#------------------------------------------------------------------------------
#$Date: 2016-03-25 23:13:35 +0200 (Fri, 25 Mar 2016) $
#$Revision: 180030 $
#$URL: svn://www.crystallography.net/cod/cif/7/03/24/7032483.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_7032483
loop_
_publ_author_name
'Han, Min-Le'
'Duan, Ya-Ping'
'Li, Dong-Sheng'
'Xu, Guo-Wang'
'Wu, Ya-Pan'
'Zhao, Jun'
_publ_section_title
;
 A series of divalent metal coordination polymers based on isomeric
 tetracarboxylic acids: synthesis, structures and magnetic properties.
;
_journal_issue                   46
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              17519
_journal_page_last               17527
_journal_paper_doi               10.1039/c4dt01946f
_journal_volume                  43
_journal_year                    2014
_chemical_formula_sum            'C32 H24 Mn N2 O10'
_chemical_formula_weight         651.47
_chemical_name_systematic
;

 ?

;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_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                99.384(6)
_cell_angle_beta                 99.642(6)
_cell_angle_gamma                94.786(6)
_cell_formula_units_Z            2
_cell_length_a                   10.454(5)
_cell_length_b                   10.739(5)
_cell_length_c                   13.686(7)
_cell_measurement_reflns_used    3678
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      27.5
_cell_measurement_theta_min      1.9
_cell_volume                     1484.8(12)
_computing_cell_refinement       'Bruker XSCANS'
_computing_data_collection       'Bruker XSCANS'
_computing_data_reduction        'Bruker SHELXTL'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.995
_diffrn_measured_fraction_theta_max 0.995
_diffrn_measurement_device_type  'Bruker P4'
_diffrn_measurement_method       'ω 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  0.0500
_diffrn_reflns_av_unetI/netI     0.0516
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_number            15990
_diffrn_reflns_theta_full        27.52
_diffrn_reflns_theta_max         27.52
_diffrn_reflns_theta_min         1.53
_exptl_absorpt_coefficient_mu    0.507
_exptl_absorpt_correction_T_max  0.8966
_exptl_absorpt_correction_T_min  0.8836
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            pink
_exptl_crystal_density_diffrn    1.457
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             670
_exptl_crystal_size_max          0.25
_exptl_crystal_size_mid          0.24
_exptl_crystal_size_min          0.22
_refine_diff_density_max         0.340
_refine_diff_density_min         -0.442
_refine_diff_density_rms         0.086
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.080
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     418
_refine_ls_number_reflns         6797
_refine_ls_number_restraints     8
_refine_ls_restrained_S_all      1.085
_refine_ls_R_factor_all          0.0637
_refine_ls_R_factor_gt           0.0473
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0709P)²+0.1715P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1263
_refine_ls_wR_factor_ref         0.1435
_reflns_number_gt                5414
_reflns_number_total             6797
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c4dt01946f2.cif
_cod_data_source_block           z
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to
/usr/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 2281 2013-09-26 08:29:07Z andrius 

 Adding full bibliography for 7032483--7032487.cif.
;
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               7032483
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 0.53783(3) 0.43247(3) 0.17973(2) 0.03639(12) Uani 1 1 d .
O1 O 0.4500(2) 0.26850(16) 0.07628(14) 0.0561(5) Uani 1 1 d .
O2 O 0.45597(19) 0.20250(16) -0.08319(14) 0.0537(5) Uani 1 1 d .
O3 O 0.3146(2) 0.0607(2) -0.22084(14) 0.0657(6) Uani 1 1 d D
H3A H 0.367(3) 0.111(3) -0.170(2) 0.099 Uiso 1 1 d D
O4 O 0.14825(18) -0.08480(18) -0.24399(12) 0.0494(4) Uani 1 1 d .
O5 O -0.30238(15) -0.51582(16) 0.11180(13) 0.0446(4) Uani 1 1 d .
O6 O -0.13476(17) -0.59041(18) 0.19846(16) 0.0578(5) Uani 1 1 d .
O7 O 0.13658(19) -0.0852(2) 0.56616(13) 0.0593(5) Uani 1 1 d D
H7A H 0.139(4) -0.095(3) 0.6268(16) 0.089 Uiso 1 1 d D
O8 O 0.3321(2) -0.1559(2) 0.58378(13) 0.0612(5) Uani 1 1 d .
