#------------------------------------------------------------------------------
#$Date: 2019-11-23 09:15:31 +0200 (Sat, 23 Nov 2019) $
#$Revision: 232681 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/34/80/4348037.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_4348037
loop_
_publ_author_name
'Axelson, Jordan C.'
'Gonzalez, Miguel I.'
'Meihaus, Katie R.'
'Chang, Christopher J.'
'Long, Jeffrey R.'
_publ_section_title
;
 Synthesis and Characterization of a Tetrapodal NO4(4-) Ligand and Its
 Transition Metal Complexes.
;
_journal_issue                   15
_journal_name_full               'Inorganic chemistry'
_journal_page_first              7527
_journal_page_last               7534
_journal_paper_doi               10.1021/acs.inorgchem.6b00908
_journal_volume                  55
_journal_year                    2016
_chemical_formula_moiety         'C26 H29 Co2 K3 N2 O22'
_chemical_formula_sum            'C26 H29 Co2 K3 N2 O22'
_chemical_formula_weight         956.67
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_date             2016-04-11
_audit_creation_method
;
Olex2 1.2
(compiled 2016.02.16 svn.r3265 for OlexSys, GUI svn.r5155)
;
_cell_angle_alpha                106.112(2)
_cell_angle_beta                 110.326(2)
_cell_angle_gamma                92.152(2)
_cell_formula_units_Z            2
_cell_length_a                   11.7659(5)
_cell_length_b                   12.2288(5)
_cell_length_c                   12.3782(5)
_cell_measurement_reflns_used    9958
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      38.789
_cell_measurement_theta_min      2.290
_cell_volume                     1586.67(12)
_computing_cell_refinement       'SAINT v8.34A (Bruker, 2013)'
_computing_data_collection       'Bruker APEX2'
_computing_data_reduction        'SAINT v8.34A (Bruker, 2013)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2015)'
_computing_structure_solution    'ShelXT (Sheldrick, 2015)'
_diffrn_ambient_temperature      100(2)
_diffrn_detector_area_resol_mean 10.42
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.979
_diffrn_measurement_device_type  'Bruker PHOTON100 CMOS diffractometer'
_diffrn_measurement_method       'ω/θ scans'
_diffrn_radiation_monochromator  'channel-cut Si(111) crystal'
_diffrn_radiation_type           synchrotron
_diffrn_radiation_wavelength     0.6888
_diffrn_reflns_av_R_equivalents  0.0509
_diffrn_reflns_av_unetI/netI     0.0793
_diffrn_reflns_Laue_measured_fraction_full 0.997
_diffrn_reflns_Laue_measured_fraction_max 0.979
_diffrn_reflns_limit_h_max       21
_diffrn_reflns_limit_h_min       -21
_diffrn_reflns_limit_k_max       22
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_number            47289
_diffrn_reflns_point_group_measured_fraction_full 0.997
_diffrn_reflns_point_group_measured_fraction_max 0.979
_diffrn_reflns_theta_full        24.411
_diffrn_reflns_theta_max         38.885
_diffrn_reflns_theta_min         2.050
_diffrn_source                   'Advanced Light Source station 11.3.1'
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    1.423
_exptl_absorpt_correction_T_max  0.948
_exptl_absorpt_correction_T_min  0.876
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
SADABS-2014/5 (Bruker,2014) was used for absorption correction.
wR2(int) was 0.0765 before and 0.0562 after correction.
The Ratio of minimum to maximum transmission is 0.9241.
The λ/2 correction factor is Not present.
;
_exptl_crystal_colour            violet
_exptl_crystal_density_diffrn    1.994
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       plate
_exptl_crystal_F_000             964
_exptl_crystal_size_max          0.071
_exptl_crystal_size_mid          0.054
_exptl_crystal_size_min          0.038
_refine_diff_density_max         1.775
_refine_diff_density_min         -1.289
_refine_diff_density_rms         0.151
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.019
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     521
_refine_ls_number_reflns         19702
_refine_ls_number_restraints     7
_refine_ls_restrained_S_all      1.019
_refine_ls_R_factor_all          0.0983
_refine_ls_R_factor_gt           0.0550
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0534P)²+0.7708P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1214
_refine_ls_wR_factor_ref         0.1402
_reflns_Friedel_coverage         0.000
_reflns_number_gt                12809
_reflns_number_total             19702
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            JA033S.cif
_cod_data_source_block           ja033s
_cod_database_code               4348037
_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.
;
_shelx_estimated_absorpt_t_max   0.948
_shelx_estimated_absorpt_t_min   0.906
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups
 At 1.5 times of:
  All C(H,H,H) groups, All C(H,H,H,H) groups, All C(H,H,H,H,H,H) groups
2. Restrained distances
 O20-H20A
 0.84 with sigma of 0.02
 O20-H20B
 0.84 with sigma of 0.02
 O18-H18
 0.84 with sigma of 0.02
 O19-H19A = O19-H19B
 0.84 with sigma of 0.02
 O9-H9A
 0.84 with sigma of 0.02
 O9-H9B
 0.84 with sigma of 0.02
3.a Aromatic/amide H refined with riding coordinates:
 C8(H8), C9(H9), C10(H10), C21(H21), C22(H22), C23(H23)
3.b Idealised Me refined as rotating group:
 C5(H5A,H5B,H5C), C13(H13A,H13B,H13C), C18(H18A,H18B,H18C), C26(H26A,H26B,H26C)
;
_shelx_shelxl_version_number     2014/7
_olex2_submission_special_instructions 'No special instructions were received'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'
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
Co1 Co -0.69047(2) 1.35919(2) -1.48109(2) 0.00799(5) Uani 1 1 d .
Co2 Co -0.69031(2) 0.87128(2) -1.97401(2) 0.00834(5) Uani 1 1 d .
K1 K -0.68910(4) 0.91509(4) -1.49140(4) 0.01491(7) Uani 1 1 d .
K2 K -0.49913(3) 1.24529(3) -1.75408(3) 0.01171(6) Uani 1 1 d .
K3 K -0.66036(4) 1.41303(4) -1.99751(4) 0.01841(8) Uani 1 1 d .
O1 O -0.63567(11) 1.51863(11) -1.43660(11) 0.0117(2) Uani 1 1 d .
