data_1d
  
_audit_creation_method            SHELXL-97 
_chemical_name_systematic 
; 
 ? 
; 
_chemical_name_common             ? 
_chemical_melting_point           ? 
_chemical_formula_moiety 
 'C36 H24 Co N6, Bi3 I11' 
_chemical_formula_sum 
 'C36 H24 Bi3 Co I11 N6' 
_chemical_formula_weight          2622.38 
  
loop_ 
 _atom_type_symbol 
 _atom_type_description 
 _atom_type_scat_dispersion_real 
 _atom_type_scat_dispersion_imag 
 _atom_type_scat_source 
 'C'  'C'   0.0033   0.0016 
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 
 'H'  'H'   0.0000   0.0000 
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 
 'N'  'N'   0.0061   0.0033 
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 
 'Co'  'Co'   0.3494   0.9721 
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 
 'I'  'I'  -0.4742   1.8119 
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 
 'Bi'  'Bi'  -4.1077  10.2566 
 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 
  
_symmetry_cell_setting            Monoclinic 
_symmetry_space_group_name_H-M    'P 21/n' 
_symmetry_space_group_name_Hall   '-P 2yn' 
  
loop_ 
 _symmetry_equiv_pos_as_xyz 
 'x, y, z' 
 '-x+1/2, y+1/2, -z+1/2' 
 '-x, -y, -z' 
 'x-1/2, -y-1/2, z-1/2' 
  
_cell_length_a                    14.9220(6) 
_cell_length_b                    21.1086(9) 
_cell_length_c                    17.3631(7) 
_cell_angle_alpha                 90.00 
_cell_angle_beta                  96.4910(10) 
_cell_angle_gamma                 90.00 
_cell_volume                      5434.0(4) 
_cell_formula_units_Z             4 
_cell_measurement_temperature     150(1) 
_cell_measurement_reflns_used     5352 
_cell_measurement_theta_min       2.262 
_cell_measurement_theta_max       24.102 
  
_exptl_crystal_description        needle 
_exptl_crystal_colour             red 
_exptl_crystal_size_max           0.16 
_exptl_crystal_size_mid           0.04 
_exptl_crystal_size_min           0.02 
_exptl_crystal_density_meas       ? 
_exptl_crystal_density_diffrn     3.205 
_exptl_crystal_density_method     'not measured' 
_exptl_crystal_F_000              4564 
_exptl_absorpt_coefficient_mu     16.267 
_exptl_absorpt_correction_type    multi-scan 
_exptl_absorpt_correction_T_min   0.2369 
_exptl_absorpt_correction_T_max   1.0000 
_exptl_absorpt_process_details    '(SADABS, Bruker, 2001)' 
  
_exptl_special_details 
; 
 ? 
; 
  
_diffrn_ambient_temperature       150(1) 
_diffrn_radiation_wavelength      0.71073 
_diffrn_radiation_type            MoK\a 
_diffrn_radiation_source          'fine-focus sealed tube' 
_diffrn_radiation_monochromator   graphite 
_diffrn_measurement_device_type   'Bruker SMART APEX CCD diffractometer' 
_diffrn_measurement_method        'omega scans' 
_diffrn_detector_area_resol_mean  ? 
_diffrn_standards_number          ? 
_diffrn_standards_interval_count  ? 
_diffrn_standards_interval_time   ? 
_diffrn_standards_decay_%         ?
_diffrn_reflns_number             41273 
_diffrn_reflns_av_R_equivalents   0.0809 
_diffrn_reflns_av_sigmaI/netI     0.0537 
_diffrn_reflns_limit_h_min        -16 
_diffrn_reflns_limit_h_max        16 
_diffrn_reflns_limit_k_min        -22 
_diffrn_reflns_limit_k_max        22 
_diffrn_reflns_limit_l_min        -18 
_diffrn_reflns_limit_l_max        18 
_diffrn_reflns_theta_min          1.52 
_diffrn_reflns_theta_max          22.57 
_reflns_number_total              7155 
_reflns_number_gt                 5953 
_reflns_threshold_expression      >2sigma(I) 
  
_computing_data_collection        'SMART NT V5.625 (Bruker, 1998)' 
_computing_cell_refinement        'SAINT+ NT V6.22 (Bruker, 2001)' 
_computing_data_reduction         'SAINT+ NT V6.22' 
_computing_structure_solution     'SHELXS-97 (Sheldrick, 1990)' 
_computing_structure_refinement   'SHELXL-97 (Sheldrick, 1997)' 
_computing_molecular_graphics     'SHELXTL V6.1 (Sheldrick, 2000)' 
_computing_publication_material   'SHELXTL V6.1' 
  
_refine_special_details 
; 
 Refinement of F^2^ against ALL reflections.  The weighted R-factor wR and 
 goodness of fit S are based on F^2^, conventional R-factors R are based 
 on F, with F set to zero for negative F^2^. The threshold expression of 
 F^2^ > 2sigma(F^2^) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement.  R-factors based 
 on F^2^ are statistically about twice as large as those based on F, and R- 
 factors based on ALL data will be even larger. 
; 
  
_refine_ls_structure_factor_coef  Fsqd 
_refine_ls_matrix_type            full 
_refine_ls_weighting_scheme       calc 
_refine_ls_weighting_details 
 'calc w=1/[\s^2^(Fo^2^)+(0.0308P)^2^+24.9464P] where P=(Fo^2^+2Fc^2^)/3' 
_atom_sites_solution_primary      direct 
_atom_sites_solution_secondary    difmap 
_atom_sites_solution_hydrogens    geom 
_refine_ls_hydrogen_treatment     constr 
_refine_ls_extinction_method      none 
_refine_ls_extinction_coef        ? 
_refine_ls_number_reflns          7155 
_refine_ls_number_parameters      514 
_refine_ls_number_restraints      0 
_refine_ls_R_factor_all           0.0564 
_refine_ls_R_factor_gt            0.0435 
_refine_ls_wR_factor_ref          0.0873 
_refine_ls_wR_factor_gt           0.0829 
_refine_ls_goodness_of_fit_ref    1.092 
_refine_ls_restrained_S_all       1.092 
_refine_ls_shift/su_max           0.001 
_refine_ls_shift/su_mean          0.000 
  
