?
 B12 B16 B20 B22 0.3(3) . . . . ?
 B12 B16 B21 Cl21 111.7(3) . . . . ?
 B12 B16 B21 B17 -37.4(2) . . . . ?
 B12 B16 B21 B20 -137.8(2) . . . . ?
 B12 B16 B21 B22 -100.8(2) . . . . ?
 B12 B17 B18 Cl18 147.0(2) . . . . ?
 B12 B17 B18 B13 37.4(2) . . . . ?
 B12 B17 B18 B14 -0.7(3) . . . . ?
 B12 B17 B18 B19 -63.7(3) . . . . ?
 B12 B17 B18 B22 -100.3(2) . . . . ?
 B12 B17 B21 Cl21 -111.6(3) . . . . ?
 B12 B17 B21 B16 37.6(2) . . . . ?
 B12 B17 B21 B20 100.9(2) . . . . ?
 B12 B17 B21 B22 137.7(2) . . . . ?
 B12 B17 B22 Cl22 -147.7(2) . . . . ?
 B12 B17 B22 B18 100.9(2) . . . . ?
 B12 B17 B22 B19 63.9(3) . . . . ?
 B12 B17 B22 B20 -0.3(3) . . . . ?
 B12 B17 B22 B21 -37.5(2) . . . . ?
 B12 B21 B22 Cl22 148.8(2) . . . . ?
 B12 B21 B22 B17 37.7(2) . . . . ?
 B12 B21 B22 B18 0.5(3) . . . . ?
 B12 B21 B22 B19 -63.6(3) . . . . ?
 B12 B21 B22 B20 -101.0(2) . . . . ?
 B13 C20 B12 Cl12 108.0(3) . . . . ?
 B13 C20 B12 B16 -142.9(2) . . . . ?
 B13 C20 B12 B17 -40.1(2) . . . . ?
 B13 C20 B12 B21 -102.7(2) . . . . ?
 B13 C20 B14 Cl14 -109.6(3) . . . . ?
 B13 C20 B14 B15 142.7(2) . . . . ?
 B13 C20 B14 B18 39.7(2) . . . . ?
 B13 C20 B14 B19 102.7(2) . . . . ?
 B13 C20 B15 Cl15 -144.0(2) . . . . ?
 B13 C20 B15 B14 -36.5(2) . . . . ?
 B13 C20 B15 B16 106.8(3) . . . . ?
 B13 C20 B15 B19 3.4(3) . . . . ?
 B13 C20 B15 B20 66.5(3) . . . . ?
 B13 C20 B16 Cl16 144.9(2) . . . . ?
 B13 C20 B16 B12 36.3(2) . . . . ?
 B13 C20 B16 B15 -106.2(3) . . . . ?
 B13 C20 B16 B20 -66.3(3) . . . . ?
 B13 C20 B16 B21 -3.7(3) . . . . ?
 B13 B12 B16 Cl16 -143.8(2) . . . . ?
 B13 B12 B16 C20 -32.8(2) . . . . ?
 B13 B12 B16 B15 0.1(3) . . . . ?
 B13 B12 B16 B20 62.9(3) . . . . ?
 B13 B12 B16 B21 100.8(2) . . . . ?
 B13 B12 B17 Cl17 111.2(3) . . . . ?
 B13 B12 B17 B18 -37.0(2) . . . . ?
 B13 B12 B17 B21 -138.1(2) . . . . ?
 B13 B12 B17 B22 -100.4(2) . . . . ?
 B13 B12 B21 Cl21 147.8(2) . . . . ?
 B13 B12 B21 B16 -101.0(3) . . . . ?
 B13 B12 B21 B17 37.4(2) . . . . ?
 B13 B12 B21 B20 -63.4(3) . . . . ?
 B13 B12 B21 B22 -0.3(3) . . . . ?
 B13 B14 B15 Cl15 143.1(2) . . . . ?
 B13 B14 B15 C20 33.0(2) . . . . ?
 B13 B14 B15 B16 0.5(3) . . . . ?
 B13 B14 B15 B19 -101.3(2) . . . . ?
 B13 B14 B15 B20 -63.1(3) . . . . ?
 B13 B14 B18 Cl18 -109.7(3) . . . . ?