O2 O -0.65821(11) 1.33266(11) -1.62457(12) 0.0112(2) Uani 1 1 d .
O3 O -0.74392(11) 1.20002(11) -1.52725(12) 0.0103(2) Uani 1 1 d .
O4 O -0.71725(11) 1.38652(11) -1.33506(11) 0.0110(2) Uani 1 1 d .
O5 O -0.64477(12) 1.67616(11) -1.49263(12) 0.0128(2) Uani 1 1 d .
O6 O -0.68317(12) 1.38219(12) -1.78965(12) 0.0133(2) Uani 1 1 d .
O7 O -0.86566(12) 1.06179(11) -1.52024(12) 0.0128(2) Uani 1 1 d .
O8 O -0.83357(12) 1.34537(11) -1.23980(11) 0.0127(2) Uani 1 1 d .
O9 O -0.53107(12) 1.33026(13) -1.39532(14) 0.0170(3) Uani 1 1 d D
O10 O -0.72897(12) 0.71095(11) -2.01430(12) 0.0127(2) Uani 1 1 d .
O11 O -0.71945(11) 0.89567(11) -1.82941(11) 0.0103(2) Uani 1 1 d .
O12 O -0.65080(12) 1.03264(12) -1.93407(11) 0.0132(2) Uani 1 1 d .
O13 O -0.65706(11) 0.84668(11) -2.11655(11) 0.0110(2) Uani 1 1 d .
O14 O -0.84587(13) 0.56364(11) -2.01582(12) 0.0142(2) Uani 1 1 d .
O15 O -0.82913(12) 0.84198(11) -1.73435(11) 0.0120(2) Uani 1 1 d .
O16 O -0.65770(14) 1.18260(12) -2.00208(13) 0.0193(3) Uani 1 1 d .
O17 O -0.69330(12) 0.88666(11) -2.28814(11) 0.0121(2) Uani 1 1 d .
O18 O -0.52535(13) 0.86010(17) -1.88602(13) 0.0261(4) Uani 1 1 d D
O19 O -0.42309(14) 0.93082(15) -1.38720(15) 0.0250(4) Uani 1 1 d D
O20 O -0.41783(13) 1.39667(13) -1.84949(14) 0.0197(3) Uani 1 1 d D
O21 O -0.53845(13) 1.13560(12) -1.33842(13) 0.0177(3) Uani 1 1 d .
O22 O -0.50899(16) 1.62194(14) -1.87431(15) 0.0302(4) Uani 1 1 d .
N1 N -0.85199(12) 1.38095(11) -1.56122(12) 0.0068(2) Uani 1 1 d .
N00S N -0.85582(12) 0.88020(11) -2.05781(12) 0.0067(2) Uani 1 1 d .
C1 C -0.67363(15) 1.57135(14) -1.51581(15) 0.0086(3) Uani 1 1 d .
C2 C -0.69478(14) 1.39811(14) -1.69187(15) 0.0089(3) Uani 1 1 d .
C3 C -0.83507(15) 1.16331(14) -1.50524(14) 0.0085(3) Uani 1 1 d .
C4 C -0.81407(14) 1.33505(14) -1.33283(14) 0.0084(3) Uani 1 1 d .
C5 C -0.78794(16) 1.57196(15) -1.73057(15) 0.0112(3) Uani 1 1 d .
H5A H -0.7120 1.6005 -1.7364 0.017 Uiso 1 1 calc GR
H5B H -0.8254 1.6373 -1.6988 0.017 Uiso 1 1 calc GR
H5C H -0.8449 1.5253 -1.8111 0.017 Uiso 1 1 calc GR
C6 C -0.75930(14) 1.49884(14) -1.64592(14) 0.0080(2) Uani 1 1 d .
C7 C -0.87289(14) 1.44559(13) -1.63646(14) 0.0076(2) Uani 1 1 d .
C8 C -0.99168(15) 1.45909(14) -1.70019(15) 0.0097(3) Uani 1 1 d .
H8 H -1.0070 1.5047 -1.7532 0.012 Uiso 1 1 calc R
C9 C -1.08746(15) 1.40432(15) -1.68443(15) 0.0105(3) Uani 1 1 d .
H9 H -1.1695 1.4118 -1.7277 0.013 Uiso 1 1 calc R
C10 C -1.06441(15) 1.33860(15) -1.60600(15) 0.0103(3) Uani 1 1 d .
H10 H -1.1300 1.3017 -1.5948 0.012 Uiso 1 1 calc R
H9A H -0.487(2) 1.326(2) -1.439(2) 0.016 Uiso 1 1 d DR
H18 H -0.491(2) 0.842(2) -1.930(2) 0.016 Uiso 1 1 d DR
H19A H -0.382(2) 0.971(2) -1.3135(16) 0.016 Uiso 1 1 d DR
H19B H -0.376(2) 0.8848(19) -1.405(2) 0.016 Uiso 1 1 d DR
H20A H -0.373(2) 1.374(2) -1.889(2) 0.016 Uiso 1 1 d DR
H20B H -0.384(2) 1.4655(15) -1.808(2) 0.016 Uiso 1 1 d DR
C11 C -0.94358(14) 1.32768(13) -1.54405(14) 0.0074(2) Uani 1 1 d .
C12 C -0.90742(14) 1.25663(13) -1.45749(14) 0.0076(2) Uani 1 1 d .
C13 C -1.01738(16) 1.20245(15) -1.44330(16) 0.0116(3) Uani 1 1 d .
H13A H -1.0735 1.1519 -1.5224 0.017 Uiso 1 1 calc GR
H13B H -1.0599 1.2631 -1.4112 0.017 Uiso 1 1 calc GR
H13C H -0.9898 1.1574 -1.3872 0.017 Uiso 1 1 calc GR
C14 C -0.82092(15) 0.66644(14) -1.99788(14) 0.0088(3) Uani 1 1 d .
C15 C -0.81144(14) 0.83587(14) -1.82753(14) 0.0080(2) Uani 1 1 d .
C16 C -0.68767(16) 1.07962(15) -2.01851(15) 0.0116(3) Uani 1 1 d .
C17 C -0.70220(14) 0.90526(14) -2.18860(15) 0.0088(3) Uani 1 1 d .
