#------------------------------------------------------------------------------
#$Date: 2019-11-28 18:34:26 +0200 (Thu, 28 Nov 2019) $
#$Revision: 244298 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/23/86/7238698.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_7238698
loop_
_publ_author_name
'Wang, Yan-Qin'
'Cheng, Ai-Ling'
'Wang, Xuan'
'Gao, En-Qing'
_publ_section_title
;
 Mixed azide and carboxylate bridged trinuclear Mn(ii) and Co(ii) motifs
 in coordination ladders: structures and magnetism
;
_journal_issue                   27
_journal_name_full               'RSC Advances'
_journal_page_first              10352
_journal_paper_doi               10.1039/c2ra21173d
_journal_volume                  2
_journal_year                    2012
_chemical_formula_sum            'C40 H40 Mn3 N22 O12'
_chemical_formula_weight         1185.76
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                106.489(3)
_cell_angle_beta                 100.946(3)
_cell_angle_gamma                90.640(3)
_cell_formula_units_Z            1
_cell_length_a                   8.9045(11)
_cell_length_b                   10.3308(12)
_cell_length_c                   14.0372(17)
_cell_measurement_reflns_used    8561
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      28.32
_cell_measurement_theta_min      2.53
_cell_volume                     1212.8(3)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'Bruker SHELXTL'
_computing_structure_solution    'Bruker SHELXTL'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.983
_diffrn_measured_fraction_theta_max 0.983
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_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  0.0208
_diffrn_reflns_av_sigmaI/netI    0.0213
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       14
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_number            15107
_diffrn_reflns_theta_full        26.01
_diffrn_reflns_theta_max         26.01
_diffrn_reflns_theta_min         1.54
_exptl_absorpt_coefficient_mu    0.855
_exptl_absorpt_correction_T_max  0.9831
_exptl_absorpt_correction_T_min  0.9348
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS (Bruker, 1999)'
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.624
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       plate
_exptl_crystal_F_000             605
_exptl_crystal_size_max          0.08
_exptl_crystal_size_mid          0.05
_exptl_crystal_size_min          0.02
_refine_diff_density_max         0.415
_refine_diff_density_min         -0.205
_refine_diff_density_rms         0.051
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.050
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     365
_refine_ls_number_reflns         4688
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.050
_refine_ls_R_factor_all          0.0332
_refine_ls_R_factor_gt           0.0289
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0476P)²+0.3707P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0784
_refine_ls_wR_factor_ref         0.0815
_reflns_number_gt                4186
_reflns_number_total             4688
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c2ra21173d.txt
_cod_data_source_block           1
_cod_depositor_comments
;
The following automatic conversions were performed:

data item '_symmetry_cell_setting' value 'Triclinic' was changed to
'triclinic' in accordance with the
/home/saulius/struct/COD-crude-data/automatic-downloads/DataCite-retrospective/RSC/depositions/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 last updated on
2011-04-26.

Automatic conversion script
Id: cif_fix_values 6909 2019-04-08 15:41:33Z antanas 
;
_cod_original_sg_symbol_H-M      'P-1 '
_cod_database_code               7238698
loop_
_symmetry_equiv_pos_as_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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
Mn1 Mn 0.34320(3) 0.11806(2) 0.642568(19) 0.02518(9) Uani 1 1 d .
Mn2 Mn 0.0000 0.0000 0.5000 0.02567(10) Uani 1 2 d S
C1 C 0.1974(2) 0.22746(17) 0.46618(13) 0.0298(4) Uani 1 1 d .
C2 C 0.2027(2) 0.33753(17) 0.41421(13) 0.0279(4) Uani 1 1 d .
C3 C 0.0698(2) 0.39234(19) 0.37984(15) 0.0336(4) Uani 1 1 d .
H3A H -0.0239 0.3646 0.3904 0.040 Uiso 1 1 calc R
C4 C 0.0772(2) 0.48828(19) 0.32983(15) 0.0347(4) Uani 1 1 d .
H4A H -0.0114 0.5273 0.3080 0.042 Uiso 1 1 calc R
C5 C 0.3426(2) 0.47539(18) 0.34645(14) 0.0324(4) Uani 1 1 d .
