#------------------------------------------------------------------------------
#$Date: 2016-03-26 13:05:57 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180222 $
#$URL: svn://www.crystallography.net/cod/cif/7/11/08/7110849.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided the Crystal Eye server at
# http://wwmm.ch.cam.ac.uk/crystaleye/, created by Nick Day at the
# Peter Murray-Rust laboratory.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_7110849
loop_
_publ_author_name
'Graham, Alasdair'
'Meier, Stephanie'
'Parsons, Simon'
'Winpenny, Richard E. P.'
_publ_section_title
;
 Changing cage structures through inter-ligand repulsions
;
_journal_issue                   10
_journal_name_full               'Chemical Communications'
_journal_page_first              811
_journal_paper_doi               10.1039/b000385i
_journal_year                    2000
_chemical_formula_moiety
;
[Co10(OH)6(tpa)6(mhp)6(Hmhp)3(HCO3)3].MeOH.2H2O
;
_chemical_formula_sum            'C178 H164 Co10 N9 O39'
_chemical_formula_weight         3642.48
_chemical_name_systematic
;
 ?
;
_space_group_IT_number           167
_symmetry_cell_setting           rhombohedral
_symmetry_space_group_name_Hall  '-R 3 2"c'
_symmetry_space_group_name_H-M   'R -3 c :H'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            6
_cell_length_a                   19.054(3)
_cell_length_b                   19.054(3)
_cell_length_c                   81.851(16)
_cell_measurement_reflns_used    48
_cell_measurement_temperature    220(2)
_cell_measurement_theta_max      15
_cell_measurement_theta_min      10
_cell_volume                     25735(8)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      220(2)
_diffrn_measured_fraction_theta_full 0.295
_diffrn_measured_fraction_theta_max 0.295
_diffrn_measurement_method       Omega
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.1312
_diffrn_reflns_av_sigmaI/netI    0.1088
_diffrn_reflns_limit_h_max       0
_diffrn_reflns_limit_h_min       -18
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       78
_diffrn_reflns_limit_l_min       -26
_diffrn_reflns_number            9949
_diffrn_reflns_theta_full        20.06
_diffrn_reflns_theta_max         20.06
_diffrn_reflns_theta_min         2.52
_exptl_absorpt_coefficient_mu    1.019
_exptl_absorpt_correction_T_max  0.768
_exptl_absorpt_correction_T_min  0.713
_exptl_absorpt_correction_type   'Psi Scans'
_exptl_crystal_colour            Colourless
_exptl_crystal_density_diffrn    1.410
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Block
_exptl_crystal_F_000             11262
_exptl_crystal_size_max          0.31
_exptl_crystal_size_mid          0.27
_exptl_crystal_size_min          0.19
_refine_diff_density_max         0.814
_refine_diff_density_min         -0.688
_refine_diff_density_rms         0.108
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.055
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     355
_refine_ls_number_reflns         2679
_refine_ls_number_restraints     360
_refine_ls_restrained_S_all      1.045
_refine_ls_R_factor_all          0.1299
_refine_ls_R_factor_gt           0.0715
_refine_ls_shift/su_max          0.008
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.1187P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1790
_refine_ls_wR_factor_ref         0.2127
_reflns_number_gt                1620
_reflns_number_total             2679
_reflns_threshold_expression     2sigma(I)
_cod_data_source_file            b000385isup1.cif
_cod_data_source_block           rh_co4
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Rhombohedral' changed to
'rhombohedral' according to
/home/saulius/struct/CIF-dictionaries/cif_core.dic dictionary named
'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 1891 2012-01-12 08:04:46Z andrius 

The following automatic conversions were performed:

'_refine_ls_weighting_scheme' value 'calc
w=1/[\s^2^(Fo^2^)+(0.1187P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3' was
changed to 'calc'. New tag '_refine_ls_weighting_details' was
created. The value of the new tag was set to
'w=1/[\s^2^(Fo^2^)+(0.1187P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3'.