C18 C -1.00664(16) 0.69123(15) -1.93853(16) 0.0116(3) Uani 1 1 d .
H18A H -0.9750 0.6476 -1.8816 0.017 Uiso 1 1 calc GR
H18B H -1.0597 0.6384 -2.0176 0.017 Uiso 1 1 calc GR
H18C H -1.0538 0.7477 -1.9078 0.017 Uiso 1 1 calc GR
C19 C -0.90024(14) 0.75320(14) -1.95177(14) 0.0078(2) Uani 1 1 d .
C20 C -0.94317(14) 0.82271(13) -2.03948(14) 0.0073(2) Uani 1 1 d .
C21 C -1.06611(15) 0.82825(15) -2.09986(15) 0.0104(3) Uani 1 1 d .
H21 H -1.1288 0.7879 -2.0876 0.012 Uiso 1 1 calc R
C22 C -1.09527(16) 0.89393(16) -2.17843(16) 0.0124(3) Uani 1 1 d .
H22 H -1.1787 0.8986 -2.2203 0.015 Uiso 1 1 calc R
C23 C -1.00332(15) 0.95270(15) -2.19608(15) 0.0106(3) Uani 1 1 d .
H23 H -1.0228 0.9980 -2.2494 0.013 Uiso 1 1 calc R
C24 C -0.88237(14) 0.94387(13) -2.13418(14) 0.0074(2) Uani 1 1 d .
C25 C -0.77324(15) 1.00192(14) -2.14655(14) 0.0084(3) Uani 1 1 d .
C26 C -0.80982(17) 1.07140(15) -2.23481(15) 0.0115(3) Uani 1 1 d .
H26A H -0.8670 1.0217 -2.3138 0.017 Uiso 1 1 calc GR
H26B H -0.7366 1.1020 -2.2438 0.017 Uiso 1 1 calc GR
H26C H -0.8495 1.1352 -2.2037 0.017 Uiso 1 1 calc GR
H9B H -0.530(2) 1.2706(17) -1.376(2) 0.017 Uiso 1 1 d DR
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0030 0.0010 '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'
Co Co 0.3540 0.9120 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
K K 0.2030 0.2500 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0060 0.0030 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0110 0.0060 '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
O1 Co1 O9 92.25(6) . .
O2 Co1 O1 90.80(6) . .
O2 Co1 O9 91.48(6) . .
O3 Co1 O1 179.10(6) . .
O3 Co1 O2 88.32(6) . .
O3 Co1 O9 87.57(6) . .
O4 Co1 O1 88.63(6) . .
O4 Co1 O2 178.18(5) . .
O4 Co1 O3 92.24(5) . .
O4 Co1 O9 86.81(6) . .
N1 Co1 O1 90.62(6) . .
N1 Co1 O2 91.17(6) . .
N1 Co1 O3 89.61(6) . .
N1 Co1 O4 90.56(6) . .
N1 Co1 O9 176.07(6) . .
O10 Co2 O11 91.67(5) . .
O10 Co2 O12 179.64(6) . .
O10 Co2 O13 88.34(6) . .
O10 Co2 O18 88.96(7) . .
O10 Co2 N00S 90.05(6) . .
O11 Co2 O12 88.66(6) . .
O11 Co2 O13 178.58(5) . .
O11 Co2 O18 88.07(6) . .
O11 Co2 N00S 90.23(6) . .
O12 Co2 O18 90.91(7) . .
O13 Co2 O12 91.33(6) . .
O13 Co2 O18 90.51(6) . .
O13 Co2 N00S 91.19(6) . .
N00S Co2 O12 90.09(6) . .
N00S Co2 O18 178.01(6) . .
K2 K1 K1 93.133(13) 2_472 2_472
O5 K1 K1 103.34(3) 1_545 2_472
O5 K1 K2 42.63(3) 1_545 2_472
O5 K1 O19 125.89(4) 1_545 2_472
O5 K1 C13 81.39(4) 1_545 2_372
O7 K1 K1 110.71(3) . 2_472
O7 K1 K2 139.61(3) . 2_472
O7 K1 O5 144.91(4) . 1_545
O7 K1 O19 82.00(4) . 2_472
O7 K1 O19 138.75(5) . .
O7 K1 O21 79.49(4) . .
O7 K1 C13 63.51(4) . 2_372
O15 K1 K1 98.77(3) . 2_472
O15 K1 K2 134.52(3) . 2_472
O15 K1 O5 91.90(4) . 1_545
O15 K1 O7 75.08(4) . .
O15 K1 O19 73.23(4) . 2_472
O15 K1 O19 125.14(4) . .
O15 K1 O21 130.14(4) . .
O15 K1 C13 66.54(4) . 2_372
O17 K1 K1 121.21(3) 1_556 2_472
O17 K1 K2 42.66(3) 1_556 2_472
O17 K1 O5 71.30(4) 1_556 1_545
O17 K1 O7 97.15(4) 1_556 .
O17 K1 O15 138.91(4) 1_556 .
O17 K1 O19 87.47(5) 1_556 .
O17 K1 O19 146.78(4) 1_556 2_472
O17 K1 O21 85.91(4) 1_556 .
O17 K1 C13 73.86(4) 1_556 2_372
O19 K1 K1 34.36(3) 2_472 2_472
O19 K1 K1 38.42(4) . 2_472
O19 K1 K2 54.74(4) . 2_472
O19 K1 K2 127.47(3) 2_472 2_472
O19 K1 O5 75.22(4) . 1_545
O19 K1 O19 72.78(6) . 2_472
O19 K1 C13 153.83(5) . 2_372
O19 K1 C13 131.99(4) 2_472 2_372
O21 K1 K1 52.40(3) . 2_472
O21 K1 K2 91.31(3) . 2_472
O21 K1 O5 130.39(4) . 1_545
O21 K1 O19 61.17(4) . 2_472
O21 K1 O19 59.89(4) . .
O21 K1 C13 134.32(4) . 2_372
C13 K1 K1 164.92(3) 2_372 2_472
C13 K1 K2 99.74(3) 2_372 2_472
O1 K2 C2 70.42(4) 2_482 .
O1 K2 C16 154.21(4) 2_482 .