loop_ 
 _atom_site_label 
 _atom_site_type_symbol 
 _atom_site_fract_x 
 _atom_site_fract_y 
 _atom_site_fract_z 
 _atom_site_U_iso_or_equiv 
 _atom_site_adp_type 
 _atom_site_occupancy 
 _atom_site_symmetry_multiplicity 
 _atom_site_calc_flag 
 _atom_site_refinement_flags 
 _atom_site_disorder_assembly 
 _atom_site_disorder_group 
Bi1 Bi 0.64085(4) 0.14803(3) 0.30837(3) 0.02778(15) Uani 1 1 d . . . 
Bi2 Bi 0.56639(4) 0.33231(3) 0.23121(3) 0.03123(16) Uani 1 1 d . . . 
Bi3 Bi 0.55918(4) 0.17562(3) 0.06975(3) 0.03286(17) Uani 1 1 d . . . 
I1 I 0.45322(6) 0.19813(5) 0.22073(5) 0.0294(2) Uani 1 1 d . . . 
I2 I 0.73062(6) 0.24008(5) 0.18210(5) 0.0295(2) Uani 1 1 d . . . 
I3 I 0.63301(7) 0.27698(5) 0.39795(5) 0.0366(3) Uani 1 1 d . . . 
I4 I 0.51601(7) 0.32707(5) 0.04953(6) 0.0397(3) Uani 1 1 d . . . 
I5 I 0.62520(7) 0.05408(5) 0.16216(7) 0.0464(3) Uani 1 1 d . . . 
I6 I 0.54212(7) 0.07023(5) 0.40832(6) 0.0360(3) Uani 1 1 d . . . 
I7 I 0.81772(6) 0.11463(5) 0.38219(5) 0.0318(2) Uani 1 1 d . . . 
I8 I 0.40412(7) 0.39630(5) 0.27086(6) 0.0368(3) Uani 1 1 d . . . 
I9 I 0.67960(7) 0.44277(5) 0.25061(6) 0.0393(3) Uani 1 1 d . . . 
I10 I 0.39486(8) 0.12253(7) -0.00493(6) 0.0587(4) Uani 1 1 d . . . 
I11 I 0.66387(6) 0.15966(5) -0.05862(5) 0.0359(3) Uani 1 1 d . . . 
Co1 Co 0.63742(11) 0.33333(9) 0.75110(10) 0.0222(4) Uani 1 1 d . . . 
C1 C 0.7971(9) 0.2660(7) 0.8481(8) 0.029(4) Uani 1 1 d . . . 
H1 H 0.7947 0.2360 0.8072 0.035 Uiso 1 1 calc R . . 
C2 C 0.8660(10) 0.2605(7) 0.9111(8) 0.037(4) Uani 1 1 d . . . 
H2 H 0.9106 0.2283 0.9119 0.044 Uiso 1 1 calc R . . 
C3 C 0.8664(10) 0.3027(7) 0.9705(8) 0.033(4) Uani 1 1 d . . . 
H3 H 0.9114 0.2995 1.0136 0.039 Uiso 1 1 calc R . . 
C4 C 0.8016(10) 0.3507(7) 0.9691(8) 0.030(4) Uani 1 1 d . . . 
C5 C 0.7987(9) 0.3951(8) 1.0308(8) 0.040(4) Uani 1 1 d . . . 
H5 H 0.8404 0.3920 1.0762 0.048 Uiso 1 1 calc R . . 
C6 C 0.7369(10) 0.4408(7) 1.0240(9) 0.040(4) Uani 1 1 d . . . 
H6 H 0.7387 0.4724 1.0631 0.048 Uiso 1 1 calc R . . 
C7 C 0.6678(10) 0.4441(7) 0.9596(8) 0.030(4) Uani 1 1 d . . . 
C8 C 0.6006(9) 0.4897(8) 0.9501(8) 0.035(4) Uani 1 1 d . . . 
H8 H 0.5986 0.5218 0.9882 0.042 Uiso 1 1 calc R . . 
C9 C 0.5379(9) 0.4893(7) 0.8874(8) 0.034(4) Uani 1 1 d . . . 
H9 H 0.4906 0.5197 0.8825 0.041 Uiso 1 1 calc R . . 
C10 C 0.5437(9) 0.4442(6) 0.8310(8) 0.026(3) Uani 1 1 d . . . 
H10 H 0.5003 0.4449 0.7865 0.032 Uiso 1 1 calc R . . 
C11 C 0.6693(9) 0.4010(6) 0.9010(8) 0.023(3) Uani 1 1 d . . . 
C12 C 0.7366(8) 0.3530(7) 0.9052(7) 0.023(3) Uani 1 1 d . . . 
C13 C 0.7932(10) 0.4298(7) 0.7338(8) 0.032(4) Uani 1 1 d . . . 
H13 H 0.8168 0.4186 0.7851 0.038 Uiso 1 1 calc R . . 
C14 C 0.8406(11) 0.4710(8) 0.6913(10) 0.047(5) Uani 1 1 d . . . 
H14 H 0.8972 0.4872 0.7134 0.056 Uiso 1 1 calc R . . 
C15 C 0.8069(11) 0.4886(7) 0.6179(10) 0.046(4) Uani 1 1 d . . . 
H15 H 0.8397 0.5170 0.5891 0.056 Uiso 1 1 calc R . . 
C16 C 0.7226(11) 0.4642(7) 0.5852(9) 0.035(4) Uani 1 1 d . . . 
C17 C 0.6846(15) 0.4776(8) 0.5088(10) 0.058(5) Uani 1 1 d . . . 
H17 H 0.7167 0.5036 0.4766 0.069 Uiso 1 1 calc R . . 
C18 C 0.6029(13) 0.4539(8) 0.4808(9) 0.049(5) Uani 1 1 d . . . 
H18 H 0.5786 0.4617 0.4287 0.059 Uiso 1 1 calc R . . 
C19 C 0.5545(10) 0.4175(7) 0.5303(8) 0.034(4) Uani 1 1 d . . . 
C20 C 0.4646(12) 0.3935(8) 0.5066(9) 0.047(5) Uani 1 1 d . . . 
H20 H 0.4370 0.4016 0.4555 0.057 Uiso 1 1 calc R . . 
C21 C 0.4195(12) 0.3600(8) 0.5559(9) 0.050(5) Uani 1 1 d . . . 
H21 H 0.3593 0.3465 0.5414 0.059 Uiso 1 1 calc R . . 
C22 C 0.4644(9) 0.3458(7) 0.6292(8) 0.030(4) Uani 1 1 d . . . 
H22 H 0.4341 0.3202 0.6630 0.036 Uiso 1 1 calc R . . 
C23 C 0.5898(9) 0.4003(7) 0.6039(8) 0.028(4) Uani 1 1 d . . . 
C24 C 0.6792(9) 0.4240(7) 0.6323(8) 0.030(4) Uani 1 1 d . . . 
C25 C 0.7337(9) 0.2592(7) 0.6253(8) 0.030(4) Uani 1 1 d . . . 
H25 H 0.7672 0.2968 0.6192 0.036 Uiso 1 1 calc R . . 
C26 C 0.7497(10) 0.2063(7) 0.5804(8) 0.035(4) Uani 1 1 d . . . 
H26 H 0.7943 0.2082 0.5456 0.042 Uiso 1 1 calc R . . 
C27 C 0.7013(10) 0.1520(7) 0.5865(8) 0.036(4) Uani 1 1 d . . . 
H27 H 0.7139 0.1151 0.5582 0.043 Uiso 1 1 calc R . . 
C28 C 0.6315(9) 0.1516(7) 0.6363(7) 0.027(4) Uani 1 1 d . . . 
C29 C 0.5761(10) 0.0964(8) 0.6454(9) 0.039(4) Uani 1 1 d . . . 
H29 H 0.5851 0.0584 0.6180 0.047 Uiso 1 1 calc R . . 
C30 C 0.5124(10) 0.1001(8) 0.6928(9) 0.039(4) Uani 1 1 d . . . 
H30 H 0.4749 0.0642 0.6971 0.047 Uiso 1 1 calc R . . 
C31 C 0.4971(9) 0.1544(7) 0.7372(8) 0.027(4) Uani 1 1 d . . . 
C32 C 0.4282(9) 0.1598(7) 0.7863(8) 0.030(4) Uani 1 1 d . . . 
H32 H 0.3880 0.1256 0.7916 0.036 Uiso 1 1 calc R . . 
C33 C 0.4203(9) 0.2148(7) 0.8261(8) 0.033(4) Uani 1 1 d . . . 
H33 H 0.3730 0.2199 0.8579 0.040 Uiso 1 1 calc R . . 
C34 C 0.4825(10) 0.2637(7) 0.8196(8) 0.031(4) Uani 1 1 d . . . 
H34 H 0.4772 0.3012 0.8491 0.037 Uiso 1 1 calc R . . 
C35 C 0.5542(9) 0.2058(7) 0.7322(7) 0.024(3) Uani 1 1 d . . . 
C36 C 0.6250(9) 0.2053(7) 0.6810(7) 0.026(4) Uani 1 1 d . . . 
N1 N 0.7365(7) 0.3111(5) 0.8446(6) 0.019(3) Uani 1 1 d . . . 
N2 N 0.6071(7) 0.3999(5) 0.8360(6) 0.022(3) Uani 1 1 d . . . 
N3 N 0.7148(7) 0.4060(6) 0.7030(7) 0.031(3) Uani 1 1 d . . . 
N4 N 0.5468(7) 0.3660(5) 0.6542(6) 0.026(3) Uani 1 1 d . . . 
N5 N 0.6737(7) 0.2592(5) 0.6761(6) 0.022(3) Uani 1 1 d . . . 
N6 N 0.5486(7) 0.2605(6) 0.7744(6) 0.029(3) Uani 1 1 d . . . 
  