Automatic conversion script
Id: cif_fix_values 3143 2015-03-26 13:38:13Z robertas 
;
_cod_original_cell_volume        25737(7)
_cod_original_sg_symbol_H-M      R-3c
_cod_database_code               7110849
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-y, x-y, z'
'-x+y, -x, z'
'y, x, -z+1/2'
'x-y, -y, -z+1/2'
'-x, -x+y, -z+1/2'
'x+2/3, y+1/3, z+1/3'
'-y+2/3, x-y+1/3, z+1/3'
'-x+y+2/3, -x+1/3, z+1/3'
'y+2/3, x+1/3, -z+5/6'
'x-y+2/3, -y+1/3, -z+5/6'
'-x+2/3, -x+y+1/3, -z+5/6'
'x+1/3, y+2/3, z+2/3'
'-y+1/3, x-y+2/3, z+2/3'
'-x+y+1/3, -x+2/3, z+2/3'
'y+1/3, x+2/3, -z+7/6'
'x-y+1/3, -y+2/3, -z+7/6'
'-x+1/3, -x+y+2/3, -z+7/6'
'-x, -y, -z'
'y, -x+y, -z'
'x-y, x, -z'
'-y, -x, z-1/2'
'-x+y, y, z-1/2'
'x, x-y, z-1/2'
'-x+2/3, -y+1/3, -z+1/3'
'y+2/3, -x+y+1/3, -z+1/3'
'x-y+2/3, x+1/3, -z+1/3'
'-y+2/3, -x+1/3, z-1/6'
'-x+y+2/3, y+1/3, z-1/6'
'x+2/3, x-y+1/3, z-1/6'
'-x+1/3, -y+2/3, -z+2/3'
'y+1/3, -x+y+2/3, -z+2/3'
'x-y+1/3, x+2/3, -z+2/3'
'-y+1/3, -x+2/3, z+1/6'
'-x+y+1/3, y+2/3, z+1/6'
'x+1/3, x-y+2/3, z+1/6'
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_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Co1 Co 0.77591(10) 0.32789(10) 0.04693(2) 0.0255(6) Uani 1 d U . .
Co2 Co 0.6667 0.3333 0.0833 0.0198(10) Uani 1 d SU . .
Co3 Co 0.82884(11) 0.3333 0.0833 0.0229(7) Uani 1 d SU . .
O1V O 0.7201(4) 0.2919(4) 0.07030(8) 0.0193(17) Uani 1 d U . .
H1V H 0.6890 0.2320 0.0708 0.023 Uiso 1 calc R . .
O1A O 0.8287(5) 0.2577(5) 0.04671(10) 0.039(2) Uani 1 d U . .
O2A O 0.8637(5) 0.2581(5) 0.07301(10) 0.036(2) Uani 1 d U . .
C1A C 0.8606(7) 0.2382(7) 0.05828(16) 0.028(3) Uani 1 d U . .
C2A C 0.9036(7) 0.1914(7) 0.05257(15) 0.029(2) Uani 1 d U . .
C3A C 0.9912(7) 0.2550(8) 0.04792(14) 0.031(3) Uani 1 d DU . .
C4A C 1.0498(8) 0.2315(9) 0.04618(15) 0.052(4) Uani 1 d DU . .
H4A H 1.0365 0.1780 0.0486 0.063 Uiso 1 calc R . .
C5A C 1.1276(9) 0.2870(11) 0.04085(18) 0.079(5) Uani 1 d DU . .
H5A H 1.1660 0.2700 0.0397 0.095 Uiso 1 calc R . .
C6A C 1.1493(10) 0.3641(11) 0.0373(2) 0.076(5) Uani 1 d DU . .
H6A H 1.2022 0.4008 0.0337 0.091 Uiso 1 calc R . .
C7A C 1.0942(9) 0.3872(9) 0.03888(18) 0.059(4) Uani 1 d DU . .
H7A H 1.1092 0.4412 0.0365 0.071 Uiso 1 calc R . .
C8A C 1.0160(8) 0.3346(9) 0.04388(17) 0.050(4) Uani 1 d DU . .