O1 K2 C17 108.44(4) 2_482 2_471
O2 K2 O1 72.65(4) . 2_482
O2 K2 O12 101.88(4) . .
O2 K2 C2 23.92(4) . .
O2 K2 C16 104.18(4) . .
O2 K2 C17 155.65(4) . 2_471
O5 K2 O1 43.66(4) 2_482 2_482
O5 K2 O2 72.36(4) 2_482 .
O5 K2 O12 138.23(4) 2_482 .
O5 K2 O13 107.88(4) 2_482 2_471
O5 K2 O16 174.75(4) 2_482 .
O5 K2 O17 72.05(4) 2_482 2_471
O5 K2 C2 87.33(4) 2_482 .
O5 K2 C16 161.15(4) 2_482 .
O5 K2 C17 91.53(4) 2_482 2_471
O6 K2 O1 78.19(4) . 2_482
O6 K2 O2 45.76(4) . .
O6 K2 O5 106.33(4) . 2_482
O6 K2 O12 95.92(4) . .
O6 K2 O13 134.90(4) . 2_471
O6 K2 O16 68.45(4) . .
O6 K2 O17 177.97(4) . 2_471
O6 K2 C2 22.46(4) . .
O6 K2 C16 81.76(4) . .
O6 K2 C17 158.27(4) . 2_471
O12 K2 O1 173.80(4) . 2_482
O12 K2 C2 103.38(4) . .
O12 K2 C16 23.09(4) . .
O12 K2 C17 77.76(4) . 2_471
O13 K2 O1 108.40(4) 2_471 2_482
O13 K2 O2 178.75(4) 2_471 .
O13 K2 O12 77.11(4) 2_471 .
O13 K2 C2 156.90(4) 2_471 .
O13 K2 C16 75.18(4) 2_471 .
O13 K2 C17 23.57(4) 2_471 2_471
O16 K2 O1 132.51(4) . 2_482
O16 K2 O2 103.47(4) . .
O16 K2 O12 45.03(4) . .
O16 K2 O13 76.36(4) . 2_471
O16 K2 C2 87.70(5) . .
O16 K2 C16 21.95(4) . .
O16 K2 C17 93.42(4) . 2_471
O17 K2 O1 99.78(4) 2_471 2_482
O17 K2 O2 133.86(4) 2_471 .
O17 K2 O12 86.11(4) 2_471 .
O17 K2 O13 45.53(3) 2_471 2_471
O17 K2 O16 113.15(4) 2_471 .
O17 K2 C2 156.77(4) 2_471 .
O17 K2 C16 100.15(4) 2_471 .
O17 K2 C17 22.42(4) 2_471 2_471
O20 K2 O1 66.23(4) . 2_482
O20 K2 O2 114.93(4) . .
O20 K2 O5 104.58(4) . 2_482
O20 K2 O6 77.39(4) . .
O20 K2 O12 114.67(4) . .
O20 K2 O13 66.25(4) . 2_471
O20 K2 O16 74.03(4) . .
O20 K2 O17 101.75(4) . 2_471
O20 K2 C2 93.54(4) . .
O20 K2 C16 93.72(5) . .
O20 K2 C17 86.33(4) . 2_471
C2 K2 C16 96.14(5) . .
C2 K2 C17 178.79(4) . 2_471
C17 K2 C16 85.07(4) 2_471 .
K2 K3 K3 99.786(15) . 2_481
O6 K3 K2 42.75(3) . .
O6 K3 K3 124.48(3) . 2_481
O6 K3 O8 129.60(4) . 1_554
O6 K3 O14 90.80(4) . 1_565
O6 K3 O16 68.69(4) . .
O6 K3 O20 75.39(4) . .
O6 K3 O22 139.41(4) . 2_481
O8 K3 K2 135.07(3) 1_554 .
O8 K3 K3 105.91(3) 1_554 2_481
O8 K3 O14 70.69(4) 1_554 1_565
O8 K3 O20 143.76(4) 1_554 .
O8 K3 O22 80.92(4) 1_554 2_481
O14 K3 K2 133.50(3) 1_565 .
O14 K3 K3 108.66(3) 1_565 2_481
O14 K3 O22 127.95(4) 1_565 2_481
O16 K3 K2 44.19(3) . .
O16 K3 K3 116.76(4) . 2_481
O16 K3 O8 91.03(4) . 1_554
O16 K3 O14 134.22(5) . 1_565
O16 K3 O20 73.18(5) . .
O16 K3 O22 87.36(5) . 2_481
O20 K3 K2 42.44(3) . .
O20 K3 K3 57.37(3) . 2_481
O20 K3 O14 142.46(4) . 1_565
O20 K3 O22 66.28(5) . 2_481
O22 K3 K2 97.34(3) 2_481 .
O22 K3 K2 97.39(4) . .
O22 K3 K3 42.49(4) . 2_481
O22 K3 K3 39.65(3) 2_481 2_481
O22 K3 O6 94.31(5) . .
O22 K3 O8 126.35(5) . 1_554
O22 K3 O14 81.12(5) . 1_565
O22 K3 O16 138.39(5) . .
O22 K3 O20 65.71(5) . .
O22 K3 O22 82.13(5) . 2_481
Co1 O1 K2 152.22(6) . 2_482
C1 O1 Co1 119.17(11) . .
C1 O1 K2 88.31(10) . 2_482
Co1 O2 K2 147.45(6) . .
C2 O2 Co1 119.61(11) . .
C2 O2 K2 89.81(9) . .
C3 O3 Co1 120.33(11) . .
C4 O4 Co1 120.52(11) . .
K2 O5 K1 90.91(4) 2_482 1_565
C1 O5 K1 155.76(12) . 1_565
C1 O5 K2 105.05(11) . 2_482
K2 O6 K3 94.01(4) . .
C2 O6 K2 97.83(10) . .
C2 O6 K3 163.65(12) . .
C3 O7 K1 119.77(11) . .
C4 O8 K3 127.97(11) . 1_556
Co1 O9 H9A 109.8(17) . .
Co1 O9 H9B 114.9(17) . .
H9A O9 H9B 108(2) . .
C14 O10 Co2 120.86(11) . .
C15 O11 Co2 120.43(11) . .
Co2 O12 K2 146.80(6) . .
C16 O12 Co2 118.89(11) . .