O9 O 0.42520(16) 0.55557(16) 0.09159(13) 0.0418(4) Uani 1 1 d D
H9A H 0.461(3) 0.6285(18) 0.095(2) 0.063 Uiso 1 1 d D
H9B H 0.379(3) 0.528(2) 0.0328(15) 0.063 Uiso 1 1 d D
O10 O 0.66060(19) 0.3167(2) 0.26704(18) 0.0740(7) Uani 1 1 d D
H10B H 0.6594 0.2578 0.3063 0.111 Uiso 1 1 d RD
H10A H 0.7385 0.3417 0.2524 0.111 Uiso 1 1 d RD
N1 N 0.3771(2) 0.42305(19) 0.27431(15) 0.0448(5) Uani 1 1 d .
N2 N 0.5887(2) 0.5976(2) 0.31285(17) 0.0534(5) Uani 1 1 d .
C1 C 0.4220(2) 0.1875(2) -0.00158(18) 0.0372(5) Uani 1 1 d .
C2 C 0.3384(2) 0.06685(18) 0.00500(16) 0.0312(4) Uani 1 1 d .
C3 C 0.2552(2) -0.01686(19) -0.07517(15) 0.0312(4) Uani 1 1 d .
C4 C 0.2369(2) -0.0137(2) -0.18635(16) 0.0380(5) Uani 1 1 d .
C5 C 0.1758(2) -0.11520(19) -0.05195(15) 0.0324(4) Uani 1 1 d .
H5 H 0.1215 -0.1710 -0.1045 0.039 Uiso 1 1 calc R
C6 C 0.1744(2) -0.13331(19) 0.04592(15) 0.0306(4) Uani 1 1 d .
C7 C 0.2577(2) -0.05128(19) 0.12543(15) 0.0312(4) Uani 1 1 d .
C8 C 0.3393(2) 0.0452(2) 0.10263(16) 0.0333(4) Uani 1 1 d .
H8 H 0.3971 0.0976 0.1552 0.040 Uiso 1 1 calc R
C9 C 0.0844(2) -0.23879(19) 0.06409(15) 0.0313(4) Uani 1 1 d .
C10 C -0.0490(2) -0.2468(2) 0.02812(18) 0.0398(5) Uani 1 1 d .
H10 H -0.0811 -0.1901 -0.0120 0.048 Uiso 1 1 calc R
C11 C -0.1348(2) -0.3384(2) 0.05140(18) 0.0416(5) Uani 1 1 d .
H11 H -0.2240 -0.3415 0.0281 0.050 Uiso 1 1 calc R
C12 C -0.0883(2) -0.4256(2) 0.10936(16) 0.0339(4) Uani 1 1 d .
C13 C 0.0452(2) -0.4217(2) 0.14083(18) 0.0387(5) Uani 1 1 d .
H13 H 0.0778 -0.4817 0.1772 0.046 Uiso 1 1 calc R
C14 C 0.1307(2) -0.3291(2) 0.11857(17) 0.0370(5) Uani 1 1 d .
H14 H 0.2201 -0.3275 0.1404 0.044 Uiso 1 1 calc R
C15 C -0.1802(2) -0.5190(2) 0.14192(18) 0.0385(5) Uani 1 1 d .
C16 C 0.2563(2) -0.0603(2) 0.23285(15) 0.0322(4) Uani 1 1 d .
C17 C 0.1404(2) -0.0538(2) 0.26983(16) 0.0411(5) Uani 1 1 d .
H17 H 0.0652 -0.0395 0.2282 0.049 Uiso 1 1 calc R
C18 C 0.1359(2) -0.0684(2) 0.36801(16) 0.0415(5) Uani 1 1 d .
H18 H 0.0581 -0.0631 0.3921 0.050 Uiso 1 1 calc R
C19 C 0.2468(2) -0.0909(2) 0.43012(15) 0.0370(5) Uani 1 1 d .
C20 C 0.3634(2) -0.0926(2) 0.39467(16) 0.0409(5) Uani 1 1 d .
H20 H 0.4390 -0.1050 0.4368 0.049 Uiso 1 1 calc R
C21 C 0.3685(2) -0.0759(2) 0.29726(17) 0.0403(5) Uani 1 1 d .