 B13 B14 B18 B17 37.8(2) . . . . ?
 B13 B14 B18 B19 138.6(2) . . . . ?
 B13 B14 B18 B22 101.0(2) . . . . ?
 B13 B14 B19 Cl19 -148.3(2) . . . . ?
 B13 B14 B19 B15 100.8(2) . . . . ?
 B13 B14 B19 B18 -36.9(2) . . . . ?
 B13 B14 B19 B20 63.7(3) . . . . ?
 B13 B14 B19 B22 0.9(3) . . . . ?
 B13 B17 B18 Cl18 109.6(3) . . . . ?
 B13 B17 B18 B14 -38.1(2) . . . . ?
 B13 B17 B18 B19 -101.1(2) . . . . ?
 B13 B17 B18 B22 -137.7(2) . . . . ?
 B13 B17 B21 Cl21 -149.2(2) . . . . ?
 B13 B17 B21 B12 -37.5(2) . . . . ?
 B13 B17 B21 B16 0.1(3) . . . . ?
 B13 B17 B21 B20 63.3(3) . . . . ?
 B13 B17 B21 B22 100.2(2) . . . . ?
 B13 B17 B22 Cl22 148.8(2) . . . . ?
 B13 B17 B22 B18 37.4(2) . . . . ?
 B13 B17 B22 B19 0.4(3) . . . . ?
 B13 B17 B22 B20 -63.8(3) . . . . ?
 B13 B17 B22 B21 -101.0(2) . . . . ?
 B13 B18 B19 Cl19 147.9(2) . . . . ?
 B13 B18 B19 B14 37.3(2) . . . . ?
 B13 B18 B19 B15 -0.4(3) . . . . ?
 B13 B18 B19 B20 -62.8(3) . . . . ?
 B13 B18 B19 B22 -100.1(3) . . . . ?
 B13 B18 B22 Cl22 -148.5(2) . . . . ?
 B13 B18 B22 B17 -37.7(2) . . . . ?
 B13 B18 B22 B19 101.3(2) . . . . ?
 B13 B18 B22 B20 63.4(3) . . . . ?
 B13 B18 B22 B21 -0.5(3) . . . . ?
 B14 C20 B12 Cl12 144.4(2) . . . . ?
 B14 C20 B12 B13 36.3(2) . . . . ?
 B14 C20 B12 B16 -106.6(3) . . . . ?
 B14 C20 B12 B17 -3.8(3) . . . . ?
 B14 C20 B12 B21 -66.4(3) . . . . ?
 B14 C20 B13 Cl13 108.5(3) . . . . ?
 B14 C20 B13 B12 -142.9(2) . . . . ?
 B14 C20 B13 B17 -102.8(2) . . . . ?
 B14 C20 B13 B18 -40.0(2) . . . . ?
 B14 C20 B15 Cl15 -107.5(3) . . . . ?
 B14 C20 B15 B16 143.3(2) . . . . ?
 B14 C20 B15 B19 39.8(2) . . . . ?
 B14 C20 B15 B20 103.0(2) . . . . ?
 B14 C20 B16 Cl16 -144.7(2) . . . . ?
 B14 C20 B16 B12 106.7(3) . . . . ?
 B14 C20 B16 B15 -35.9(2) . . . . ?
 B14 C20 B16 B20 4.1(3) . . . . ?
 B14 C20 B16 B21 66.7(3) . . . . ?
 B14 B13 B17 Cl17 148.6(2) . . . . ?
 B14 B13 B17 B12 -100.4(2) . . . . ?
 B14 B13 B17 B18 37.9(2) . . . . ?
 B14 B13 B17 B21 -63.1(3) . . . . ?
 B14 B13 B17 B22 0.2(3) . . . . ?
 B14 B13 B18 Cl18 111.6(3) . . . . ?
 B14 B13 B18 B17 -137.6(2) . . . . ?
 B14 B13 B18 B19 -36.9(2) . . . . ?
 B14 B13 B18 B22 -100.0(2) . . . . ?
 B14 B15 B16 Cl16 143.5(2) . . . . ?
 B14 B15 B16 C20 32.5(2) . . . . ?
 B14 B15 B16 B12 -0.4(3) . . . . ?