H8A H 0.9787 0.3531 0.0446 0.061 Uiso 1 calc R . .
C9A C 0.9065(7) 0.1392(8) 0.06666(15) 0.030(3) Uani 1 d DU . .
C10A C 0.8769(7) 0.0567(8) 0.06480(17) 0.047(4) Uani 1 d DU . .
H10A H 0.8509 0.0322 0.0549 0.056 Uiso 1 calc R . .
C11A C 0.8834(9) 0.0096(9) 0.07631(18) 0.064(4) Uani 1 d DU . .
H11A H 0.8629 -0.0461 0.0746 0.077 Uiso 1 calc R . .
C12A C 0.9217(9) 0.0470(10) 0.0908(2) 0.064(4) Uani 1 d DU . .
H12A H 0.9272 0.0166 0.0993 0.077 Uiso 1 calc R . .
C13A C 0.9516(10) 0.1291(10) 0.09278(19) 0.059(4) Uani 1 d DU . .
H13A H 0.9764 0.1536 0.1027 0.071 Uiso 1 calc R . .
C14A C 0.9463(8) 0.1759(9) 0.08068(16) 0.044(3) Uani 1 d DU . .
H14A H 0.9698 0.2322 0.0820 0.053 Uiso 1 calc R . .
C15A C 0.8594(8) 0.1422(7) 0.03732(15) 0.031(3) Uani 1 d DU . .
C16A C 0.7767(8) 0.0892(7) 0.03870(16) 0.041(3) Uani 1 d DU . .
H16A H 0.7500 0.0870 0.0485 0.049 Uiso 1 calc R . .
C17A C 0.7331(9) 0.0396(8) 0.02573(18) 0.054(4) Uani 1 d DU . .
H17A H 0.6771 0.0036 0.0269 0.064 Uiso 1 calc R . .
C18A C 0.7695(10) 0.0425(9) 0.01177(19) 0.060(4) Uani 1 d DU . .
H18A H 0.7399 0.0085 0.0030 0.072 Uiso 1 calc R . .
C19A C 0.8507(10) 0.0956(9) 0.01024(19) 0.061(4) Uani 1 d DU . .
H19A H 0.8766 0.0987 0.0003 0.073 Uiso 1 calc R . .
C20A C 0.8959(9) 0.1452(8) 0.02319(17) 0.048(4) Uani 1 d DU . .
H20A H 0.9519 0.1806 0.0220 0.057 Uiso 1 calc R . .
N1P N 0.5605(6) 0.1742(6) 0.02297(12) 0.032(3) Uani 1 d U . .
C2P C 0.6390(8) 0.2018(8) 0.02544(15) 0.028(3) Uani 1 d U . .
C3P C 0.6856(8) 0.1868(8) 0.01492(16) 0.046(4) Uani 1 d U . .
H3P H 0.7414 0.2087 0.0167 0.055 Uiso 1 calc R . .
C4P C 0.6483(10) 0.1389(10) 0.00170(19) 0.069(5) Uani 1 d U . .
H4P H 0.6786 0.1261 -0.0055 0.082 Uiso 1 calc R . .
C5P C 0.5666(9) 0.1086(10) -0.00132(18) 0.061(4) Uani 1 d U . .
H5P H 0.5416 0.0759 -0.0105 0.073 Uiso 1 calc R . .
C6P C 0.5227(9) 0.1275(9) 0.00946(18) 0.049(4) Uani 1 d U . .
C1MP C 0.4333(8) 0.0981(10) 0.00750(19) 0.071(5) Uani 1 d U . .
H1M1 H 0.4151 0.1185 0.0164 0.107 Uiso 1 calc R . .
H1M2 H 0.4032 0.0393 0.0076 0.107 Uiso 1 calc R . .
H1M3 H 0.4242 0.1176 -0.0028 0.107 Uiso 1 calc R . .
O2P O 0.6649(5) 0.2420(5) 0.03911(10) 0.030(2) Uani 1 d U . .