H21 H 0.4478 -0.0751 0.2749 0.048 Uiso 1 1 calc R
C22 C 0.2438(3) -0.1142(2) 0.53438(16) 0.0413(5) Uani 1 1 d .
C23 C 0.2668(3) 0.3428(3) 0.2472(2) 0.0540(6) Uani 1 1 d .
H23 H 0.2604 0.2779 0.1920 0.065 Uiso 1 1 calc R
C24 C 0.1623(3) 0.3510(3) 0.2963(3) 0.0660(8) Uani 1 1 d .
H24 H 0.0882 0.2922 0.2761 0.079 Uiso 1 1 calc R
C25 C 0.1714(4) 0.4486(4) 0.3760(3) 0.0812(11) Uani 1 1 d .
H25 H 0.1017 0.4582 0.4098 0.097 Uiso 1 1 calc R
C26 C 0.2828(4) 0.5321(3) 0.4060(3) 0.0727(9) Uani 1 1 d .
H26 H 0.2895 0.5981 0.4604 0.087 Uiso 1 1 calc R
C27 C 0.3861(3) 0.5171(2) 0.35405(19) 0.0503(6) Uani 1 1 d .
C28 C 0.5112(3) 0.6017(2) 0.38237(19) 0.0524(7) Uani 1 1 d .
C29 C 0.5478(4) 0.6814(3) 0.4757(2) 0.0664(9) Uani 1 1 d .
H29 H 0.4943 0.6814 0.5236 0.080 Uiso 1 1 calc R
C30 C 0.6627(4) 0.7598(3) 0.4968(3) 0.0783(11) Uani 1 1 d .
H30 H 0.6879 0.8136 0.5588 0.094 Uiso 1 1 calc R
C31 C 0.7402(4) 0.7578(3) 0.4250(3) 0.0828(11) Uani 1 1 d .
H31 H 0.8182 0.8111 0.4371 0.099 Uiso 1 1 calc R
C32 C 0.6998(4) 0.6744(3) 0.3338(3) 0.0702(9) Uani 1 1 d .
H32 H 0.7528 0.6724 0.2855 0.084 Uiso 1 1 calc R
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'
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'
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 Mn1 O5 100.22(8) . 1_665
O1 Mn1 O10 90.52(9) . .
O5 Mn1 O10 89.69(7) 1_665 .
O1 Mn1 O9 91.43(8) . .
O5 Mn1 O9 87.28(7) 1_665 .
O10 Mn1 O9 176.64(7) . .
O1 Mn1 N2 164.85(8) . .
O5 Mn1 N2 94.92(8) 1_665 .
O10 Mn1 N2 89.49(10) . .
O9 Mn1 N2 89.33(8) . .
O1 Mn1 N1 92.59(8) . .
O5 Mn1 N1 166.77(7) 1_665 .
O10 Mn1 N1 93.49(8) . .
O9 Mn1 N1 89.15(7) . .
N2 Mn1 N1 72.29(9) . .
C1 O1 Mn1 160.95(16) . .
C4 O3 H3A 109(3) . .
C15 O5 Mn1 129.27(15) . 1_445
C22 O7 H7A 111(2) . .
Mn1 O9 H9A 116(2) . .
Mn1 O9 H9B 123.0(19) . .
H9A O9 H9B 111(2) . .
Mn1 O10 H10B 144.1 . .
Mn1 O10 H10A 99.1 . .
H10B O10 H10A 116.8 . .
C23 N1 C27 118.1(2) . .
C23 N1 Mn1 124.40(18) . .
C27 N1 Mn1 116.73(18) . .
C32 N2 C28 118.6(3) . .
C32 N2 Mn1 123.8(2) . .
C28 N2 Mn1 116.51(18) . .
O1 C1 O2 123.3(2) . .
O1 C1 C2 116.1(2) . .
O2 C1 C2 120.6(2) . .
C8 C2 C3 118.25(18) . .
C8 C2 C1 114.45(18) . .
C3 C2 C1 127.11(19) . .
C5 C3 C2 118.23(18) . .
C5 C3 C4 113.47(18) . .
C2 C3 C4 128.28(18) . .
O4 C4 O3 120.3(2) . .
O4 C4 C3 118.97(19) . .
O3 C4 C3 120.7(2) . .
C6 C5 C3 123.00(19) . .
C6 C5 H5 118.5 . .