C16 O12 K2 93.39(10) . .
Co2 O13 K2 146.95(6) . 2_471
C17 O13 Co2 119.93(11) . .
C17 O13 K2 91.72(9) . 2_471
C14 O14 K3 121.83(12) . 1_545
C15 O15 K1 135.74(11) . .
K3 O16 K2 92.42(4) . .
C16 O16 K2 98.60(11) . .
C16 O16 K3 163.97(14) . .
K1 O17 K2 97.69(4) 1_554 2_471
C17 O17 K1 161.64(12) . 1_554
C17 O17 K2 96.91(10) . 2_471
Co2 O18 H18 109.9(19) . .
K1 O19 K1 107.22(5) . 2_472
K1 O19 K2 80.86(4) . 2_472
K1 O19 K2 171.58(5) 2_472 2_472
K1 O19 H19A 121.1(17) . .
K1 O19 H19A 96.4(17) 2_472 .
K1 O19 H19B 130.5(18) . .
K1 O19 H19B 84.4(17) 2_472 .
K2 O19 H19A 81.0(17) 2_472 .
K2 O19 H19B 88.5(17) 2_472 .
H19A O19 H19B 104(2) . .
K2 O20 K3 93.21(5) . .
K2 O20 H20A 118.0(18) . .
K2 O20 H20B 122.9(17) . .
K3 O20 H20A 113.8(18) . .
K3 O20 H20B 105.9(17) . .
H20A O20 H20B 102(2) . .
K3 O22 K3 97.87(5) . 2_481
C7 N1 Co1 119.45(11) . .
C11 N1 Co1 118.31(11) . .
C11 N1 C7 122.20(14) . .
C20 N00S Co2 118.74(11) . .
C20 N00S C24 122.26(14) . .
C24 N00S Co2 118.99(11) . .
O1 C1 K2 69.07(9) . 2_482
O1 C1 C6 117.56(14) . .
O5 C1 K2 53.90(9) . 2_482
O5 C1 O1 122.93(16) . .
O5 C1 C6 119.51(14) . .
C6 C1 K2 173.11(11) . 2_482
O2 C2 K2 66.27(8) . .
O2 C2 C6 116.93(14) . .
O6 C2 K2 59.72(9) . .
O6 C2 O2 123.24(15) . .
O6 C2 C6 119.81(15) . .
C6 C2 K2 164.27(11) . .
O3 C3 C12 116.06(14) . .
O7 C3 O3 123.59(15) . .
O7 C3 C12 120.36(15) . .
O4 C4 C12 115.99(14) . .
O8 C4 O4 123.40(15) . .
O8 C4 C12 120.61(15) . .
H5A C5 H5B 109.5 . .
H5A C5 H5C 109.5 . .
H5B C5 H5C 109.5 . .
C6 C5 H5A 109.5 . .
C6 C5 H5B 109.5 . .
C6 C5 H5C 109.5 . .
C2 C6 C1 108.35(13) . .
C5 C6 C1 110.96(13) . .
C5 C6 C2 110.13(13) . .
C5 C6 C7 113.19(13) . .
C7 C6 C1 107.21(13) . .
C7 C6 C2 106.79(13) . .
N1 C7 C6 115.38(13) . .
N1 C7 C8 120.45(15) . .
C8 C7 C6 124.17(14) . .
C7 C8 H8 120.9 . .
C9 C8 C7 118.29(15) . .
C9 C8 H8 120.9 . .
C8 C9 H9 119.7 . .
C8 C9 C10 120.59(15) . .
C10 C9 H9 119.7 . .
C9 C10 H10 120.5 . .
C9 C10 C11 118.97(15) . .
C11 C10 H10 120.5 . .
N1 C11 C10 119.50(14) . .
N1 C11 C12 116.86(13) . .
C10 C11 C12 123.63(14) . .
C3 C12 C4 105.29(12) . .
C11 C12 C3 108.05(13) . .
C11 C12 C4 108.65(13) . .
C13 C12 C3 111.19(13) . .
C13 C12 C4 111.02(13) . .
C13 C12 C11 112.34(13) . .
K1 C13 H13A 54.3 2_372 .
K1 C13 H13B 71.4 2_372 .
K1 C13 H13C 87.7 2_372 .
C12 C13 K1 160.57(11) . 2_372
C12 C13 H13A 109.5 . .
C12 C13 H13B 109.5 . .
C12 C13 H13C 109.5 . .
H13A C13 H13B 109.5 . .
H13A C13 H13C 109.5 . .
H13B C13 H13C 109.5 . .
O10 C14 C19 115.80(14) . .
O14 C14 O10 123.59(16) . .
O14 C14 C19 120.61(15) . .
O11 C15 C19 116.21(13) . .
O15 C15 O11 123.04(15) . .
O15 C15 C19 120.75(14) . .
O12 C16 K2 63.52(9) . .
O12 C16 C25 117.69(15) . .
O16 C16 K2 59.45(10) . .
O16 C16 O12 122.94(16) . .
O16 C16 C25 119.37(15) . .
C25 C16 K2 177.55(11) . .
O13 C17 K2 64.70(8) . 2_471
O13 C17 C25 116.89(14) . .
O17 C17 K2 60.67(9) . 2_471
O17 C17 O13 123.28(15) . .
O17 C17 C25 119.82(14) . .
C25 C17 K2 166.19(11) . 2_471
H18A C18 H18B 109.5 . .
H18A C18 H18C 109.5 . .
H18B C18 H18C 109.5 . .
C19 C18 H18A 109.5 . .
C19 C18 H18B 109.5 . .
C19 C18 H18C 109.5 . .
C15 C19 C14 105.49(13) . .
C18 C19 C14 111.13(14) . .
C18 C19 C15 111.29(13) . .
C18 C19 C20 112.20(13) . .
C20 C19 C14 108.07(12) . .
C20 C19 C15 108.37(13) . .
N00S C20 C19 116.72(13) . .
N00S C20 C21 119.89(15) . .
C21 C20 C19 123.38(15) . .
C20 C21 H21 120.7 . .
C22 C21 C20 118.70(16) . .
C22 C21 H21 120.7 . .
C21 C22 H22 119.8 . .
C23 C22 C21 120.43(15) . .
C23 C22 H22 119.8 . .