N1Q N 0.9485(6) 0.5523(6) 0.07223(12) 0.031(5) Uiso 0.50 d PDU A -1
H1Q H 0.9199 0.5457 0.0810 0.037 Uiso 0.50 calc PR A -1
C2Q C 0.9248(6) 0.4898(6) 0.06099(12) 0.045(4) Uani 1 d RDU . .
C3Q C 0.9715(6) 0.5009(6) 0.04714(12) 0.056(9) Uiso 0.50 d PRDU A -1
H3Q H 0.9552 0.4583 0.0396 0.067 Uiso 0.50 calc PR A -1
C4Q C 1.0456(16) 0.5781(16) 0.0442(3) 0.042(7) Uiso 0.50 d PDU A -1
H4Q H 1.0780 0.5855 0.0349 0.050 Uiso 0.50 calc PR A -1
C5Q C 1.0663(18) 0.6388(18) 0.0552(4) 0.055(8) Uiso 0.50 d PDU A -1
H5Q H 1.1124 0.6897 0.0533 0.066 Uiso 0.50 calc PR A -1
C6Q C 1.0197(14) 0.6265(13) 0.0692(3) 0.032(6) Uiso 0.50 d PDU A -1
C1MQ C 1.0372(14) 0.6874(13) 0.0822(3) 0.039(7) Uiso 0.50 d PDU A -1
H1M4 H 0.9959 0.6638 0.0906 0.058 Uiso 0.50 calc PR A -1
H1M5 H 1.0374 0.7342 0.0776 0.058 Uiso 0.50 calc PR A -1
H1M6 H 1.0899 0.7038 0.0870 0.058 Uiso 0.50 calc PR A -1
O2Q O 0.8723(5) 0.4161(5) 0.06264(10) 0.045(2) Uani 1 d DU . .
O1Q O 0.8872(11) 0.5209(10) 0.0698(2) 0.056(5) Uiso 0.50 d PDU A 2
O3Q O 0.9760(11) 0.5265(13) 0.0518(3) 0.096(8) Uiso 0.50 d PDU A 2
H3Q1 H 0.9946 0.4980 0.0484 0.144 Uiso 0.50 d PR A 2
O1S O 0.318(5) 0.594(4) 0.0271(9) 0.079(19) Uiso 0.17 d PDU B -1
H1S H 0.3461 0.5745 0.0302 0.119 Uiso 0.17 d PR B -1
C1S C 0.380(6) 0.675(4) 0.0271(13) 0.09(3) Uiso 0.17 d PDU B -1
H1S1 H 0.3506 0.7021 0.0299 0.141 Uiso 0.17 d PR B -1
H1S2 H 0.3967 0.6851 0.0157 0.141 Uiso 0.17 d PR B -1
H1S3 H 0.4281 0.6952 0.0339 0.141 Uiso 0.17 d PR B -1
O1W O 1.0000 0.0000 0.0195(10) 0.074(19) Uiso 0.25 d SPU C 1
O1X O 1.0000 0.0000 0.0326(9) 0.060(19) Uiso 0.25 d SPU D 2
O1Y O 1.0000 0.0000 0.0000 0.057(13) Uiso 0.50 d SPU E 3
O1Z O 0.3333 0.6667 0.0164(9) 0.068(19) Uiso 0.25 d SPU F 4
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'
O O 0.0106 0.0060 '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'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
O2P Co1 O1A 97.2(3) . .
O2P Co1 O2P 92.7(4) . 2_655
O1A Co1 O2P 155.3(3) . 2_655
O2P Co1 O1V 82.7(3) . .
O1A Co1 O1V 97.3(3) . .
O2P Co1 O1V 106.3(3) 2_655 .
O2P Co1 O2Q 161.0(3) . .
O1A Co1 O2Q 90.5(3) . .
O2P Co1 O2Q 87.3(3) 2_655 .
O1V Co1 O2Q 79.1(3) . .