loop_ 
 _atom_site_aniso_label 
 _atom_site_aniso_U_11 
 _atom_site_aniso_U_22 
 _atom_site_aniso_U_33 
 _atom_site_aniso_U_23 
 _atom_site_aniso_U_13 
 _atom_site_aniso_U_12 
Bi1 0.0241(3) 0.0291(4) 0.0292(3) 0.0051(3) -0.0011(2) 0.0030(3) 
Bi2 0.0299(3) 0.0238(3) 0.0399(3) 0.0035(3) 0.0034(3) 0.0004(3) 
Bi3 0.0276(3) 0.0439(4) 0.0262(3) 0.0021(3) -0.0006(3) -0.0049(3) 
I1 0.0233(5) 0.0330(6) 0.0313(5) 0.0031(4) -0.0002(4) 0.0002(4) 
I2 0.0226(5) 0.0344(6) 0.0305(5) 0.0007(4) -0.0008(4) -0.0018(4) 
I3 0.0360(6) 0.0450(7) 0.0270(5) -0.0038(5) -0.0043(5) 0.0014(5) 
I4 0.0345(6) 0.0465(7) 0.0364(6) 0.0159(5) -0.0031(5) 0.0008(5) 
I5 0.0467(6) 0.0301(7) 0.0595(7) -0.0051(5) -0.0068(6) 0.0080(5) 
I6 0.0391(6) 0.0318(6) 0.0371(6) 0.0026(5) 0.0048(5) -0.0083(5) 
I7 0.0240(5) 0.0317(6) 0.0383(6) 0.0082(5) -0.0020(4) 0.0031(4) 
I8 0.0368(6) 0.0356(7) 0.0385(6) 0.0052(5) 0.0064(5) 0.0067(5) 
I9 0.0369(6) 0.0321(6) 0.0476(6) 0.0023(5) -0.0014(5) -0.0074(5) 
I10 0.0461(7) 0.0930(11) 0.0343(6) 0.0145(6) -0.0070(5) -0.0349(7) 
I11 0.0357(6) 0.0396(7) 0.0325(5) 0.0027(5) 0.0042(5) -0.0003(5) 
Co1 0.0216(10) 0.0224(11) 0.0223(10) -0.0009(8) 0.0008(8) 0.0004(8) 
C1 0.030(8) 0.025(9) 0.031(8) 0.002(7) 0.000(7) 0.008(7) 
C2 0.034(9) 0.042(11) 0.034(9) 0.019(8) -0.001(8) 0.007(8) 
C3 0.045(9) 0.028(10) 0.025(8) -0.002(7) 0.001(7) 0.005(8) 
C4 0.041(9) 0.026(9) 0.023(8) -0.002(7) 0.008(7) -0.004(7) 
C5 0.024(8) 0.065(13) 0.028(9) -0.016(8) -0.006(7) 0.010(8) 
C6 0.037(9) 0.028(10) 0.053(10) -0.024(8) -0.002(8) -0.008(8) 
C7 0.036(9) 0.023(9) 0.032(8) -0.014(7) 0.007(7) 0.012(7) 
C8 0.028(8) 0.047(11) 0.034(9) 0.001(8) 0.021(8) -0.011(8) 
C9 0.021(8) 0.043(11) 0.038(9) 0.002(8) 0.004(8) 0.003(7) 
C10 0.031(8) 0.020(9) 0.030(8) -0.007(7) 0.011(7) 0.006(7) 
C11 0.028(8) 0.013(8) 0.029(8) -0.006(7) 0.008(7) -0.010(6) 
C12 0.020(7) 0.025(9) 0.025(8) 0.007(7) 0.013(7) -0.006(7) 
C13 0.043(10) 0.021(9) 0.033(9) 0.002(7) 0.011(8) 0.007(8) 
C14 0.047(10) 0.036(11) 0.059(12) -0.013(9) 0.005(9) -0.016(9) 
C15 0.048(11) 0.024(10) 0.070(13) 0.005(9) 0.023(10) -0.011(8) 
C16 0.058(11) 0.013(9) 0.038(10) 0.002(7) 0.025(9) 0.010(8) 
C17 0.097(16) 0.038(12) 0.046(12) 0.016(9) 0.045(12) 0.003(11) 
C18 0.082(14) 0.045(12) 0.027(9) 0.027(9) 0.037(10) 0.041(11) 
C19 0.048(10) 0.024(9) 0.028(9) -0.008(7) -0.009(8) 0.026(8) 
C20 0.068(13) 0.045(12) 0.028(9) -0.014(9) 0.004(9) 0.035(10) 
C21 0.056(11) 0.052(12) 0.037(10) -0.011(9) -0.009(9) 0.015(10) 
C22 0.029(8) 0.024(9) 0.033(8) -0.008(7) -0.010(7) 0.014(7) 
C23 0.037(9) 0.020(9) 0.029(8) -0.001(7) 0.007(7) 0.012(7) 
C24 0.036(9) 0.019(9) 0.032(9) -0.004(7) -0.002(8) 0.009(7) 
C25 0.029(8) 0.037(10) 0.022(8) -0.001(7) -0.008(7) -0.009(7) 
C26 0.035(9) 0.033(11) 0.036(9) 0.005(8) 0.000(7) 0.018(8) 
C27 0.052(10) 0.026(10) 0.029(8) -0.011(7) -0.001(8) 0.002(8) 
C28 0.038(9) 0.026(9) 0.015(7) 0.001(7) -0.013(7) 0.000(7) 
C29 0.047(10) 0.033(11) 0.037(9) -0.003(8) -0.001(8) -0.001(8) 
C30 0.034(9) 0.043(12) 0.039(9) 0.022(9) -0.005(8) -0.012(8) 
C31 0.032(8) 0.022(9) 0.027(8) 0.021(7) -0.004(7) 0.000(7) 
C32 0.018(7) 0.037(11) 0.034(8) -0.002(8) -0.001(7) 0.001(7) 
C33 0.030(8) 0.035(11) 0.035(9) 0.014(8) 0.007(7) 0.004(8) 
C34 0.041(9) 0.022(9) 0.030(8) 0.006(7) 0.003(8) 0.003(7) 
C35 0.035(8) 0.026(9) 0.011(7) -0.003(7) -0.004(6) 0.005(7) 
C36 0.021(8) 0.035(10) 0.021(8) -0.007(7) -0.009(6) -0.006(7) 
N1 0.015(6) 0.017(7) 0.024(6) 0.000(5) 0.007(5) -0.002(5) 
N2 0.016(6) 0.021(7) 0.030(7) -0.001(5) 0.001(5) -0.002(5) 
N3 0.018(6) 0.030(8) 0.045(8) -0.007(6) 0.009(6) -0.003(6) 
N4 0.020(6) 0.028(8) 0.028(7) -0.004(6) -0.001(6) 0.003(5) 
N5 0.016(6) 0.037(8) 0.013(6) -0.008(5) 0.005(5) 0.002(6) 
N6 0.012(6) 0.054(9) 0.020(6) 0.008(6) -0.008(5) -0.008(6) 
  