H5A H 0.4349 0.5041 0.3346 0.039 Uiso 1 1 calc R
C6 C 0.3409(2) 0.38167(18) 0.39864(14) 0.0319(4) Uani 1 1 d .
H6A H 0.4319 0.3480 0.4234 0.038 Uiso 1 1 calc R
C7 C 0.2150(2) 0.61492(17) 0.24641(14) 0.0332(4) Uani 1 1 d .
H7A H 0.3089 0.6732 0.2701 0.040 Uiso 1 1 calc R
H7B H 0.1293 0.6720 0.2507 0.040 Uiso 1 1 calc R
C8 C 0.20609(19) 0.53295(17) 0.13712(13) 0.0274(4) Uani 1 1 d .
C9 C 0.1643(2) 0.39537(18) 0.10405(15) 0.0334(4) Uani 1 1 d .
H9A H 0.1436 0.3521 0.1503 0.040 Uiso 1 1 calc R
C10 C 0.1528(2) 0.32122(19) 0.00379(15) 0.0359(4) Uani 1 1 d .
H10A H 0.1244 0.2290 -0.0169 0.043 Uiso 1 1 calc R
C11 C 0.1833(2) 0.3841(2) -0.06525(15) 0.0383(4) Uani 1 1 d .
H11A H 0.1757 0.3346 -0.1328 0.046 Uiso 1 1 calc R
C12 C 0.2253(2) 0.52119(19) -0.03385(14) 0.0350(4) Uani 1 1 d .
H12A H 0.2457 0.5634 -0.0808 0.042 Uiso 1 1 calc R
C13 C 0.23738(19) 0.59695(17) 0.06653(14) 0.0279(4) Uani 1 1 d .
C14 C 0.2803(2) 0.74753(18) 0.10133(14) 0.0324(4) Uani 1 1 d .
H14A H 0.1942 0.7956 0.1232 0.039 Uiso 1 1 calc R
H14B H 0.3655 0.7680 0.1589 0.039 Uiso 1 1 calc R
C15 C 0.2195(2) 0.8463(2) -0.03948(17) 0.0407(5) Uani 1 1 d .
H15A H 0.1198 0.8528 -0.0284 0.049 Uiso 1 1 calc R
C16 C 0.2583(2) 0.8891(2) -0.11577(16) 0.0417(5) Uani 1 1 d .
H16A H 0.1855 0.9259 -0.1555 0.050 Uiso 1 1 calc R
C17 C 0.4052(2) 0.87801(17) -0.13398(14) 0.0295(4) Uani 1 1 d .
C18 C 0.5089(2) 0.8209(2) -0.07416(15) 0.0356(4) Uani 1 1 d .
H18A H 0.6079 0.8097 -0.0859 0.043 Uiso 1 1 calc R
C19 C 0.4664(2) 0.7806(2) 0.00250(15) 0.0360(4) Uani 1 1 d .
H19A H 0.5371 0.7430 0.0429 0.043 Uiso 1 1 calc R
C20 C 0.4515(2) 0.93488(18) -0.21390(14) 0.0315(4) Uani 1 1 d .
N1 N 0.41206(19) 0.31453(17) 0.75458(13) 0.0397(4) Uani 1 1 d .
N2 N 0.3543(2) 0.41215(18) 0.74574(13) 0.0413(4) Uani 1 1 d .
N3 N 0.2995(3) 0.5121(2) 0.7386(2) 0.0695(6) Uani 1 1 d .
N4 N 0.08738(17) 0.13841(15) 0.65596(12) 0.0316(3) Uani 1 1 d .
N5 N 0.04222(17) 0.11252(14) 0.72278(12) 0.0306(3) Uani 1 1 d .
N6 N -0.0031(2) 0.09121(19) 0.78970(14) 0.0479(4) Uani 1 1 d .
N7 N 0.24037(17) -0.07206(15) 0.51701(12) 0.0309(3) Uani 1 1 d .
N8 N 0.25912(18) -0.18220(15) 0.53014(12) 0.0348(3) Uani 1 1 d .
