#------------------------------------------------------------------------------
#$Date: 2019-11-17 12:44:51 +0100 (dom 17 de nov de 2019) $
#$Revision: 230247 $
#$URL: svn://www.crystallography.net/cod/cif/7/05/71/7057151.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_7057151
loop_
_publ_author_name
'Lan, Tian-Xiang'
'Gao, Wei-Song'
'Chen, Chang-Neng'
'Wang, Hui-Sheng'
'Wang, Mei'
'Fan, Yu-hua'
_publ_section_title
;
 Two tetranuclear 3d--4f heterometal complexes Mn2Ln2 (Ln = Dy, Gd):
 synthesis, structure, magnetism, and electrocatalytic reactivity for
 water oxidation
;
_journal_issue                   8
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              5798
_journal_paper_doi               10.1039/C8NJ00149A
_journal_volume                  42
_journal_year                    2018
_chemical_formula_sum            'C40 H52 Dy2 Mn2 N5 O24'
_chemical_formula_weight         1421.74
_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_Hall           '-C 2yc'
_space_group_name_H-M_alt        'C 1 2/c 1'
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2014/7
_audit_update_record
;
2017-10-17 deposited with the CCDC.
2018-03-09 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 101.134(11)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   11.469(7)
_cell_length_b                   21.210(12)
_cell_length_c                   21.144(12)
_cell_measurement_reflns_used    5571
_cell_measurement_temperature    173(2)
_cell_measurement_theta_max      27.50
_cell_measurement_theta_min      2.59
_cell_volume                     5047(5)
_computing_cell_refinement       'Siemens SMART & SAINT'
_computing_data_collection       'Siemens SMART'
_computing_data_reduction        'Siemens XPREP'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'S'Siemens SHELXTL'
_computing_structure_solution    'Siemens SHELXTL'
_diffrn_ambient_temperature      173(2)
_diffrn_measured_fraction_theta_full 0.991
_diffrn_measured_fraction_theta_max 0.988
_diffrn_measurement_device_type  'Bruker P4'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0681
_diffrn_reflns_av_unetI/netI     0.0683
_diffrn_reflns_Laue_measured_fraction_full 0.991
_diffrn_reflns_Laue_measured_fraction_max 0.988
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       27
_diffrn_reflns_limit_k_min       -26
_diffrn_reflns_limit_l_max       27
_diffrn_reflns_limit_l_min       -27
_diffrn_reflns_number            19039
_diffrn_reflns_point_group_measured_fraction_full 0.991
_diffrn_reflns_point_group_measured_fraction_max 0.988
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         27.505
_diffrn_reflns_theta_min         2.585
_exptl_absorpt_coefficient_mu    3.504
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  .4253
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details   'SADABS (Sheldrick, 1996)'
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    1.871
_exptl_crystal_description       prism
_exptl_crystal_F_000             2804
_exptl_crystal_size_max          .30
_exptl_crystal_size_mid          .20
_exptl_crystal_size_min          .20
_refine_diff_density_max         2.165
_refine_diff_density_min         -1.560
_refine_diff_density_rms         0.169
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.091
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     330
_refine_ls_number_reflns         5745
_refine_ls_number_restraints     3
_refine_ls_restrained_S_all      1.091
_refine_ls_R_factor_gt           0.0620
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0638P)²+26.2512P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1428
_refine_ls_wR_factor_ref         0.1580
_reflns_Friedel_coverage         0.000
_reflns_number_gt                4550
_reflns_number_total             5745
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            c8nj00149a2.cif
_cod_data_source_block           w
_cod_depositor_comments
'Adding full bibliography for 7057151--7057152.cif.'
_cod_database_code               7057151
_shelx_shelxl_version_number     2014/7
_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.
;
_refine_ls_r_factor_ref          0.0798
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -y+1/2, z-1/2'
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
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
Dy1 Dy 0.57701(3) 0.32193(2) -0.09539(2) 0.03800(14) Uani 1 1 d . . .
Mn1 Mn 0.5000 0.26239(7) -0.2500 0.0378(3) Uani 1 2 d S T P
Mn2 Mn 0.5000 0.41597(7) -0.2500 0.0379(3) Uani 1 2 d S T P
O1 O 0.6323(5) 0.3016(3) 0.0195(3) 0.0520(13) Uani 1 1 d . . .
O2 O 0.4341(5) 0.2673(2) -0.1723(3) 0.0456(12) Uani 1 1 d . . .
O3 O 0.6732(5) 0.2220(2) -0.1076(2) 0.0446(12) Uani 1 1 d . . .