C22 C23 H23 120.7 . .
C24 C23 C22 118.58(15) . .
C24 C23 H23 120.7 . .
N00S C24 C23 120.13(15) . .
N00S C24 C25 115.81(13) . .
C23 C24 C25 124.05(14) . .
C17 C25 C16 107.23(13) . .
C24 C25 C16 107.95(13) . .
C24 C25 C17 106.73(13) . .
C24 C25 C26 113.03(13) . .
C26 C25 C16 110.83(14) . .
C26 C25 C17 110.80(13) . .
C25 C26 H26A 109.5 . .
C25 C26 H26B 109.5 . .
C25 C26 H26C 109.5 . .
H26A C26 H26B 109.5 . .
H26A C26 H26C 109.5 . .
H26B C26 H26C 109.5 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Co1 O1 1.8931(13) .
Co1 O2 1.8872(13) .
Co1 O3 1.8847(13) .
Co1 O4 1.8833(13) .
Co1 O9 1.9090(13) .
Co1 N1 1.8818(13) .
Co2 O10 1.8794(14) .
Co2 O11 1.8836(12) .
Co2 O12 1.8933(14) .
Co2 O13 1.8843(12) .
Co2 O18 1.8989(14) .
Co2 N00S 1.8857(13) .
K1 K1 4.9364(9) 2_472
K1 K2 4.1162(6) 2_472
K1 O5 2.9841(14) 1_545
K1 O7 2.7896(14) .
K1 O15 2.7410(13) .
K1 O17 2.6503(13) 1_556
K1 O19 2.9170(16) .
K1 O19 3.212(2) 2_472
K1 O21 2.9110(16) .
K1 C13 3.4190(17) 2_372
K2 O1 3.1136(13) 2_482
K2 O2 2.9153(13) .
K2 O5 2.7880(14) 2_482
K2 O6 2.7757(13) .
K2 O12 2.9299(14) .
K2 O13 2.8993(13) 2_471
K2 O16 2.8460(15) .
K2 O17 2.8148(13) 2_471
K2 O20 2.7571(17) .
K2 C2 3.1844(16) .
K2 C16 3.2675(17) .
K2 C17 3.2054(17) 2_471
K3 K3 4.2894(9) 2_481
K3 O6 2.8010(13) .
K3 O8 2.8429(14) 1_554
K3 O14 2.8978(14) 1_565
K3 O16 2.8044(15) .
K3 O20 2.8555(16) .
K3 O22 2.7628(18) .
K3 O22 2.925(2) 2_481
O1 K2 3.1136(13) 2_482
O1 C1 1.282(2) .
O2 C2 1.291(2) .
O3 C3 1.289(2) .
O4 C4 1.293(2) .
O5 K1 2.9842(13) 1_565
O5 K2 2.7880(14) 2_482
O5 C1 1.239(2) .
O6 C2 1.228(2) .
O7 C3 1.224(2) .
O8 K3 2.8429(14) 1_556
O8 C4 1.225(2) .
O9 H9A 0.863(16) .
O9 H9B 0.831(16) .
O10 C14 1.295(2) .
O11 C15 1.294(2) .
O12 C16 1.284(2) .
O13 K2 2.8993(13) 2_471
O13 C17 1.283(2) .
O14 K3 2.8978(14) 1_545
O14 C14 1.220(2) .
O15 C15 1.224(2) .
O16 C16 1.235(2) .
O17 K1 2.6503(13) 1_554
O17 K2 2.8148(13) 2_471
O17 C17 1.232(2) .
O18 H18 0.784(16) .
O19 K1 3.212(2) 2_472
O19 K2 3.404(2) 2_472
O19 H19A 0.857(16) .
O19 H19B 0.841(16) .
O20 H20A 0.840(16) .
O20 H20B 0.851(16) .
O22 K3 2.925(2) 2_481
N1 C7 1.348(2) .
N1 C11 1.347(2) .
N00S C20 1.341(2) .
N00S C24 1.349(2) .
C1 K2 3.3321(17) 2_482
C1 C6 1.552(2) .
C2 C6 1.549(2) .
C3 C12 1.557(2) .
C4 C12 1.559(2) .
C5 H5A 0.9800 .
C5 H5B 0.9800 .
C5 H5C 0.9800 .
C5 C6 1.519(2) .
C6 C7 1.520(2) .
C7 C8 1.388(2) .
C8 H8 0.9500 .
C8 C9 1.388(2) .
C9 H9 0.9500 .
C9 C10 1.389(2) .
C10 H10 0.9500 .
C10 C11 1.393(2) .
C11 C12 1.520(2) .
C12 C13 1.517(2) .
C13 K1 3.4190(17) 2_372
C13 H13A 0.9800 .
C13 H13B 0.9800 .
C13 H13C 0.9800 .
C14 C19 1.559(2) .
C15 C19 1.556(2) .
C16 C25 1.553(2) .
C17 K2 3.2054(17) 2_471
C17 C25 1.550(2) .
C18 H18A 0.9800 .
C18 H18B 0.9800 .
C18 H18C 0.9800 .
C18 C19 1.519(2) .
C19 C20 1.523(2) .
C20 C21 1.393(2) .
C21 H21 0.9500 .
C21 C22 1.390(2) .
C22 H22 0.9500 .
C22 C23 1.389(3) .
C23 H23 0.9500 .
C23 C24 1.387(2) .
C24 C25 1.518(2) .
C25 C26 1.522(2) .
C26 H26A 0.9800 .
C26 H26B 0.9800 .
C26 H26C 0.9800 .
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_site_symmetry_A
O9 H9A O5 0.863(16) 2.006(17) 2.856(2) 168(2) 2_482
O19 H19A O11 0.857(16) 2.000(18) 2.821(2) 160(2) 2_472
O19 H19B O3 0.841(16) 2.056(17) 2.8782(19) 166(2) 2_472
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_4
Co1 O1 C1 K2 175.69(11) . 2_482
Co1 O1 C1 O5 177.81(13) . .
Co1 O1 C1 C6 -2.26(19) . .
Co1 O2 C2 K2 165.38(11) . .
Co1 O2 C2 O6 -175.82(13) . .
Co1 O2 C2 C6 2.44(19) . .
Co1 O3 C3 O7 -171.49(13) . .