N9 N 0.2778(3) -0.28607(19) 0.54258(18) 0.0614(6) Uani 1 1 d .
N10 N 0.21188(17) 0.52595(14) 0.31232(11) 0.0289(3) Uani 1 1 d .
N11 N 0.32372(17) 0.79517(14) 0.01951(11) 0.0302(3) Uani 1 1 d .
O1 O 0.07374(16) 0.15817(14) 0.44414(11) 0.0407(3) Uani 1 1 d .
O2 O 0.31770(15) 0.21667(14) 0.52479(10) 0.0383(3) Uani 1 1 d .
O3 O 0.35940(16) 1.01046(14) -0.24535(11) 0.0404(3) Uani 1 1 d .
O4 O 0.57640(17) 0.90590(18) -0.23818(13) 0.0538(4) Uani 1 1 d .
O5 O 0.58198(16) 0.06969(15) 0.63728(12) 0.0372(3) Uani 1 1 d .
H5W1 H 0.598(3) 0.009(3) 0.664(2) 0.057(8) Uiso 1 1 d .
H5W2 H 0.631(3) 0.066(3) 0.596(2) 0.055(8) Uiso 1 1 d .
O6 O 0.1287(2) 0.1060(2) 0.13660(19) 0.0756(6) Uani 1 1 d .
H6W1 H 0.222(4) 0.110(3) 0.168(3) 0.089(11) Uiso 1 1 d .
H6W2 H 0.087(4) 0.049(3) 0.162(2) 0.077(9) Uiso 1 1 d .
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'
Mn Mn 0.3368 0.7283 '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'
O O 0.0106 0.0060 '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'
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
O2 Mn1 O3 176.74(5) . 1_546
O2 Mn1 N1 88.96(6) . .
O3 Mn1 N1 93.98(6) 1_546 .
O2 Mn1 O5 95.37(6) . .
O3 Mn1 O5 85.90(6) 1_546 .
N1 Mn1 O5 92.77(6) . .
O2 Mn1 N7 85.90(5) . .
O3 Mn1 N7 91.02(6) 1_546 .
N1 Mn1 N7 171.52(6) . .
O5 Mn1 N7 94.42(6) . .
O2 Mn1 N4 92.47(5) . .
O3 Mn1 N4 86.05(5) 1_546 .
N1 Mn1 N4 91.90(6) . .
O5 Mn1 N4 170.95(6) . .
N7 Mn1 N4 81.60(5) . .
O1 Mn2 O1 180.000(1) 2_556 .
O1 Mn2 N4 93.01(5) 2_556 .
O1 Mn2 N4 86.99(5) . .
O1 Mn2 N4 86.99(5) 2_556 2_556
O1 Mn2 N4 93.01(5) . 2_556
N4 Mn2 N4 180.0 . 2_556
O1 Mn2 N7 89.77(5) 2_556 .
O1 Mn2 N7 90.23(5) . .
N4 Mn2 N7 83.92(6) . .
N4 Mn2 N7 96.08(6) 2_556 .
O1 Mn2 N7 90.23(5) 2_556 2_556
O1 Mn2 N7 89.77(5) . 2_556
N4 Mn2 N7 96.08(6) . 2_556
N4 Mn2 N7 83.92(6) 2_556 2_556
N7 Mn2 N7 180.0 . 2_556
O1 C1 O2 127.96(16) . .
O1 C1 C2 115.81(16) . .
O2 C1 C2 116.22(15) . .
C3 C2 C6 119.23(15) . .
C3 C2 C1 120.61(16) . .
C6 C2 C1 120.15(16) . .
C4 C3 C2 119.36(16) . .
C4 C3 H3A 120.3 . .
C2 C3 H3A 120.3 . .
N10 C4 C3 120.37(17) . .
N10 C4 H4A 119.8 . .
C3 C4 H4A 119.8 . .
N10 C5 C6 120.39(16) . .
N10 C5 H5A 119.8 . .
C6 C5 H5A 119.8 . .
C5 C6 C2 119.44(16) . .
C5 C6 H6A 120.3 . .
C2 C6 H6A 120.3 . .
N10 C7 C8 111.23(14) . .
N10 C7 H7A 109.4 . .