 B14 B15 B16 B20 -101.2(2) . . . . ?
 B14 B15 B16 B21 -63.2(3) . . . . ?
 B14 B15 B19 Cl19 -111.0(3) . . . . ?
 B14 B15 B19 B18 37.5(2) . . . . ?
 B14 B15 B19 B20 137.9(2) . . . . ?
 B14 B15 B19 B22 100.5(2) . . . . ?
 B14 B15 B20 Cl20 -148.7(2) . . . . ?
 B14 B15 B20 B16 100.9(2) . . . . ?
 B14 B15 B20 B19 -37.7(2) . . . . ?
 B14 B15 B20 B21 63.3(3) . . . . ?
 B14 B15 B20 B22 -0.1(3) . . . . ?
 B14 B18 B19 Cl19 110.6(3) . . . . ?
 B14 B18 B19 B15 -37.7(2) . . . . ?
 B14 B18 B19 B20 -100.1(2) . . . . ?
 B14 B18 B19 B22 -137.4(2) . . . . ?
 B14 B18 B22 Cl22 147.8(2) . . . . ?
 B14 B18 B22 B17 -101.4(2) . . . . ?
 B14 B18 B22 B19 37.6(2) . . . . ?
 B14 B18 B22 B20 -0.3(3) . . . . ?
 B14 B18 B22 B21 -64.1(3) . . . . ?
 B14 B19 B20 Cl20 148.5(2) . . . . ?
 B14 B19 B20 B15 37.5(2) . . . . ?
 B14 B19 B20 B16 0.1(3) . . . . ?
 B14 B19 B20 B21 -63.2(3) . . . . ?
 B14 B19 B20 B22 -100.2(2) . . . . ?
 B14 B19 B22 Cl22 -149.4(2) . . . . ?
 B14 B19 B22 B17 -0.8(3) . . . . ?
 B14 B19 B22 B18 -37.7(2) . . . . ?
 B14 B19 B22 B20 100.3(2) . . . . ?
 B14 B19 B22 B21 63.0(3) . . . . ?
 B15 C20 B12 Cl12 -145.6(2) . . . . ?
 B15 C20 B12 B13 106.4(3) . . . . ?
 B15 C20 B12 B16 -36.6(2) . . . . ?
 B15 C20 B12 B17 66.2(3) . . . . ?
 B15 C20 B12 B21 3.7(3) . . . . ?
 B15 C20 B13 Cl13 144.8(2) . . . . ?
 B15 C20 B13 B12 -106.6(3) . . . . ?
 B15 C20 B13 B14 36.4(2) . . . . ?
 B15 C20 B13 B17 -66.4(3) . . . . ?
 B15 C20 B13 B18 -3.6(3) . . . . ?
 B15 C20 B14 Cl14 107.7(3) . . . . ?
 B15 C20 B14 B13 -142.7(2) . . . . ?
 B15 C20 B14 B18 -103.0(2) . . . . ?
 B15 C20 B14 B19 -40.0(2) . . . . ?
 B15 C20 B16 Cl16 -108.9(3) . . . . ?
 B15 C20 B16 B12 142.6(2) . . . . ?
 B15 C20 B16 B20 39.9(2) . . . . ?
 B15 C20 B16 B21 102.6(2) . . . . ?
 B15 B14 B18 Cl18 149.6(2) . . . . ?
 B15 B14 B18 B13 -100.7(2) . . . . ?
 B15 B14 B18 B17 -62.9(3) . . . . ?
 B15 B14 B18 B19 37.9(2) . . . . ?
 B15 B14 B18 B22 0.2(3) . . . . ?
 B15 B14 B19 Cl19 110.9(3) . . . . ?
 B15 B14 B19 B18 -137.7(2) . . . . ?
 B15 B14 B19 B20 -37.1(2) . . . . ?
 B15 B14 B19 B22 -99.9(2) . . . . ?
 B15 B16 B20 Cl20 -111.6(3) . . . . ?
 B15 B16 B20 B19 37.1(2) . . . . ?
 B15 B16 B20 B21 137.7(2) . . . . ?
 B15 B16 B20 B22 100.5(2) . . . . ?
 B15 B16 B21 Cl21 -148.0(2) . . . . ?