O2P Co1 N1P 97.9(4) . 2_655
O1A Co1 N1P 95.3(4) . 2_655
O2P Co1 N1P 60.8(3) 2_655 2_655
O1V Co1 N1P 167.1(3) . 2_655
O2Q Co1 N1P 98.6(3) . 2_655
O1V Co2 O1V 91.5(3) . 3_665
O1V Co2 O1V 91.5(3) . 2_655
O1V Co2 O1V 91.5(3) 3_665 2_655
O1V Co2 O1V 83.8(4) . 17_554
O1V Co2 O1V 173.1(4) 3_665 17_554
O1V Co2 O1V 93.7(4) 2_655 17_554
O1V Co2 O1V 93.7(4) . 18_654
O1V Co2 O1V 83.8(4) 3_665 18_654
O1V Co2 O1V 173.1(4) 2_655 18_654
O1V Co2 O1V 91.5(3) 17_554 18_654
O1V Co2 O1V 173.1(4) . 16_544
O1V Co2 O1V 93.7(4) 3_665 16_544
O1V Co2 O1V 83.8(4) 2_655 16_544
O1V Co2 O1V 91.5(3) 17_554 16_544
O1V Co2 O1V 91.5(3) 18_654 16_544
O2A Co3 O2A 94.8(5) . 17_554
O2A Co3 O1V 97.6(3) . .
O2A Co3 O1V 161.5(3) 17_554 .
O2A Co3 O1V 161.5(3) . 17_554
O2A Co3 O1V 97.6(3) 17_554 17_554
O1V Co3 O1V 74.1(4) . 17_554
O2A Co3 O2Q 92.7(3) . .
O2A Co3 O2Q 85.9(3) 17_554 .
O1V Co3 O2Q 79.9(3) . .
O1V Co3 O2Q 101.9(3) 17_554 .
O2A Co3 O2Q 85.9(3) . 17_554
O2A Co3 O2Q 92.7(3) 17_554 17_554
O1V Co3 O2Q 101.9(3) . 17_554
O1V Co3 O2Q 79.9(3) 17_554 17_554
O2Q Co3 O2Q 177.9(5) . 17_554
Co2 O1V Co3 101.0(3) . .
Co2 O1V Co1 131.1(4) . .
Co3 O1V Co1 95.5(3) . .
C1A O1A Co1 130.4(8) . .
C1A O2A Co3 128.8(8) . .
O2A C1A O1A 125.5(11) . .
O2A C1A C2A 120.2(11) . .
O1A C1A C2A 114.1(11) . .
C15A C2A C9A 113.5(10) . .
C15A C2A C3A 109.1(10) . .
C9A C2A C3A 108.5(10) . .
C15A C2A C1A 108.0(10) . .
C9A C2A C1A 110.1(10) . .
C3A C2A C1A 107.4(10) . .
C8A C3A C4A 115.8(13) . .
C8A C3A C2A 124.1(11) . .
C4A C3A C2A 119.8(12) . .
C5A C4A C3A 120.3(15) . .
C6A C5A C4A 121.9(16) . .
C7A C6A C5A 118.4(16) . .
C6A C7A C8A 122.3(16) . .
C7A C8A C3A 121.3(14) . .
C14A C9A C10A 118.7(13) . .
C14A C9A C2A 119.4(12) . .
C10A C9A C2A 121.6(12) . .
C11A C10A C9A 123.9(14) . .
C10A C11A C12A 117.1(14) . .
C13A C12A C11A 119.5(15) . .
C14A C13A C12A 122.1(15) . .
C9A C14A C13A 118.6(14) . .
C20A C15A C16A 118.6(13) . .
C20A C15A C2A 124.3(12) . .
C16A C15A C2A 117.1(11) . .
C15A C16A C17A 120.6(13) . .
C18A C17A C16A 120.6(15) . .
C17A C18A C19A 119.1(14) . .
C18A C19A C20A 121.3(15) . .
C15A C20A C19A 119.8(14) . .
C2P N1P C6P 120.0(11) . .
C2P N1P Co1 90.3(7) . 3_665
C6P N1P Co1 149.3(9) . 3_665
O2P C2P N1P 112.5(10) . .
O2P C2P C3P 124.6(12) . .
N1P C2P C3P 122.8(12) . .
C4P C3P C2P 117.6(13) . .