C8 C7 H7A 109.4 . .
N10 C7 H7B 109.4 . .
C8 C7 H7B 109.4 . .
H7A C7 H7B 108.0 . .
C9 C8 C13 118.70(17) . .
C9 C8 C7 121.44(15) . .
C13 C8 C7 119.84(15) . .
C10 C9 C8 121.40(17) . .
C10 C9 H9A 119.3 . .
C8 C9 H9A 119.3 . .
C11 C10 C9 119.83(17) . .
C11 C10 H10A 120.1 . .
C9 C10 H10A 120.1 . .
C10 C11 C12 119.71(18) . .
C10 C11 H11A 120.1 . .
C12 C11 H11A 120.1 . .
C11 C12 C13 121.13(17) . .
C11 C12 H12A 119.4 . .
C13 C12 H12A 119.4 . .
C12 C13 C8 119.23(16) . .
C12 C13 C14 121.57(16) . .
C8 C13 C14 119.19(16) . .
N11 C14 C13 111.73(15) . .
N11 C14 H14A 109.3 . .
C13 C14 H14A 109.3 . .
N11 C14 H14B 109.3 . .
C13 C14 H14B 109.3 . .
H14A C14 H14B 107.9 . .
N11 C15 C16 120.61(17) . .
N11 C15 H15A 119.7 . .
C16 C15 H15A 119.7 . .
C15 C16 C17 120.24(17) . .
C15 C16 H16A 119.9 . .
C17 C16 H16A 119.9 . .
C16 C17 C18 117.92(16) . .
C16 C17 C20 120.16(16) . .
C18 C17 C20 121.83(16) . .
C19 C18 C17 120.24(17) . .
C19 C18 H18A 119.9 . .
C17 C18 H18A 119.9 . .
N11 C19 C18 120.39(17) . .
N11 C19 H19A 119.8 . .
C18 C19 H19A 119.8 . .
O4 C20 O3 127.06(17) . .
O4 C20 C17 117.94(16) . .
O3 C20 C17 114.95(16) . .
N2 N1 Mn1 121.59(14) . .
N1 N2 N3 178.3(2) . .
N5 N4 Mn2 116.57(12) . .
N5 N4 Mn1 120.80(12) . .
Mn2 N4 Mn1 93.46(6) . .
N6 N5 N4 177.89(18) . .
N8 N7 Mn2 118.51(12) . .
N8 N7 Mn1 119.78(12) . .
Mn2 N7 Mn1 94.01(6) . .
N9 N8 N7 179.6(2) . .
C5 N10 C4 121.14(15) . .
C5 N10 C7 118.96(15) . .
C4 N10 C7 119.66(15) . .
C19 N11 C15 120.55(15) . .
C19 N11 C14 119.07(15) . .
C15 N11 C14 120.31(15) . .
C1 O1 Mn2 131.35(12) . .
C1 O2 Mn1 127.81(11) . .
C20 O3 Mn1 135.81(12) . 1_564
Mn1 O5 H5W1 106.3(19) . .
Mn1 O5 H5W2 132(2) . .
H5W1 O5 H5W2 112(3) . .
H6W1 O6 H6W2 100(3) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Mn1 O2 2.1544(12) .
Mn1 O3 2.1546(12) 1_546
Mn1 N1 2.1822(17) .
Mn1 O5 2.1997(14) .
Mn1 N7 2.2769(15) .
Mn1 N4 2.3280(16) .
Mn2 O1 2.1482(12) 2_556
Mn2 O1 2.1482(12) .
Mn2 N4 2.2347(15) .
Mn2 N4 2.2347(15) 2_556
Mn2 N7 2.2660(15) .
Mn2 N7 2.2660(15) 2_556
C1 O1 1.244(2) .
C1 O2 1.248(2) .
C1 C2 1.520(2) .
C2 C3 1.381(3) .
C2 C6 1.385(2) .
C3 C4 1.375(3) .
C3 H3A 0.9300 .
C4 N10 1.343(2) .
C4 H4A 0.9300 .
C5 N10 1.342(2) .
C5 C6 1.371(2) .
C5 H5A 0.9300 .