_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 
Bi1 I7 2.8880(10) . ? 
Bi1 I6 2.9082(11) . ? 
Bi1 I3 3.1436(12) . ? 
Bi1 I5 3.2091(12) . ? 
Bi1 I1 3.2108(10) . ? 
Bi1 I2 3.3226(11) . ? 
Bi2 I9 2.8766(11) . ? 
Bi2 I8 2.9222(11) . ? 
Bi2 I4 3.1610(11) . ? 
Bi2 I3 3.1755(11) . ? 
Bi2 I1 3.2921(11) . ? 
Bi2 I2 3.3159(11) . ? 
Bi3 I10 2.8689(11) . ? 
Bi3 I11 2.8826(11) . ? 
Bi3 I5 3.1257(12) . ? 
Bi3 I1 3.2458(11) . ? 
Bi3 I4 3.2721(13) . ? 
Bi3 I2 3.3276(10) . ? 
Co1 N6 2.099(12) . ? 
Co1 N1 2.121(10) . ? 
Co1 N2 2.121(11) . ? 
Co1 N5 2.145(11) . ? 
Co1 N3 2.145(12) . ? 
Co1 N4 2.150(10) . ? 
C1 N1 1.310(16) . ? 
C1 C2 1.419(18) . ? 
C1 H1 0.9500 . ? 
C2 C3 1.36(2) . ? 
C2 H2 0.9500 . ? 
C3 C4 1.40(2) . ? 
C3 H3 0.9500 . ? 
C4 C12 1.389(18) . ? 
C4 C5 1.43(2) . ? 
C5 C6 1.33(2) . ? 
C5 H5 0.9500 . ? 
C6 C7 1.434(19) . ? 
C6 H6 0.9500 . ? 
C7 C11 1.368(18) . ? 
C7 C8 1.39(2) . ? 
C8 C9 1.353(19) . ? 
C8 H8 0.9500 . ? 
C9 C10 1.376(19) . ? 
C9 H9 0.9500 . ? 
C10 N2 1.327(16) . ? 
C10 H10 0.9500 . ? 
C11 N2 1.379(16) . ? 
C11 C12 1.422(19) . ? 
C12 N1 1.375(17) . ? 
C13 N3 1.330(17) . ? 
C13 C14 1.38(2) . ? 
C13 H13 0.9500 . ? 
C14 C15 1.37(2) . ? 
C14 H14 0.9500 . ? 
C15 C16 1.42(2) . ? 
C15 H15 0.9500 . ? 
C16 C24 1.39(2) . ? 
C16 C17 1.41(2) . ? 
C17 C18 1.36(2) . ? 
C17 H17 0.9500 . ? 
C18 C19 1.41(2) . ? 
C18 H18 0.9500 . ? 
C19 C23 1.375(19) . ? 
C19 C20 1.45(2) . ? 
C20 C21 1.35(2) . ? 
C20 H20 0.9500 . ? 
C21 C22 1.40(2) . ? 
C21 H21 0.9500 . ? 
C22 N4 1.327(17) . ? 
C22 H22 0.9500 . ? 
C23 N4 1.350(17) . ? 
C23 C24 1.46(2) . ? 
C24 N3 1.335(17) . ? 
C25 N5 1.325(17) . ? 
C25 C26 1.40(2) . ? 
C25 H25 0.9500 . ? 
C26 C27 1.37(2) . ? 
C26 H26 0.9500 . ? 
C27 C28 1.43(2) . ? 
C27 H27 0.9500 . ? 
C28 C36 1.383(19) . ? 
C28 C29 1.45(2) . ? 
C29 C30 1.33(2) . ? 
C29 H29 0.9500 . ? 
C30 C31 1.41(2) . ? 
C30 H30 0.9500 . ? 
C31 C35 1.389(19) . ? 
C31 C32 1.412(19) . ? 
C32 C33 1.36(2) . ? 
C32 H32 0.9500 . ? 
C33 C34 1.40(2) . ? 
C33 H33 0.9500 . ? 
C34 N6 1.330(17) . ? 
C34 H34 0.9500 . ? 
C35 N6 1.374(17) . ? 
C35 C36 1.456(19) . ? 
C36 N5 1.357(17) . ? 
  