Co1 O3 C3 C12 8.69(19) . .
Co1 O4 C4 O8 176.54(13) . .
Co1 O4 C4 C12 -3.24(19) . .
Co1 N1 C7 C6 -1.83(19) . .
Co1 N1 C7 C8 177.45(12) . .
Co1 N1 C11 C10 -177.47(12) . .
Co1 N1 C11 C12 1.74(19) . .
Co2 O10 C14 O14 -175.63(13) . .
Co2 O10 C14 C19 3.94(19) . .
Co2 O11 C15 O15 174.23(12) . .
Co2 O11 C15 C19 -5.34(19) . .
Co2 O12 C16 K2 -171.93(12) . .
Co2 O12 C16 O16 -174.04(15) . .
Co2 O12 C16 C25 5.7(2) . .
Co2 O13 C17 K2 170.06(12) . 2_471
Co2 O13 C17 O17 -173.35(13) . .
Co2 O13 C17 C25 5.3(2) . .
Co2 N00S C20 C19 -0.50(19) . .
Co2 N00S C20 C21 179.73(12) . .
Co2 N00S C24 C23 -179.41(12) . .
Co2 N00S C24 C25 0.91(18) . .
K1 O5 C1 K2 -129.6(3) 1_565 2_482
K1 O5 C1 O1 -132.1(2) 1_565 .
K1 O5 C1 C6 48.0(3) 1_565 .
K1 O7 C3 O3 30.8(2) . .
K1 O7 C3 C12 -149.42(11) . .
K1 O15 C15 O11 -20.1(3) . .
K1 O15 C15 C19 159.41(11) . .
K1 O17 C17 K2 -142.5(4) 1_554 2_471
K1 O17 C17 O13 -159.7(3) 1_554 .
K1 O17 C17 C25 21.6(5) 1_554 .
K2 O1 C1 O5 2.12(16) 2_482 .
K2 O1 C1 C6 -177.95(12) 2_482 .
K2 O2 C2 O6 18.80(17) . .
K2 O2 C2 C6 -162.94(12) . .
K2 O5 C1 O1 -2.45(19) 2_482 .
K2 O5 C1 C6 177.62(11) 2_482 .
K2 O6 C2 O2 -19.98(18) . .
K2 O6 C2 C6 161.81(12) . .
K2 O12 C16 O16 -2.10(19) . .
K2 O12 C16 C25 177.61(13) . .
K2 O13 C17 O17 16.60(17) 2_471 .
K2 O13 C17 C25 -164.72(12) 2_471 .
K2 O16 C16 O12 2.2(2) . .
K2 O16 C16 C25 -177.52(13) . .
K2 O17 C17 O13 -17.23(18) 2_471 .
K2 O17 C17 C25 164.12(13) 2_471 .
K2 C2 C6 C1 -43.6(4) . .
K2 C2 C6 C5 77.9(4) . .
K2 C2 C6 C7 -158.8(3) . .
K2 C17 C25 C16 -40.1(5) 2_471 .
K2 C17 C25 C24 -155.5(4) 2_471 .
K2 C17 C25 C26 81.0(5) 2_471 .
K3 O6 C2 K2 -136.0(4) . .
K3 O6 C2 O2 -156.0(3) . .
K3 O6 C2 C6 25.8(5) . .
K3 O8 C4 O4 -22.4(2) 1_556 .
K3 O8 C4 C12 157.37(11) 1_556 .
K3 O14 C14 O10 26.9(2) 1_545 .
K3 O14 C14 C19 -152.65(11) 1_545 .
K3 O16 C16 K2 -132.9(5) . .
K3 O16 C16 O12 -130.7(4) . .
K3 O16 C16 C25 49.6(5) . .
O1 Co1 O2 K2 105.10(12) . .
O1 Co1 O2 C2 -46.93(13) . .
O1 Co1 O4 C4 138.73(13) . .
O1 Co1 N1 C7 46.79(12) . .
O1 Co1 N1 C11 -135.36(12) . .
O1 C1 C6 C2 -54.65(18) . .
O1 C1 C6 C5 -175.66(14) . .
O1 C1 C6 C7 60.27(18) . .
O2 Co1 O1 K2 -142.52(13) . 2_482
O2 Co1 O1 C1 46.75(13) . .
O2 Co1 O3 C3 -143.29(13) . .
O2 Co1 N1 C7 -44.02(12) . .
O2 Co1 N1 C11 133.82(12) . .
O2 C2 C6 C1 54.38(18) . .
O2 C2 C6 C5 175.91(14) . .
O2 C2 C6 C7 -60.82(18) . .
O3 Co1 O2 K2 -74.69(12) . .
O3 Co1 O2 C2 133.28(13) . .
O3 Co1 O4 C4 -41.51(13) . .
O3 Co1 N1 C7 -132.34(12) . .
O3 Co1 N1 C11 45.51(12) . .
O3 C3 C12 C4 -63.63(17) . .
O3 C3 C12 C11 52.33(18) . .
O3 C3 C12 C13 176.05(14) . .
O4 Co1 O1 K2 35.75(13) . 2_482
O4 Co1 O1 C1 -134.98(13) . .
O4 Co1 O3 C3 38.44(13) . .
O4 Co1 N1 C7 135.43(12) . .
O4 Co1 N1 C11 -46.72(12) . .
O4 C4 C12 C3 60.27(17) . .
O4 C4 C12 C11 -55.28(18) . .
O4 C4 C12 C13 -179.29(14) . .
O5 C1 C6 C2 125.28(16) . .
O5 C1 C6 C5 4.3(2) . .
O5 C1 C6 C7 -119.80(16) . .
O6 C2 C6 C1 -127.30(16) . .
O6 C2 C6 C5 -5.8(2) . .
O6 C2 C6 C7 117.50(17) . .
O7 C3 C12 C4 116.54(16) . .
O7 C3 C12 C11 -127.49(16) . .
O7 C3 C12 C13 -3.8(2) . .
O8 C4 C12 C3 -119.52(16) . .
O8 C4 C12 C11 124.93(16) . .
O8 C4 C12 C13 0.9(2) . .
O9 Co1 O1 K2 -51.01(14) . 2_482
O9 Co1 O1 C1 138.26(13) . .