C6 H6A 0.9300 .
C7 N10 1.481(2) .
C7 C8 1.514(3) .
C7 H7A 0.9700 .
C7 H7B 0.9700 .
C8 C9 1.386(2) .
C8 C13 1.403(2) .
C9 C10 1.382(3) .
C9 H9A 0.9300 .
C10 C11 1.374(3) .
C10 H10A 0.9300 .
C11 C12 1.383(3) .
C11 H11A 0.9300 .
C12 C13 1.387(3) .
C12 H12A 0.9300 .
C13 C14 1.513(2) .
C14 N11 1.482(2) .
C14 H14A 0.9700 .
C14 H14B 0.9700 .
C15 N11 1.339(2) .
C15 C16 1.367(3) .
C15 H15A 0.9300 .
C16 C17 1.379(3) .
C16 H16A 0.9300 .
C17 C18 1.380(3) .
C17 C20 1.523(2) .
C18 C19 1.371(3) .
C18 H18A 0.9300 .
C19 N11 1.339(2) .
C19 H19A 0.9300 .
C20 O4 1.239(2) .
C20 O3 1.245(2) .
N1 N2 1.164(2) .
N2 N3 1.169(3) .
N4 N5 1.182(2) .
N5 N6 1.163(2) .
N7 N8 1.212(2) .
N8 N9 1.144(2) .
O3 Mn1 2.1546(12) 1_564
O5 H5W1 0.82(3) .
O5 H5W2 0.78(3) .
O6 H6W1 0.85(4) .
O6 H6W2 0.88(3) .
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
O1 C1 C2 C3 25.0(3) . .
O2 C1 C2 C3 -155.74(18) . .
O1 C1 C2 C6 -153.46(17) . .
O2 C1 C2 C6 25.8(3) . .
C6 C2 C3 C4 0.8(3) . .
C1 C2 C3 C4 -177.66(17) . .
C2 C3 C4 N10 1.7(3) . .
N10 C5 C6 C2 1.2(3) . .
C3 C2 C6 C5 -2.2(3) . .
C1 C2 C6 C5 176.25(17) . .
N10 C7 C8 C9 13.8(2) . .
N10 C7 C8 C13 -167.57(15) . .
C13 C8 C9 C10 -0.2(3) . .
C7 C8 C9 C10 178.50(17) . .
C8 C9 C10 C11 0.1(3) . .
C9 C10 C11 C12 0.0(3) . .
C10 C11 C12 C13 0.1(3) . .
C11 C12 C13 C8 -0.1(3) . .
C11 C12 C13 C14 -178.83(17) . .
C9 C8 C13 C12 0.2(3) . .
C7 C8 C13 C12 -178.51(17) . .
C9 C8 C13 C14 178.91(16) . .
C7 C8 C13 C14 0.2(2) . .
C12 C13 C14 N11 -6.8(2) . .
C8 C13 C14 N11 174.51(15) . .
N11 C15 C16 C17 1.1(3) . .
C15 C16 C17 C18 1.0(3) . .
C15 C16 C17 C20 -175.60(19) . .
C16 C17 C18 C19 -1.8(3) . .
C20 C17 C18 C19 174.73(18) . .
C17 C18 C19 N11 0.6(3) . .
C16 C17 C20 O4 -169.8(2) . .
C18 C17 C20 O4 13.7(3) . .
C16 C17 C20 O3 12.6(3) . .
C18 C17 C20 O3 -163.93(18) . .
O2 Mn1 N1 N2 38.30(16) . .
O3 Mn1 N1 N2 -140.31(16) 1_546 .
O5 Mn1 N1 N2 133.62(16) . .
N7 Mn1 N1 N2 -14.4(5) . .
N4 Mn1 N1 N2 -54.14(16) . .
Mn1 N1 N2 N3 -162(7) . .
O1 Mn2 N4 N5 -17.85(14) 2_556 .
O1 Mn2 N4 N5 162.15(14) . .
N4 Mn2 N4 N5 126(100) 2_556 .
N7 Mn2 N4 N5 -107.30(14) . .
N7 Mn2 N4 N5 72.70(14) 2_556 .