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 
I7 Bi1 I6 95.53(3) . . ? 
I7 Bi1 I3 94.30(3) . . ? 
I6 Bi1 I3 98.28(3) . . ? 
I7 Bi1 I5 100.45(3) . . ? 
I6 Bi1 I5 97.27(3) . . ? 
I3 Bi1 I5 157.37(3) . . ? 
I7 Bi1 I1 174.21(3) . . ? 
I6 Bi1 I1 89.73(3) . . ? 
I3 Bi1 I1 82.54(3) . . ? 
I5 Bi1 I1 81.20(3) . . ? 
I7 Bi1 I2 91.10(3) . . ? 
I6 Bi1 I2 173.31(3) . . ? 
I3 Bi1 I2 81.98(3) . . ? 
I5 Bi1 I2 80.69(3) . . ? 
I1 Bi1 I2 83.67(3) . . ? 
I9 Bi2 I8 95.11(3) . . ? 
I9 Bi2 I4 102.45(3) . . ? 
I8 Bi2 I4 98.13(3) . . ? 
I9 Bi2 I3 94.14(3) . . ? 
I8 Bi2 I3 97.91(3) . . ? 
I4 Bi2 I3 155.72(3) . . ? 
I9 Bi2 I1 174.04(3) . . ? 
I8 Bi2 I1 88.69(3) . . ? 
I4 Bi2 I1 81.49(3) . . ? 
I3 Bi2 I1 80.77(3) . . ? 
I9 Bi2 I2 93.71(3) . . ? 
I8 Bi2 I2 171.18(3) . . ? 
I4 Bi2 I2 79.76(3) . . ? 
I3 Bi2 I2 81.61(3) . . ? 
I1 Bi2 I2 82.53(3) . . ? 
I10 Bi3 I11 96.60(4) . . ? 
I10 Bi3 I5 96.61(4) . . ? 
I11 Bi3 I5 97.71(3) . . ? 
I10 Bi3 I1 87.29(3) . . ? 
I11 Bi3 I1 176.10(3) . . ? 
I5 Bi3 I1 81.93(3) . . ? 
I10 Bi3 I4 100.68(4) . . ? 
I11 Bi3 I4 98.54(3) . . ? 
I5 Bi3 I4 154.66(3) . . ? 
I1 Bi3 I4 80.54(3) . . ? 
I10 Bi3 I2 170.34(4) . . ? 
I11 Bi3 I2 93.05(3) . . ? 
I5 Bi3 I2 81.83(3) . . ? 
I1 Bi3 I2 83.05(3) . . ? 
I4 Bi3 I2 78.02(3) . . ? 
Bi1 I1 Bi3 81.74(3) . . ? 
Bi1 I1 Bi2 80.96(2) . . ? 
Bi3 I1 Bi2 82.93(3) . . ? 
Bi2 I2 Bi1 78.98(2) . . ? 
Bi2 I2 Bi3 81.33(2) . . ? 
Bi1 I2 Bi3 78.88(2) . . ? 
Bi1 I3 Bi2 83.84(3) . . ? 
Bi2 I4 Bi3 84.57(3) . . ? 
Bi3 I5 Bi1 83.65(3) . . ? 
N6 Co1 N1 95.3(4) . . ? 
N6 Co1 N2 99.3(4) . . ? 
N1 Co1 N2 78.4(4) . . ? 
N6 Co1 N5 77.9(5) . . ? 
N1 Co1 N5 95.8(4) . . ? 
N2 Co1 N5 173.5(4) . . ? 
N6 Co1 N3 168.0(4) . . ? 
N1 Co1 N3 95.6(4) . . ? 
N2 Co1 N3 87.9(4) . . ? 
N5 Co1 N3 95.8(4) . . ? 
N6 Co1 N4 91.8(4) . . ? 
N1 Co1 N4 172.9(4) . . ? 
N2 Co1 N4 99.6(4) . . ? 
N5 Co1 N4 86.5(4) . . ? 
N3 Co1 N4 77.5(4) . . ? 
N1 C1 C2 122.1(13) . . ? 
N1 C1 H1 118.9 . . ? 
C2 C1 H1 118.9 . . ? 
C3 C2 C1 118.0(14) . . ? 
C3 C2 H2 121.0 . . ? 
C1 C2 H2 121.0 . . ? 
C2 C3 C4 121.2(13) . . ? 
C2 C3 H3 119.4 . . ? 
C4 C3 H3 119.4 . . ? 
C12 C4 C3 117.3(13) . . ? 
C12 C4 C5 119.9(13) . . ? 
C3 C4 C5 122.8(13) . . ? 
C6 C5 C4 119.3(13) . . ? 
C6 C5 H5 120.4 . . ? 
C4 C5 H5 120.4 . . ? 
C5 C6 C7 122.3(14) . . ? 
C5 C6 H6 118.8 . . ? 
C7 C6 H6 118.8 . . ? 
C11 C7 C8 116.5(13) . . ? 
C11 C7 C6 118.4(13) . . ? 
C8 C7 C6 125.0(13) . . ? 
C9 C8 C7 121.1(15) . . ? 
C9 C8 H8 119.5 . . ? 
C7 C8 H8 119.5 . . ? 
C8 C9 C10 119.0(14) . . ? 
C8 C9 H9 120.5 . . ? 
C10 C9 H9 120.5 . . ? 
N2 C10 C9 122.9(13) . . ? 
N2 C10 H10 118.5 . . ? 
C9 C10 H10 118.5 . . ? 