 B15 B16 B21 B12 100.3(2) . . . . ?
 B15 B16 B21 B17 63.0(3) . . . . ?
 B15 B16 B21 B20 -37.5(2) . . . . ?
 B15 B16 B21 B22 -0.4(3) . . . . ?
 B15 B19 B20 Cl20 111.0(3) . . . . ?
 B15 B19 B20 B16 -37.4(2) . . . . ?
 B15 B19 B20 B21 -100.6(2) . . . . ?
 B15 B19 B20 B22 -137.7(2) . . . . ?
 B15 B19 B22 Cl22 147.5(2) . . . . ?
 B15 B19 B22 B17 -63.9(3) . . . . ?
 B15 B19 B22 B18 -100.8(2) . . . . ?
 B15 B19 B22 B20 37.2(2) . . . . ?
 B15 B19 B22 B21 -0.1(3) . . . . ?
 B15 B20 B21 Cl21 149.1(2) . . . . ?
 B15 B20 B21 B12 0.0(3) . . . . ?
 B15 B20 B21 B16 38.0(2) . . . . ?
 B15 B20 B21 B17 -63.4(3) . . . . ?
 B15 B20 B21 B22 -100.3(2) . . . . ?
 B15 B20 B22 Cl22 -148.4(2) . . . . ?
 B15 B20 B22 B17 63.9(3) . . . . ?
 B15 B20 B22 B18 0.2(3) . . . . ?
 B15 B20 B22 B19 -37.7(2) . . . . ?
 B15 B20 B22 B21 101.0(2) . . . . ?
 B16 C20 B12 Cl12 -109.0(3) . . . . ?
 B16 C20 B12 B13 142.9(2) . . . . ?
 B16 C20 B12 B17 102.8(2) . . . . ?
 B16 C20 B12 B21 40.2(2) . . . . ?
 B16 C20 B13 Cl13 -145.0(2) . . . . ?
 B16 C20 B13 B12 -36.4(2) . . . . ?
 B16 C20 B13 B14 106.5(3) . . . . ?
 B16 C20 B13 B17 3.8(3) . . . . ?
 B16 C20 B13 B18 66.5(3) . . . . ?
 B16 C20 B14 Cl14 143.6(2) . . . . ?
 B16 C20 B14 B13 -106.8(3) . . . . ?
 B16 C20 B14 B15 35.9(2) . . . . ?
 B16 C20 B14 B18 -67.1(3) . . . . ?
 B16 C20 B14 B19 -4.1(3) . . . . ?
 B16 C20 B15 Cl15 109.2(3) . . . . ?
 B16 C20 B15 B14 -143.3(2) . . . . ?
 B16 C20 B15 B19 -103.5(2) . . . . ?
 B16 C20 B15 B20 -40.3(2) . . . . ?
 B16 B12 B13 Cl13 143.2(2) . . . . ?
 B16 B12 B13 C20 32.8(2) . . . . ?
 B16 B12 B13 B14 0.2(3) . . . . ?
 B16 B12 B13 B17 -101.0(2) . . . . ?
 B16 B12 B13 B18 -63.3(3) . . . . ?
 B16 B12 B17 Cl17 -147.9(2) . . . . ?
 B16 B12 B17 B13 100.9(2) . . . . ?
 B16 B12 B17 B18 63.8(3) . . . . ?
 B16 B12 B17 B21 -37.2(2) . . . . ?
 B16 B12 B17 B22 0.5(3) . . . . ?
 B16 B12 B21 Cl21 -111.3(3) . . . . ?
 B16 B12 B21 B17 138.4(2) . . . . ?
 B16 B12 B21 B20 37.6(2) . . . . ?
 B16 B12 B21 B22 100.7(3) . . . . ?
 B16 B15 B19 Cl19 148.4(2) . . . . ?
 B16 B15 B19 B14 -100.7(2) . . . . ?
 B16 B15 B19 B18 -63.2(3) . . . . ?
 B16 B15 B19 B20 37.2(2) . . . . ?
 B16 B15 B19 B22 -0.2(3) . . . . ?
 B16 B15 B20 Cl20 110.4(3) . . . . ?
 B16 B15 B20 B19 -138.7(2) . . . . ?