C3 C5 H5 118.5 . .
C5 C6 C7 118.87(18) . .
C5 C6 C9 119.50(18) . .
C7 C6 C9 121.64(18) . .
C8 C7 C6 118.41(18) . .
C8 C7 C16 119.62(18) . .
C6 C7 C16 121.89(18) . .
C2 C8 C7 123.17(19) . .
C2 C8 H8 118.4 . .
C7 C8 H8 118.4 . .
C14 C9 C10 118.58(19) . .
C14 C9 C6 121.24(19) . .
C10 C9 C6 120.17(19) . .
C11 C10 C9 120.7(2) . .
C11 C10 H10 119.7 . .
C9 C10 H10 119.7 . .
C10 C11 C12 120.5(2) . .
C10 C11 H11 119.8 . .
C12 C11 H11 119.8 . .
C13 C12 C11 118.82(19) . .
C13 C12 C15 119.95(19) . .
C11 C12 C15 121.2(2) . .
C12 C13 C14 120.6(2) . .
C12 C13 H13 119.7 . .
C14 C13 H13 119.7 . .
C9 C14 C13 120.7(2) . .
C9 C14 H14 119.6 . .
C13 C14 H14 119.6 . .
O6 C15 O5 124.2(2) . .
O6 C15 C12 119.1(2) . .
O5 C15 C12 116.71(19) . .
C21 C16 C17 118.8(2) . .
C21 C16 C7 121.21(19) . .
C17 C16 C7 120.00(19) . .
C18 C17 C16 120.7(2) . .
C18 C17 H17 119.6 . .
C16 C17 H17 119.6 . .
C19 C18 C17 120.1(2) . .
C19 C18 H18 119.9 . .
C17 C18 H18 119.9 . .
C18 C19 C20 119.2(2) . .
C18 C19 C22 121.5(2) . .
C20 C19 C22 119.2(2) . .
C21 C20 C19 120.7(2) . .
C21 C20 H20 119.7 . .
C19 C20 H20 119.7 . .
C20 C21 C16 120.3(2) . .
C20 C21 H21 119.8 . .
C16 C21 H21 119.8 . .
O8 C22 O7 124.0(2) . .
O8 C22 C19 122.8(2) . .
O7 C22 C19 113.2(2) . .
N1 C23 C24 123.8(3) . .
N1 C23 H23 118.1 . .
C24 C23 H23 118.1 . .
C25 C24 C23 117.7(3) . .
C25 C24 H24 121.2 . .
C23 C24 H24 121.2 . .
C24 C25 C26 120.1(3) . .
C24 C25 H25 119.9 . .
C26 C25 H25 119.9 . .
C25 C26 C27 119.3(3) . .
C25 C26 H26 120.3 . .
C27 C26 H26 120.3 . .
N1 C27 C26 121.0(3) . .
N1 C27 C28 116.0(2) . .
C26 C27 C28 123.0(3) . .
N2 C28 C29 121.2(3) . .
N2 C28 C27 116.6(2) . .
C29 C28 C27 122.3(3) . .
C30 C29 C28 119.7(3) . .
C30 C29 H29 120.1 . .
C28 C29 H29 120.1 . .
C29 C30 C31 119.1(3) . .
C29 C30 H30 120.5 . .
C31 C30 H30 120.5 . .
C30 C31 C32 118.6(4) . .
C30 C31 H31 120.7 . .
C32 C31 H31 120.7 . .
N2 C32 C31 122.8(3) . .
N2 C32 H32 118.6 . .
C31 C32 H32 118.6 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Mn1 O1 2.1047(18) .
Mn1 O5 2.1206(17) 1_665
Mn1 O10 2.204(2) .
Mn1 O9 2.2120(17) .
Mn1 N2 2.283(2) .
Mn1 N1 2.292(2) .
O1 C1 1.236(3) .
O2 C1 1.258(3) .
O3 C4 1.290(3) .
O3 H3A 0.881(18) .
O4 C4 1.227(3) .
O5 C15 1.280(3) .
O5 Mn1 2.1206(17) 1_445
O6 C15 1.242(3) .
O7 C22 1.311(3) .
O7 H7A 0.851(18) .
O8 C22 1.212(3) .
O9 H9A 0.833(16) .
O9 H9B 0.860(16) .
O10 H10B 0.8950 .