C7 C11 N2 123.7(13) . . ? 
C7 C11 C12 120.4(13) . . ? 
N2 C11 C12 115.9(11) . . ? 
N1 C12 C4 121.9(12) . . ? 
N1 C12 C11 118.6(11) . . ? 
C4 C12 C11 119.5(13) . . ? 
N3 C13 C14 120.2(14) . . ? 
N3 C13 H13 119.9 . . ? 
C14 C13 H13 119.9 . . ? 
C15 C14 C13 120.7(15) . . ? 
C15 C14 H14 119.6 . . ? 
C13 C14 H14 119.6 . . ? 
C14 C15 C16 119.3(15) . . ? 
C14 C15 H15 120.3 . . ? 
C16 C15 H15 120.3 . . ? 
C24 C16 C17 120.8(15) . . ? 
C24 C16 C15 116.0(14) . . ? 
C17 C16 C15 123.1(16) . . ? 
C18 C17 C16 120.8(16) . . ? 
C18 C17 H17 119.6 . . ? 
C16 C17 H17 119.6 . . ? 
C17 C18 C19 118.9(15) . . ? 
C17 C18 H18 120.5 . . ? 
C19 C18 H18 120.5 . . ? 
C23 C19 C18 122.8(15) . . ? 
C23 C19 C20 114.6(15) . . ? 
C18 C19 C20 122.6(15) . . ? 
C21 C20 C19 121.0(15) . . ? 
C21 C20 H20 119.5 . . ? 
C19 C20 H20 119.5 . . ? 
C20 C21 C22 117.9(16) . . ? 
C20 C21 H21 121.1 . . ? 
C22 C21 H21 121.1 . . ? 
N4 C22 C21 123.9(16) . . ? 
N4 C22 H22 118.1 . . ? 
C21 C22 H22 118.1 . . ? 
N4 C23 C19 125.6(14) . . ? 
N4 C23 C24 116.7(12) . . ? 
C19 C23 C24 117.6(14) . . ? 
N3 C24 C16 123.5(13) . . ? 
N3 C24 C23 117.8(13) . . ? 
C16 C24 C23 118.7(13) . . ? 
N5 C25 C26 122.8(14) . . ? 
N5 C25 H25 118.6 . . ? 
C26 C25 H25 118.6 . . ? 
C27 C26 C25 120.2(15) . . ? 
C27 C26 H26 119.9 . . ? 
C25 C26 H26 119.9 . . ? 
C26 C27 C28 118.7(14) . . ? 
C26 C27 H27 120.7 . . ? 
C28 C27 H27 120.7 . . ? 
C36 C28 C27 116.0(13) . . ? 
C36 C28 C29 121.4(14) . . ? 
C27 C28 C29 122.4(14) . . ? 
C30 C29 C28 118.5(15) . . ? 
C30 C29 H29 120.7 . . ? 
C28 C29 H29 120.7 . . ? 
C29 C30 C31 123.9(15) . . ? 
C29 C30 H30 118.1 . . ? 
C31 C30 H30 118.1 . . ? 
C35 C31 C32 117.8(14) . . ? 
C35 C31 C30 117.5(13) . . ? 
C32 C31 C30 124.7(14) . . ? 
C33 C32 C31 119.2(14) . . ? 
C33 C32 H32 120.4 . . ? 
C31 C32 H32 120.4 . . ? 
C32 C33 C34 119.3(14) . . ? 
C32 C33 H33 120.3 . . ? 
C34 C33 H33 120.3 . . ? 
N6 C34 C33 123.5(14) . . ? 
N6 C34 H34 118.3 . . ? 
C33 C34 H34 118.3 . . ? 
N6 C35 C31 123.3(13) . . ? 
N6 C35 C36 115.1(13) . . ? 
C31 C35 C36 121.6(13) . . ? 
N5 C36 C28 125.3(13) . . ? 
N5 C36 C35 117.6(12) . . ? 
C28 C36 C35 116.8(13) . . ? 
C1 N1 C12 119.4(11) . . ? 
C1 N1 Co1 127.9(9) . . ? 
C12 N1 Co1 112.6(8) . . ? 
C10 N2 C11 116.8(11) . . ? 
C10 N2 Co1 129.0(9) . . ? 
C11 N2 Co1 113.8(8) . . ? 
C13 N3 C24 120.2(13) . . ? 
C13 N3 Co1 127.0(10) . . ? 
C24 N3 Co1 112.7(9) . . ? 
C22 N4 C23 116.8(12) . . ? 
C22 N4 Co1 129.0(10) . . ? 
C23 N4 Co1 112.0(8) . . ? 
C25 N5 C36 116.7(12) . . ? 
C25 N5 Co1 129.7(10) . . ? 
C36 N5 Co1 113.5(8) . . ? 
C34 N6 C35 116.8(12) . . ? 
C34 N6 Co1 127.1(10) . . ? 
C35 N6 Co1 115.8(9) . . ? 
  