 B16 B15 B20 B21 -37.7(2) . . . . ?
 B16 B15 B20 B22 -101.0(2) . . . . ?
 B16 B20 B21 Cl21 111.1(3) . . . . ?
 B16 B20 B21 B12 -38.0(2) . . . . ?
 B16 B20 B21 B17 -101.4(2) . . . . ?
 B16 B20 B21 B22 -138.3(2) . . . . ?
 B16 B20 B22 Cl22 147.8(2) . . . . ?
 B16 B20 B22 B17 0.0(3) . . . . ?
 B16 B20 B22 B18 -63.7(3) . . . . ?
 B16 B20 B22 B19 -101.5(2) . . . . ?
 B16 B20 B22 B21 37.1(2) . . . . ?
 B16 B21 B22 Cl22 -147.2(2) . . . . ?
 B16 B21 B22 B17 101.6(2) . . . . ?
 B16 B21 B22 B18 64.4(3) . . . . ?
 B16 B21 B22 B19 0.3(3) . . . . ?
 B16 B21 B22 B20 -37.0(2) . . . . ?
 B17 B12 B13 Cl13 -115.9(3) . . . . ?
 B17 B12 B13 C20 133.8(2) . . . . ?
 B17 B12 B13 B14 101.2(2) . . . . ?
 B17 B12 B13 B18 37.7(2) . . . . ?
 B17 B12 B16 Cl16 152.9(2) . . . . ?
 B17 B12 B16 C20 -96.1(2) . . . . ?
 B17 B12 B16 B15 -63.2(3) . . . . ?
 B17 B12 B16 B20 -0.5(3) . . . . ?
 B17 B12 B16 B21 37.5(2) . . . . ?
 B17 B12 B21 Cl21 110.4(3) . . . . ?
 B17 B12 B21 B16 -138.4(2) . . . . ?
 B17 B12 B21 B20 -100.8(3) . . . . ?
 B17 B12 B21 B22 -37.7(2) . . . . ?
 B17 B13 B14 Cl14 -153.9(2) . . . . ?
 B17 B13 B14 C20 96.0(2) . . . . ?
 B17 B13 B14 B15 62.9(3) . . . . ?
 B17 B13 B14 B18 -38.1(2) . . . . ?
 B17 B13 B14 B19 -0.7(3) . . . . ?
 B17 B13 B18 Cl18 -110.8(3) . . . . ?
 B17 B13 B18 B14 137.6(2) . . . . ?
 B17 B13 B18 B19 100.8(2) . . . . ?
 B17 B13 B18 B22 37.7(2) . . . . ?
 B17 B18 B19 Cl19 -148.7(2) . . . . ?
 B17 B18 B19 B14 100.7(2) . . . . ?
 B17 B18 B19 B15 63.1(3) . . . . ?
 B17 B18 B19 B20 0.6(3) . . . . ?
 B17 B18 B19 B22 -36.7(2) . . . . ?
 B17 B18 B22 Cl22 -110.8(3) . . . . ?
 B17 B18 B22 B19 139.0(2) . . . . ?
 B17 B18 B22 B20 101.1(2) . . . . ?
 B17 B18 B22 B21 37.2(2) . . . . ?
 B17 B21 B22 Cl22 111.1(3) . . . . ?
 B17 B21 B22 B18 -37.2(2) . . . . ?
 B17 B21 B22 B19 -101.3(2) . . . . ?
 B17 B21 B22 B20 -138.7(2) . . . . ?
 B18 B13 B14 Cl14 -115.7(3) . . . . ?
 B18 B13 B14 C20 134.1(2) . . . . ?
 B18 B13 B14 B15 101.1(2) . . . . ?
 B18 B13 B14 B19 37.4(2) . . . . ?
 B18 B13 B17 Cl17 110.7(3) . . . . ?
 B18 B13 B17 B12 -138.3(2) . . . . ?
 B18 B13 B17 B21 -101.0(2) . . . . ?
 B18 B13 B17 B22 -37.7(2) . . . . ?
 B18 B14 B15 Cl15 -153.9(2) . . . . ?
 B18 B14 B15 C20 96.0(2) . . . . ?
 B18 B14 B15 B16 63.5(3) . . . . ?
 B18 B14 B15 B19 -38.3(2) . . . . ?