O9 Co1 O2 K2 12.83(12) . .
O9 Co1 O2 C2 -139.20(13) . .
O9 Co1 O3 C3 125.16(13) . .
O9 Co1 O4 C4 -128.95(13) . .
O10 Co2 O11 C15 -40.84(13) . .
O10 Co2 O13 K2 -66.39(12) . 2_471
O10 Co2 O13 C17 132.06(13) . .
O10 Co2 N00S C20 46.18(12) . .
O10 Co2 N00S C24 -133.70(12) . .
O10 C14 C19 C15 -60.53(17) . .
O10 C14 C19 C18 178.75(14) . .
O10 C14 C19 C20 55.22(18) . .
O11 Co2 O10 C14 41.65(13) . .
O11 Co2 O12 K2 54.90(12) . .
O11 Co2 O12 C16 -139.92(13) . .
O11 Co2 N00S C20 -45.49(12) . .
O11 Co2 N00S C24 134.64(12) . .
O11 C15 C19 C14 61.43(17) . .
O11 C15 C19 C18 -177.94(14) . .
O11 C15 C19 C20 -54.11(18) . .
O12 Co2 O11 C15 139.29(13) . .
O12 Co2 O13 K2 113.49(12) . 2_471
O12 Co2 O13 C17 -48.06(13) . .
O12 Co2 N00S C20 -134.15(12) . .
O12 Co2 N00S C24 45.97(12) . .
O12 C16 C25 C17 -59.92(19) . .
O12 C16 C25 C24 54.8(2) . .
O12 C16 C25 C26 179.04(15) . .
O13 Co2 O10 C14 -139.77(13) . .
O13 Co2 O12 K2 -123.68(11) . .
O13 Co2 O12 C16 41.50(13) . .
O13 Co2 N00S C20 134.52(12) . .
O13 Co2 N00S C24 -45.36(12) . .
O13 C17 C25 C16 53.14(19) . .
O13 C17 C25 C24 -62.34(18) . .
O13 C17 C25 C26 174.21(14) . .
O14 C14 C19 C15 119.06(17) . .
O14 C14 C19 C18 -1.7(2) . .
O14 C14 C19 C20 -125.20(16) . .
O15 C15 C19 C14 -118.15(16) . .
O15 C15 C19 C18 2.5(2) . .
O15 C15 C19 C20 126.31(16) . .
O16 C16 C25 C17 119.81(18) . .
O16 C16 C25 C24 -125.52(17) . .
O16 C16 C25 C26 -1.2(2) . .
O17 C17 C25 C16 -128.13(16) . .
O17 C17 C25 C24 116.39(17) . .
O17 C17 C25 C26 -7.1(2) . .
O18 Co2 O10 C14 129.69(13) . .
O18 Co2 O11 C15 -129.75(13) . .
O18 Co2 O12 K2 -33.15(12) . .
O18 Co2 O12 C16 132.03(14) . .
O18 Co2 O13 K2 22.56(13) . 2_471
O18 Co2 O13 C17 -138.99(14) . .
N1 Co1 O1 K2 126.29(13) . 2_482
N1 Co1 O1 C1 -44.43(13) . .
N1 Co1 O2 K2 -164.27(12) . .
N1 Co1 O2 C2 43.70(13) . .
N1 Co1 O3 C3 -52.11(13) . .
N1 Co1 O4 C4 48.12(13) . .
N1 C7 C8 C9 -0.1(2) . .
N1 C11 C12 C3 -58.02(18) . .
N1 C11 C12 C4 55.74(18) . .
N1 C11 C12 C13 178.96(14) . .
N00S Co2 O10 C14 -48.58(13) . .
N00S Co2 O11 C15 49.21(13) . .
N00S Co2 O12 K2 145.13(12) . .
N00S Co2 O12 C16 -49.70(13) . .
N00S Co2 O13 K2 -156.40(12) . 2_471
N00S Co2 O13 C17 42.05(13) . .
N00S C20 C21 C22 0.0(2) . .
N00S C24 C25 C16 -57.53(18) . .
N00S C24 C25 C17 57.46(17) . .
N00S C24 C25 C26 179.51(14) . .
C1 C6 C7 N1 -56.58(17) . .
C1 C6 C7 C8 124.17(16) . .
C2 C6 C7 N1 59.37(17) . .
C2 C6 C7 C8 -119.87(17) . .
C3 C12 C13 K1 -92.5(3) . 2_372
C4 C12 C13 K1 150.7(3) . 2_372
C5 C6 C7 N1 -179.27(14) . .
C5 C6 C7 C8 1.5(2) . .
C6 C7 C8 C9 179.09(15) . .
C7 N1 C11 C10 0.3(2) . .
C7 N1 C11 C12 179.52(14) . .
C7 C8 C9 C10 0.5(3) . .
C8 C9 C10 C11 -0.5(3) . .
C9 C10 C11 N1 0.1(2) . .
C9 C10 C11 C12 -179.04(15) . .
C10 C11 C12 C3 121.15(17) . .
C10 C11 C12 C4 -125.10(16) . .
C10 C11 C12 C13 -1.9(2) . .
C11 N1 C7 C6 -179.59(14) . .
C11 N1 C7 C8 -0.3(2) . .
C11 C12 C13 K1 28.8(4) . 2_372
C14 C19 C20 N00S -56.78(18) . .
C14 C19 C20 C21 122.98(16) . .
C15 C19 C20 N00S 57.06(18) . .
C15 C19 C20 C21 -123.17(16) . .
C18 C19 C20 N00S -179.66(14) . .
C18 C19 C20 C21 0.1(2) . .
C19 C20 C21 C22 -179.73(15) . .
C20 N00S C24 C23 0.7(2) . .
C20 N00S C24 C25 -178.96(14) . .
C20 C21 C22 C23 0.0(3) . .
C21 C22 C23 C24 0.3(3) . .
C22 C23 C24 N00S -0.7(2) . .
C22 C23 C24 C25 178.99(16) . .
C23 C24 C25 C16 122.81(17) . .
C23 C24 C25 C17 -122.20(16) . .
C23 C24 C25 C26 -0.1(2) . .
C24 N00S C20 C19 179.38(14) . .
C24 N00S C20 C21 -0.4(2) . .