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 
I6 Bi1 I1 Bi3 -137.07(3) . . . . ? 
I3 Bi1 I1 Bi3 124.55(3) . . . . ? 
I5 Bi1 I1 Bi3 -39.67(3) . . . . ? 
I2 Bi1 I1 Bi3 41.85(3) . . . . ? 
I6 Bi1 I1 Bi2 138.84(3) . . . . ? 
I3 Bi1 I1 Bi2 40.45(3) . . . . ? 
I5 Bi1 I1 Bi2 -123.76(3) . . . . ? 
I2 Bi1 I1 Bi2 -42.25(2) . . . . ? 
I10 Bi3 I1 Bi1 137.92(4) . . . . ? 
I5 Bi3 I1 Bi1 40.85(3) . . . . ? 
I4 Bi3 I1 Bi1 -120.78(3) . . . . ? 
I2 Bi3 I1 Bi1 -41.83(3) . . . . ? 
I10 Bi3 I1 Bi2 -140.25(3) . . . . ? 
I5 Bi3 I1 Bi2 122.69(3) . . . . ? 
I4 Bi3 I1 Bi2 -38.95(2) . . . . ? 
I2 Bi3 I1 Bi2 40.00(2) . . . . ? 
I8 Bi2 I1 Bi1 -138.41(3) . . . . ? 
I4 Bi2 I1 Bi1 123.17(3) . . . . ? 
I3 Bi2 I1 Bi1 -40.18(3) . . . . ? 
I2 Bi2 I1 Bi1 42.48(2) . . . . ? 
I8 Bi2 I1 Bi3 138.88(3) . . . . ? 
I4 Bi2 I1 Bi3 40.46(3) . . . . ? 
I3 Bi2 I1 Bi3 -122.89(3) . . . . ? 
I2 Bi2 I1 Bi3 -40.23(2) . . . . ? 
I9 Bi2 I2 Bi1 134.31(3) . . . . ? 
I4 Bi2 I2 Bi1 -123.69(3) . . . . ? 
I3 Bi2 I2 Bi1 40.67(2) . . . . ? 
I1 Bi2 I2 Bi1 -41.04(2) . . . . ? 
I9 Bi2 I2 Bi3 -145.42(3) . . . . ? 
I4 Bi2 I2 Bi3 -43.43(3) . . . . ? 
I3 Bi2 I2 Bi3 120.94(3) . . . . ? 
I1 Bi2 I2 Bi3 39.23(2) . . . . ? 
I7 Bi1 I2 Bi2 -135.32(3) . . . . ? 
I3 Bi1 I2 Bi2 -41.12(2) . . . . ? 
I5 Bi1 I2 Bi2 124.28(3) . . . . ? 
I1 Bi1 I2 Bi2 42.19(2) . . . . ? 
I7 Bi1 I2 Bi3 141.47(3) . . . . ? 
I3 Bi1 I2 Bi3 -124.33(3) . . . . ? 
I5 Bi1 I2 Bi3 41.07(3) . . . . ? 
I1 Bi1 I2 Bi3 -41.02(3) . . . . ? 
I11 Bi3 I2 Bi2 140.01(3) . . . . ? 
I5 Bi3 I2 Bi2 -122.64(3) . . . . ? 
I1 Bi3 I2 Bi2 -39.84(3) . . . . ? 
I4 Bi3 I2 Bi2 41.92(2) . . . . ? 
I11 Bi3 I2 Bi1 -139.61(3) . . . . ? 
I5 Bi3 I2 Bi1 -42.25(3) . . . . ? 
I1 Bi3 I2 Bi1 40.54(2) . . . . ? 
I4 Bi3 I2 Bi1 122.30(3) . . . . ? 
I7 Bi1 I3 Bi2 133.20(3) . . . . ? 
I6 Bi1 I3 Bi2 -130.56(3) . . . . ? 
I5 Bi1 I3 Bi2 2.41(9) . . . . ? 
I1 Bi1 I3 Bi2 -41.92(3) . . . . ? 
I2 Bi1 I3 Bi2 42.69(2) . . . . ? 
I9 Bi2 I3 Bi1 -135.99(3) . . . . ? 
I8 Bi2 I3 Bi1 128.25(3) . . . . ? 
I4 Bi2 I3 Bi1 -2.67(8) . . . . ? 
I1 Bi2 I3 Bi1 40.89(3) . . . . ? 
I2 Bi2 I3 Bi1 -42.85(3) . . . . ? 
I9 Bi2 I4 Bi3 135.54(3) . . . . ? 
I8 Bi2 I4 Bi3 -127.36(3) . . . . ? 
I3 Bi2 I4 Bi3 3.53(8) . . . . ? 
I1 Bi2 I4 Bi3 -39.92(2) . . . . ? 
I2 Bi2 I4 Bi3 43.96(2) . . . . ? 
I10 Bi3 I4 Bi2 126.14(3) . . . . ? 
I11 Bi3 I4 Bi2 -135.42(3) . . . . ? 
I5 Bi3 I4 Bi2 -6.07(8) . . . . ? 
I1 Bi3 I4 Bi2 40.74(2) . . . . ? 
I2 Bi3 I4 Bi2 -44.10(2) . . . . ? 
I10 Bi3 I5 Bi1 -126.97(3) . . . . ? 
I11 Bi3 I5 Bi1 135.41(3) . . . . ? 
I1 Bi3 I5 Bi1 -40.67(3) . . . . ? 
I4 Bi3 I5 Bi1 5.91(9) . . . . ? 
I2 Bi3 I5 Bi1 43.42(3) . . . . ? 
I7 Bi1 I5 Bi3 -133.07(3) . . . . ? 
I6 Bi1 I5 Bi3 129.90(3) . . . . ? 
I3 Bi1 I5 Bi3 -3.22(9) . . . . ? 
I1 Bi1 I5 Bi3 41.30(3) . . . . ? 
I2 Bi1 I5 Bi3 -43.67(3) . . . . ? 
C2 C3 C4 C5 178.8(15) . . . . ? 
C3 C4 C5 C6 177.6(15) . . . . ? 
C5 C6 C7 C8 178.6(16) . . . . ? 
C6 C7 C8 C9 180.0(14) . . . . ? 
C6 C7 C11 N2 -179.3(13) . . . . ? 
C8 C7 C11 C12 179.1(13) . . . . ? 
C5 C4 C12 N1 -179.7(13) . . . . ? 
C3 C4 C12 C11 -180.0(13) . . . . ? 
C7 C11 C12 N1 -179.1(12) . . . . ? 
N2 C11 C12 N1 1.8(17) . . . . ? 
C7 C11 C12 C4 -1(2) . . . . ? 
N2 C11 C12 C4 -179.7(11) . . . . ? 
C14 C15 C16 C17 -177.2(15) . . . . ? 
C15 C16 C17 C18 -178.8(16) . . . . ? 
C17 C18 C19 C20 176.3(15) . . . . ? 
C18 C19 C20 C21 -178.6(15) . . . . ? 
C18 C19 C23 N4 179.5(14) . . . . ? 
C20 C19 C23 C24 -178.6(12) . . . . ? 
C17 C16 C24 N3 175.1(14) . . . . ? 
C15 C16 C24 C23 176.3(13) . . . . ? 
N4 C23 C24 N3 5.3(19) . . . . ? 
C19 C23 C24 N3 -178.2(12) . . . . ? 
N4 C23 C24 C16 -174.3(13) . . . . ? 
C26 C27 C28 C36 -6.6(19) . . . . ? 
C26 C27 C28 C29 179.1(13) . . . . ? 
C36 C28 C29 C30 6(2) . . . . ? 
C27 C28 C29 C30 -179.9(13) . . . . ? 
C29 C30 C31 C32 178.3(13) . . . . ? 
C35 C31 C32 C33 0.4(18) . . . . ? 
C30 C31 C32 C33 -179.9(13) . . . . ? 
C32 C31 C35 N6 2.1(19) . . . . ? 