 B18 B14 B15 B20 -0.1(3) . . . . ?
 B18 B14 B19 Cl19 -111.4(3) . . . . ?
 B18 B14 B19 B15 137.7(2) . . . . ?
 B18 B14 B19 B20 100.6(2) . . . . ?
 B18 B14 B19 B22 37.8(2) . . . . ?
 B18 B17 B21 Cl21 148.0(2) . . . . ?
 B18 B17 B21 B12 -100.4(2) . . . . ?
 B18 B17 B21 B16 -62.8(3) . . . . ?
 B18 B17 B21 B20 0.4(3) . . . . ?
 B18 B17 B21 B22 37.3(2) . . . . ?
 B18 B17 B22 Cl22 111.4(3) . . . . ?
 B18 B17 B22 B19 -37.1(2) . . . . ?
 B18 B17 B22 B20 -101.2(2) . . . . ?
 B18 B17 B22 B21 -138.4(2) . . . . ?
 B18 B19 B20 Cl20 -148.7(2) . . . . ?
 B18 B19 B20 B15 100.3(2) . . . . ?
 B18 B19 B20 B16 62.9(3) . . . . ?
 B18 B19 B20 B21 -0.4(3) . . . . ?
 B18 B19 B20 B22 -37.4(2) . . . . ?
 B18 B19 B22 Cl22 -111.7(3) . . . . ?
 B18 B19 B22 B17 36.9(2) . . . . ?
 B18 B19 B22 B20 138.0(2) . . . . ?
 B18 B19 B22 B21 100.7(2) . . . . ?
 B19 B14 B15 Cl15 -115.7(3) . . . . ?
 B19 B14 B15 C20 134.3(2) . . . . ?
 B19 B14 B15 B16 101.7(2) . . . . ?
 B19 B14 B15 B20 38.1(2) . . . . ?
 B19 B14 B18 Cl18 111.7(3) . . . . ?
 B19 B14 B18 B13 -138.6(2) . . . . ?
 B19 B14 B18 B17 -100.8(2) . . . . ?
 B19 B14 B18 B22 -37.7(2) . . . . ?
 B19 B15 B16 Cl16 -152.9(2) . . . . ?
 B19 B15 B16 C20 96.1(2) . . . . ?
 B19 B15 B16 B12 63.3(3) . . . . ?
 B19 B15 B16 B20 -37.6(2) . . . . ?
 B19 B15 B16 B21 0.4(3) . . . . ?
 B19 B15 B20 Cl20 -111.0(3) . . . . ?
 B19 B15 B20 B16 138.7(2) . . . . ?
 B19 B15 B20 B21 101.0(2) . . . . ?
 B19 B15 B20 B22 37.7(2) . . . . ?
 B19 B18 B22 Cl22 110.2(3) . . . . ?
 B19 B18 B22 B17 -139.0(2) . . . . ?
 B19 B18 B22 B20 -37.9(2) . . . . ?
 B19 B18 B22 B21 -101.8(2) . . . . ?
 B19 B20 B21 Cl21 -147.5(2) . . . . ?
 B19 B20 B21 B12 63.4(3) . . . . ?
 B19 B20 B21 B16 101.4(2) . . . . ?
 B19 B20 B21 B17 0.0(3) . . . . ?
 B19 B20 B21 B22 -37.0(2) . . . . ?
 B19 B20 B22 Cl22 -110.7(3) . . . . ?
 B19 B20 B22 B17 101.6(2) . . . . ?
 B19 B20 B22 B18 37.9(2) . . . . ?
 B19 B20 B22 B21 138.7(2) . . . . ?
 B20 B15 B16 Cl16 -115.3(3) . . . . ?
 B20 B15 B16 C20 133.7(2) . . . . ?
 B20 B15 B16 B12 100.8(2) . . . . ?
 B20 B15 B16 B21 38.0(2) . . . . ?
 B20 B15 B19 Cl19 111.1(3) . . . . ?
 B20 B15 B19 B14 -137.9(2) . . . . ?
 B20 B15 B19 B18 -100.4(2) . . . . ?
 B20 B15 B19 B22 -37.4(2) . . . . ?
 B20 B16 B21 Cl21 -110.5(3) . . . . ?