O10 H10A 0.9003 .
N1 C23 1.341(3) .
N1 C27 1.346(3) .
N2 C32 1.328(4) .
N2 C28 1.347(4) .
C1 C2 1.525(3) .
C2 C8 1.392(3) .
C2 C3 1.413(3) .
C3 C5 1.399(3) .
C3 C4 1.508(3) .
C5 C6 1.387(3) .
C5 H5 0.9300 .
C6 C7 1.400(3) .
C6 C9 1.491(3) .
C7 C8 1.395(3) .
C7 C16 1.492(3) .
C8 H8 0.9300 .
C9 C14 1.387(3) .
C9 C10 1.389(3) .
C10 C11 1.387(3) .
C10 H10 0.9300 .
C11 C12 1.390(3) .
C11 H11 0.9300 .
C12 C13 1.384(3) .
C12 C15 1.502(3) .
C13 C14 1.387(3) .
C13 H13 0.9300 .
C14 H14 0.9300 .
C16 C21 1.385(3) .
C16 C17 1.391(3) .
C17 C18 1.386(3) .
C17 H17 0.9300 .
C18 C19 1.382(3) .
C18 H18 0.9300 .
C19 C20 1.386(3) .
C19 C22 1.493(3) .
C20 C21 1.383(3) .
C20 H20 0.9300 .
C21 H21 0.9300 .
C23 C24 1.376(4) .
C23 H23 0.9300 .
C24 C25 1.368(5) .
C24 H24 0.9300 .
C25 C26 1.369(5) .
C25 H25 0.9300 .
C26 C27 1.395(4) .
C26 H26 0.9300 .
C27 C28 1.484(4) .
C28 C29 1.392(4) .
C29 C30 1.367(5) .
C29 H29 0.9300 .
C30 C31 1.373(6) .
C30 H30 0.9300 .
C31 C32 1.390(4) .
C31 H31 0.9300 .
C32 H32 0.9300 .
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
O3 H3A O2 0.881(18) 1.530(19) 2.410(3) 177(4) .
O7 H7A O4 0.851(18) 1.74(2) 2.580(3) 169(4) 1_556
O9 H9A O2 0.833(16) 1.985(18) 2.813(3) 173(3) 2_665
O9 H9B O5 0.860(16) 1.98(2) 2.811(3) 161(3) 2
O10 H10B O8 0.89 1.99 2.876(3) 168.6 2_656
O10 H10A O6 0.90 1.78 2.660(3) 164.3 1_665
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
O5 Mn1 O1 C1 -15.9(6) 1_665
O10 Mn1 O1 C1 -105.7(6) .
O9 Mn1 O1 C1 71.6(6) .
N2 Mn1 O1 C1 164.3(5) .
N1 Mn1 O1 C1 160.8(6) .
O1 Mn1 N1 C23 -8.2(2) .
O5 Mn1 N1 C23 157.5(3) 1_665
O10 Mn1 N1 C23 -98.9(2) .
O9 Mn1 N1 C23 83.2(2) .
N2 Mn1 N1 C23 172.8(2) .
O1 Mn1 N1 C27 -177.62(17) .
O5 Mn1 N1 C27 -11.9(4) 1_665
O10 Mn1 N1 C27 91.70(18) .
O9 Mn1 N1 C27 -86.22(18) .
N2 Mn1 N1 C27 3.35(17) .
O1 Mn1 N2 C32 170.0(3) .
O5 Mn1 N2 C32 -9.8(2) 1_665
O10 Mn1 N2 C32 79.8(2) .
O9 Mn1 N2 C32 -97.0(2) .
N1 Mn1 N2 C32 173.7(3) .
O1 Mn1 N2 C28 1.9(4) .
O5 Mn1 N2 C28 -177.86(19) 1_665
O10 Mn1 N2 C28 -88.2(2) .
O9 Mn1 N2 C28 94.93(19) .
N1 Mn1 N2 C28 5.61(18) .
Mn1 O1 C1 O2 -11.0(7) .
Mn1 O1 C1 C2 170.9(5) .
O1 C1 C2 C8 -19.6(3) .
O2 C1 C2 C8 162.2(2) .
O1 C1 C2 C3 155.3(2) .
O2 C1 C2 C3 -22.9(3) .
C8 C2 C3 C5 1.5(3) .
C1 C2 C3 C5 -173.2(2) .