C30 C31 C35 N6 -177.7(12) . . . . ? 
C32 C31 C35 C36 -177.8(12) . . . . ? 
C30 C31 C35 C36 2.4(18) . . . . ? 
C27 C28 C36 N5 6.1(19) . . . . ? 
C29 C28 C36 N5 -179.6(12) . . . . ? 
C27 C28 C36 C35 -179.9(11) . . . . ? 
C29 C28 C36 C35 -5.6(19) . . . . ? 
N6 C35 C36 N5 -4.1(17) . . . . ? 
C31 C35 C36 N5 175.8(12) . . . . ? 
N6 C35 C36 C28 -178.6(11) . . . . ? 
C31 C35 C36 C28 1.3(18) . . . . ? 
C2 C1 N1 Co1 173.0(10) . . . . ? 
C4 C12 N1 C1 2.8(19) . . . . ? 
C11 C12 N1 C1 -178.8(12) . . . . ? 
C4 C12 N1 Co1 -173.8(10) . . . . ? 
C11 C12 N1 Co1 4.6(14) . . . . ? 
N6 Co1 N1 C1 79.0(12) . . . . ? 
N2 Co1 N1 C1 177.4(12) . . . . ? 
N5 Co1 N1 C1 0.6(12) . . . . ? 
N3 Co1 N1 C1 -95.8(11) . . . . ? 
N6 Co1 N1 C12 -104.8(9) . . . . ? 
N2 Co1 N1 C12 -6.3(8) . . . . ? 
N5 Co1 N1 C12 176.8(8) . . . . ? 
N3 Co1 N1 C12 80.4(9) . . . . ? 
C9 C10 N2 C11 -1(2) . . . . ? 
C9 C10 N2 Co1 -172.1(10) . . . . ? 
C7 C11 N2 C10 0.9(19) . . . . ? 
C12 C11 N2 C10 180.0(12) . . . . ? 
C7 C11 N2 Co1 173.6(11) . . . . ? 
C12 C11 N2 Co1 -7.3(14) . . . . ? 
N6 Co1 N2 C10 -87.5(12) . . . . ? 
N1 Co1 N2 C10 179.0(12) . . . . ? 
N3 Co1 N2 C10 82.9(12) . . . . ? 
N4 Co1 N2 C10 5.9(12) . . . . ? 
N6 Co1 N2 C11 100.9(9) . . . . ? 
N1 Co1 N2 C11 7.4(8) . . . . ? 
N3 Co1 N2 C11 -88.7(9) . . . . ? 
N4 Co1 N2 C11 -165.7(9) . . . . ? 
C14 C13 N3 Co1 171.9(11) . . . . ? 
C23 C24 N3 C13 -175.1(12) . . . . ? 
C16 C24 N3 Co1 -171.4(11) . . . . ? 
C23 C24 N3 Co1 9.0(15) . . . . ? 
N6 Co1 N3 C13 -161.5(19) . . . . ? 
N1 Co1 N3 C13 -7.3(12) . . . . ? 
N2 Co1 N3 C13 70.9(12) . . . . ? 
N5 Co1 N3 C13 -103.8(12) . . . . ? 
N4 Co1 N3 C13 171.2(12) . . . . ? 
N1 Co1 N3 C24 168.2(9) . . . . ? 
N2 Co1 N3 C24 -113.6(10) . . . . ? 
N5 Co1 N3 C24 71.7(9) . . . . ? 
N4 Co1 N3 C24 -13.3(9) . . . . ? 
C21 C22 N4 Co1 -164.6(11) . . . . ? 
C24 C23 N4 C22 178.3(12) . . . . ? 
C19 C23 N4 Co1 167.1(11) . . . . ? 
C24 C23 N4 Co1 -16.6(15) . . . . ? 
N6 Co1 N4 C22 4.3(12) . . . . ? 
N2 Co1 N4 C22 -95.4(12) . . . . ? 
N5 Co1 N4 C22 82.1(12) . . . . ? 
N3 Co1 N4 C22 178.8(12) . . . . ? 
N6 Co1 N4 C23 -158.5(9) . . . . ? 
N2 Co1 N4 C23 101.7(9) . . . . ? 
N5 Co1 N4 C23 -80.7(9) . . . . ? 
N3 Co1 N4 C23 16.0(9) . . . . ? 
C26 C25 N5 C36 -2.3(18) . . . . ? 
C26 C25 N5 Co1 179.8(9) . . . . ? 
C28 C36 N5 C25 -1.7(19) . . . . ? 
C35 C36 N5 C25 -175.6(11) . . . . ? 
C28 C36 N5 Co1 176.5(10) . . . . ? 
C35 C36 N5 Co1 2.6(14) . . . . ? 
N6 Co1 N5 C25 177.4(11) . . . . ? 
N1 Co1 N5 C25 -88.4(11) . . . . ? 
N3 Co1 N5 C25 7.8(11) . . . . ? 
N4 Co1 N5 C25 84.8(11) . . . . ? 
N6 Co1 N5 C36 -0.5(8) . . . . ? 
N1 Co1 N5 C36 93.6(9) . . . . ? 
N3 Co1 N5 C36 -170.1(9) . . . . ? 
N4 Co1 N5 C36 -93.1(9) . . . . ? 
C33 C34 N6 C35 0.3(18) . . . . ? 
C33 C34 N6 Co1 173.4(10) . . . . ? 
C31 C35 N6 C34 -2.4(18) . . . . ? 
C36 C35 N6 C34 177.5(11) . . . . ? 
C31 C35 N6 Co1 -176.3(10) . . . . ? 
C36 C35 N6 Co1 3.6(14) . . . . ? 
N1 Co1 N6 C34 90.2(11) . . . . ? 
N2 Co1 N6 C34 11.1(11) . . . . ? 
N5 Co1 N6 C34 -174.9(11) . . . . ? 
N3 Co1 N6 C34 -116(2) . . . . ? 
N4 Co1 N6 C34 -88.9(11) . . . . ? 
N1 Co1 N6 C35 -96.6(9) . . . . ? 
N2 Co1 N6 C35 -175.7(8) . . . . ? 
N5 Co1 N6 C35 -1.7(8) . . . . ? 
N4 Co1 N6 C35 84.3(9) . . . . ? 
  
_diffrn_measured_fraction_theta_max    0.998 
_diffrn_reflns_theta_full              22.57 
_diffrn_measured_fraction_theta_full   0.998 
_refine_diff_density_max    1.969 
_refine_diff_density_min   -1.477 
_refine_diff_density_rms    0.223 

_vrf_THETM01_1d
;
PROBLEM: The value of sine(theta_max)/wavelength is less than 0.550
RESPONSE: No diffraction observed at higher angle due to small
crystal size (needle with minimum dimension 0.02 mm).
;
_vrf_PLAT023_1d
;
PROBLEM: Resolution (too) Low [sin(theta)/Lambda < 0.6]..      22.57 Deg. 
RESPONSE: No diffraction observed at higher angle due to small
crystal size (needle with minimum dimension 0.02 mm).
;