 B20 B16 B21 B12 137.8(2) . . . . ?
 B20 B16 B21 B17 100.5(3) . . . . ?
 B20 B16 B21 B22 37.1(2) . . . . ?
 B20 B19 B22 Cl22 110.3(3) . . . . ?
 B20 B19 B22 B17 -101.1(2) . . . . ?
 B20 B19 B22 B18 -138.0(2) . . . . ?
 B20 B19 B22 B21 -37.3(2) . . . . ?
 B20 B21 B22 Cl22 -110.2(3) . . . . ?
 B20 B21 B22 B17 138.7(2) . . . . ?
 B20 B21 B22 B18 101.4(2) . . . . ?
 B20 B21 B22 B19 37.4(2) . . . . ?
 B21 B12 B13 Cl13 -153.5(2) . . . . ?
 B21 B12 B13 C20 96.1(2) . . . . ?
 B21 B12 B13 B14 63.5(3) . . . . ?
 B21 B12 B13 B17 -37.7(2) . . . . ?
 B21 B12 B13 B18 0.0(3) . . . . ?
 B21 B12 B16 Cl16 115.4(3) . . . . ?
 B21 B12 B16 C20 -133.6(2) . . . . ?
 B21 B12 B16 B15 -100.7(2) . . . . ?
 B21 B12 B16 B20 -37.9(2) . . . . ?
 B21 B12 B17 Cl17 -110.7(3) . . . . ?
 B21 B12 B17 B13 138.1(2) . . . . ?
 B21 B12 B17 B18 101.1(2) . . . . ?
 B21 B12 B17 B22 37.7(2) . . . . ?
 B21 B16 B20 Cl20 110.7(3) . . . . ?
 B21 B16 B20 B15 -137.7(2) . . . . ?
 B21 B16 B20 B19 -100.6(2) . . . . ?
 B21 B16 B20 B22 -37.2(2) . . . . ?
 B21 B17 B18 Cl18 -150.0(2) . . . . ?
 B21 B17 B18 B13 100.4(2) . . . . ?
 B21 B17 B18 B14 62.3(3) . . . . ?
 B21 B17 B18 B19 -0.7(3) . . . . ?
 B21 B17 B18 B22 -37.3(2) . . . . ?
 B21 B17 B22 Cl22 -110.2(3) . . . . ?
 B21 B17 B22 B18 138.4(2) . . . . ?
 B21 B17 B22 B19 101.4(2) . . . . ?
 B21 B17 B22 B20 37.2(2) . . . . ?
 B21 B20 B22 Cl22 110.7(3) . . . . ?
 B21 B20 B22 B17 -37.1(2) . . . . ?
 B21 B20 B22 B18 -100.8(2) . . . . ?
 B21 B20 B22 B19 -138.7(2) . . . . ?
 B22 B17 B18 Cl18 -112.7(3) . . . . ?
 B22 B17 B18 B13 137.7(2) . . . . ?
 B22 B17 B18 B14 99.6(2) . . . . ?
 B22 B17 B18 B19 36.6(2) . . . . ?
 B22 B17 B21 Cl21 110.7(3) . . . . ?
 B22 B17 B21 B12 -137.7(2) . . . . ?
 B22 B17 B21 B16 -100.1(2) . . . . ?
 B22 B17 B21 B20 -36.8(2) . . . . ?
 B22 B18 B19 Cl19 -112.0(3) . . . . ?
 B22 B18 B19 B14 137.4(2) . . . . ?
 B22 B18 B19 B15 99.7(2) . . . . ?
 B22 B18 B19 B20 37.3(2) . . . . ?
 B22 B19 B20 Cl20 -111.3(3) . . . . ?
 B22 B19 B20 B15 137.7(2) . . . . ?
 B22 B19 B20 B16 100.3(2) . . . . ?
 B22 B19 B20 B21 37.0(2) . . . . ?
 B22 B20 B21 Cl21 -110.5(3) . . . . ?
 B22 B20 B21 B12 100.4(2) . . . . ?
 B22 B20 B21 B16 138.3(2) . . . . ?
 B22 B20 B21 B17 36.9(2) . . . . ?

_olex2_submission_special_instructions  'No special instructions were received'