C8 C2 C3 C4 -180.0(2) .
C1 C2 C3 C4 5.3(3) .
C5 C3 C4 O4 7.6(3) .
C2 C3 C4 O4 -170.9(2) .
C5 C3 C4 O3 -171.0(2) .
C2 C3 C4 O3 10.5(4) .
C2 C3 C5 C6 0.6(3) .
C4 C3 C5 C6 -178.12(19) .
C3 C5 C6 C7 -1.3(3) .
C3 C5 C6 C9 178.57(19) .
C5 C6 C7 C8 -0.2(3) .
C9 C6 C7 C8 179.95(19) .
C5 C6 C7 C16 176.48(19) .
C9 C6 C7 C16 -3.3(3) .
C3 C2 C8 C7 -3.1(3) .
C1 C2 C8 C7 172.24(19) .
C6 C7 C8 C2 2.5(3) .
C16 C7 C8 C2 -174.32(19) .
C5 C6 C9 C14 125.1(2) .
C7 C6 C9 C14 -55.0(3) .
C5 C6 C9 C10 -56.2(3) .
C7 C6 C9 C10 123.6(2) .
C14 C9 C10 C11 3.9(3) .
C6 C9 C10 C11 -174.8(2) .
C9 C10 C11 C12 -1.4(4) .
C10 C11 C12 C13 -1.9(4) .
C10 C11 C12 C15 175.3(2) .
C11 C12 C13 C14 2.7(3) .
C15 C12 C13 C14 -174.5(2) .
C10 C9 C14 C13 -3.1(3) .
C6 C9 C14 C13 175.6(2) .
C12 C13 C14 C9 -0.2(4) .
Mn1 O5 C15 O6 24.8(4) 1_445
Mn1 O5 C15 C12 -152.41(15) 1_445
C13 C12 C15 O6 1.2(3) .
C11 C12 C15 O6 -175.9(2) .
C13 C12 C15 O5 178.6(2) .
C11 C12 C15 O5 1.5(3) .
C8 C7 C16 C21 -59.2(3) .
C6 C7 C16 C21 124.1(2) .
C8 C7 C16 C17 121.2(2) .
C6 C7 C16 C17 -55.5(3) .
C21 C16 C17 C18 -2.9(4) .
C7 C16 C17 C18 176.7(2) .
C16 C17 C18 C19 -0.6(4) .
C17 C18 C19 C20 3.1(4) .
C17 C18 C19 C22 -176.6(2) .
C18 C19 C20 C21 -2.0(4) .
C22 C19 C20 C21 177.7(2) .
C19 C20 C21 C16 -1.6(4) .
C17 C16 C21 C20 4.0(4) .
C7 C16 C21 C20 -175.6(2) .
C18 C19 C22 O8 166.6(3) .
C20 C19 C22 O8 -13.1(4) .
C18 C19 C22 O7 -13.3(3) .
C20 C19 C22 O7 167.0(2) .
C27 N1 C23 C24 -0.2(4) .
Mn1 N1 C23 C24 -169.5(2) .
N1 C23 C24 C25 1.5(4) .
C23 C24 C25 C26 -1.6(5) .
C24 C25 C26 C27 0.5(5) .
C23 N1 C27 C26 -1.1(4) .
Mn1 N1 C27 C26 169.1(2) .
C23 N1 C27 C28 178.8(2) .
Mn1 N1 C27 C28 -11.1(3) .
C25 C26 C27 N1 0.9(4) .
C25 C26 C27 C28 -178.9(3) .
C32 N2 C28 C29 -2.1(4) .
Mn1 N2 C28 C29 166.61(19) .
C32 N2 C28 C27 178.1(2) .
Mn1 N2 C28 C27 -13.2(3) .
N1 C27 C28 N2 16.3(3) .
C26 C27 C28 N2 -163.9(3) .
N1 C27 C28 C29 -163.6(2) .
C26 C27 C28 C29 16.3(4) .
N2 C28 C29 C30 1.8(4) .
C27 C28 C29 C30 -178.3(3) .
C28 C29 C30 C31 -0.2(5) .
C29 C30 C31 C32 -1.0(5) .
C28 N2 C32 C31 0.8(5) .
Mn1 N2 C32 C31 -167.0(3) .
C30 C31 C32 N2 0.7(5) .