C3P C4P C5P 121.4(14) . .
C6P C5P C4P 118.6(14) . .
N1P C6P C5P 119.5(13) . .
N1P C6P C1MP 117.0(13) . .
C5P C6P C1MP 123.6(13) . .
C2P O2P Co1 132.9(8) . .
C2P O2P Co1 96.3(7) . 3_665
Co1 O2P Co1 127.2(4) . 3_665
C2Q N1Q C6Q 118.8(10) . .
O3Q C2Q O2Q 134.9(15) . .
O3Q C2Q O1Q 124.1(15) . .
O2Q C2Q O1Q 97.6(9) . .
O3Q C2Q N1Q 95.7(13) . .
O2Q C2Q N1Q 128.4(6) . .
O1Q C2Q N1Q 44.3(8) . .
O3Q C2Q C3Q 24.6(13) . .
O2Q C2Q C3Q 110.4(6) . .
O1Q C2Q C3Q 144.2(8) . .
N1Q C2Q C3Q 120.0 . .
C2Q C3Q C4Q 120.8(11) . .
C5Q C4Q C3Q 118(2) . .
C4Q C5Q C6Q 121(3) . .
C5Q C6Q N1Q 122(2) . .
C5Q C6Q C1MQ 126(2) . .
N1Q C6Q C1MQ 112.7(18) . .
C2Q O2Q Co3 134.0(7) . .
C2Q O2Q Co1 133.5(7) . .
Co3 O2Q Co1 91.8(3) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Co1 O2P 2.025(8) .
Co1 O1A 2.036(8) .
Co1 O2P 2.103(8) 2_655
Co1 O1V 2.128(7) .
Co1 O2Q 2.183(8) .
Co1 N1P 2.220(10) 2_655
Co2 O1V 1.898(7) .
Co2 O1V 1.898(7) 3_665
Co2 O1V 1.898(7) 2_655
Co2 O1V 1.898(7) 17_554
Co2 O1V 1.898(7) 18_654
Co2 O1V 1.897(7) 16_544
Co3 O2A 2.040(8) .
Co3 O2A 2.040(8) 17_554
Co3 O1V 2.102(7) .
Co3 O1V 2.102(7) 17_554
Co3 O2Q 2.176(8) .
Co3 O2Q 2.176(8) 17_554
O1A C1A 1.276(14) .
O2A C1A 1.256(14) .
C1A C2A 1.555(16) .
C2A C15A 1.536(17) .
C2A C9A 1.541(17) .
C2A C3A 1.542(17) .
C3A C8A 1.385(18) .
C3A C4A 1.402(18) .
C4A C5A 1.39(2) .
C5A C6A 1.34(2) .
C6A C7A 1.33(2) .
C7A C8A 1.378(19) .
C9A C14A 1.361(17) .
C9A C10A 1.389(18) .
C10A C11A 1.349(18) .
C11A C12A 1.39(2) .
C12A C13A 1.38(2) .
C13A C14A 1.370(19) .
C15A C20A 1.336(17) .
C15A C16A 1.388(17) .
C16A C17A 1.388(18) .
C17A C18A 1.32(2) .
C18A C19A 1.37(2) .
C19A C20A 1.395(18) .
N1P C2P 1.330(15) .
N1P C6P 1.376(16) .
N1P Co1 2.220(10) 3_665
C2P O2P 1.305(13) .
C2P C3P 1.365(17) .
C3P C4P 1.365(19) .
C4P C5P 1.385(19) .
C5P C6P 1.38(2) .
C6P C1MP 1.512(19) .
O2P Co1 2.103(8) 3_665
N1Q C2Q 1.3899 .
N1Q C6Q 1.41(3) .
C2Q O3Q 1.152(14) .
C2Q O2Q 1.259(11) .
C2Q O1Q 1.347(14) .
C2Q C3Q 1.3900 .
C3Q C4Q 1.46(3) .
C4Q C5Q 1.36(4) .
C5Q C6Q 1.40(4) .
C6Q C1MQ 1.484(10) .
O1S C1S 1.40(2) .