O1 Mn2 N4 Mn1 109.29(5) 2_556 .
O1 Mn2 N4 Mn1 -70.71(5) . .
N4 Mn2 N4 Mn1 -107(100) 2_556 .
N7 Mn2 N4 Mn1 19.84(5) . .
N7 Mn2 N4 Mn1 -160.16(5) 2_556 .
O2 Mn1 N4 N5 -170.47(14) . .
O3 Mn1 N4 N5 12.43(14) 1_546 .
N1 Mn1 N4 N5 -81.43(14) . .
O5 Mn1 N4 N5 39.6(4) . .
N7 Mn1 N4 N5 104.05(14) . .
O2 Mn1 N4 Mn2 65.64(6) . .
O3 Mn1 N4 Mn2 -111.46(6) 1_546 .
N1 Mn1 N4 Mn2 154.68(6) . .
O5 Mn1 N4 Mn2 -84.3(4) . .
N7 Mn1 N4 Mn2 -19.84(5) . .
Mn2 N4 N5 N6 -133(5) . .
Mn1 N4 N5 N6 114(5) . .
O1 Mn2 N7 N8 13.85(14) 2_556 .
O1 Mn2 N7 N8 -166.15(14) . .
N4 Mn2 N7 N8 106.89(14) . .
N4 Mn2 N7 N8 -73.11(14) 2_556 .
N7 Mn2 N7 N8 -125(100) 2_556 .
O1 Mn2 N7 Mn1 -113.36(6) 2_556 .
O1 Mn2 N7 Mn1 66.64(6) . .
N4 Mn2 N7 Mn1 -20.32(6) . .
N4 Mn2 N7 Mn1 159.68(6) 2_556 .
N7 Mn2 N7 Mn1 107(100) 2_556 .
O2 Mn1 N7 N8 160.21(14) . .
O3 Mn1 N7 N8 -20.83(14) 1_546 .
N1 Mn1 N7 N8 -147.0(4) . .
O5 Mn1 N7 N8 65.14(14) . .
N4 Mn1 N7 N8 -106.68(14) . .
O2 Mn1 N7 Mn2 -73.53(5) . .
O3 Mn1 N7 Mn2 105.43(5) 1_546 .
N1 Mn1 N7 Mn2 -20.7(4) . .
O5 Mn1 N7 Mn2 -168.61(6) . .
N4 Mn1 N7 Mn2 19.57(5) . .
Mn2 N7 N8 N9 -179(100) . .
Mn1 N7 N8 N9 -65(29) . .
C6 C5 N10 C4 1.2(3) . .
C6 C5 N10 C7 -173.13(17) . .
C3 C4 N10 C5 -2.7(3) . .
C3 C4 N10 C7 171.63(17) . .
C8 C7 N10 C5 82.5(2) . .
C8 C7 N10 C4 -91.9(2) . .
C18 C19 N11 C15 1.5(3) . .
C18 C19 N11 C14 178.50(18) . .
C16 C15 N11 C19 -2.4(3) . .
C16 C15 N11 C14 -179.29(19) . .
C13 C14 N11 C19 -82.1(2) . .
C13 C14 N11 C15 94.8(2) . .
O2 C1 O1 Mn2 4.6(3) . .
C2 C1 O1 Mn2 -176.21(12) . .
O1 Mn2 O1 C1 -158(100) 2_556 .
N4 Mn2 O1 C1 49.13(17) . .
N4 Mn2 O1 C1 -130.87(17) 2_556 .
N7 Mn2 O1 C1 -34.77(18) . .
N7 Mn2 O1 C1 145.23(18) 2_556 .
O1 C1 O2 Mn1 -19.6(3) . .
C2 C1 O2 Mn1 161.21(12) . .
O3 Mn1 O2 C1 40.1(10) 1_546 .
N1 Mn1 O2 C1 -114.47(16) . .
O5 Mn1 O2 C1 152.84(16) . .
N7 Mn1 O2 C1 58.78(16) . .
N4 Mn1 O2 C1 -22.61(16) . .
O4 C20 O3 Mn1 5.3(3) . 1_564
C17 C20 O3 Mn1 -177.32(13) . 1_564