O4 O 0.6147(6) 0.1911(3) -0.2093(3) 0.0633(17) Uani 1 1 d . . .
O5 O 0.6127(4) 0.3347(2) -0.2034(2) 0.0372(11) Uani 1 1 d . . .
O6 O 0.5000 0.5242(4) -0.2500 0.065(2) Uani 1 2 d S T P
O7 O 0.7898(5) 0.3412(3) -0.0629(3) 0.0607(15) Uani 1 1 d . . .
O8 O 0.6781(6) 0.4232(3) -0.0585(3) 0.0634(16) Uani 1 1 d . . .
O9 O 0.4522(5) 0.4051(2) -0.1542(2) 0.0445(12) Uani 1 1 d . . .
O10 O 0.4273(5) 0.3889(3) -0.0562(3) 0.0547(15) Uani 1 1 d . . .
O11 O 0.9164(11) -0.0462(4) 0.0654(5) 0.131(4) Uani 1 1 d . . .
O12 O 0.527(3) 0.2880(13) 0.2971(12) 0.173(11) Uiso 0.5 1 d D . P
O13 O 0.439(4) 0.2871(18) 0.280(2) 0.124(14) Uiso 0.25 1 d D . P
O14 O 0.453(2) 0.2104(13) 0.2070(13) 0.155(9) Uiso 0.5 1 d D . P
O15 O 0.5000 0.198(4) 0.2500 0.32(5) Uiso 0.5 2 d S . P
N1 N 0.4467(6) 0.2459(3) -0.0490(3) 0.0442(15) Uani 1 1 d . . .
N2 N 0.6810(6) 0.4524(3) -0.2165(3) 0.0453(15) Uani 1 1 d . . .
N3 N 0.5000 0.2499(11) 0.2500 0.124(6) Uiso 1 2 d DS . P
C1 C 0.5459(8) 0.2807(5) 0.0548(4) 0.059(2) Uani 1 1 d . . .
H1A H 0.5055 0.3176 0.0695 0.071 Uiso 1 1 calc R U .
H1B H 0.5858 0.2571 0.0934 0.071 Uiso 1 1 calc R U .
C2 C 0.4571(7) 0.2396(4) 0.0147(4) 0.053(2) Uani 1 1 d . . .
C3 C 0.3859(10) 0.1991(5) 0.0429(5) 0.072(3) Uani 1 1 d . . .
H3A H 0.3937 0.1959 0.0884 0.086 Uiso 1 1 calc R U .
C4 C 0.3043(9) 0.1644(5) 0.0015(6) 0.074(3) Uani 1 1 d . . .
H4A H 0.2546 0.1357 0.0184 0.089 Uiso 1 1 calc R U .
C5 C 0.2928(9) 0.1702(4) -0.0638(6) 0.064(3) Uani 1 1 d . . .
H5A H 0.2358 0.1459 -0.0922 0.077 Uiso 1 1 calc R U .
C6 C 0.3664(7) 0.2128(4) -0.0881(4) 0.053(2) Uani 1 1 d . . .
C7 C 0.3595(10) 0.2199(5) -0.1583(5) 0.074(3) Uani 1 1 d . . .
H7A H 0.3816 0.1795 -0.1763 0.089 Uiso 1 1 calc R U .
H7B H 0.2767 0.2298 -0.1791 0.089 Uiso 1 1 calc R U .
C8 C 0.6629(8) 0.1820(4) -0.1531(4) 0.050(2) Uani 1 1 d . . .
C9 C 0.7191(13) 0.1199(5) -0.1366(6) 0.109(5) Uani 1 1 d . . .
H9A H 0.7541 0.1188 -0.0905 0.164 Uiso 1 1 calc R U .
H9B H 0.6591 0.0867 -0.1466 0.164 Uiso 1 1 calc R U .
H9C H 0.7815 0.1132 -0.1617 0.164 Uiso 1 1 calc R U .
C10 C 0.7310(7) 0.3429(4) -0.2147(4) 0.0491(19) Uani 1 1 d . . .
H10A H 0.7344 0.3289 -0.2590 0.059 Uiso 1 1 calc R U .
H10B H 0.7866 0.3165 -0.1841 0.059 Uiso 1 1 calc R U .
C11 C 0.7682(7) 0.4100(4) -0.2067(4) 0.0492(18) Uani 1 1 d . . .
C12 C 0.8870(9) 0.4272(5) -0.1922(5) 0.069(3) Uani 1 1 d . . .
H12A H 0.9488 0.3967 -0.1851 0.083 Uiso 1 1 calc R U .
C13 C 0.9104(11) 0.4914(6) -0.1887(6) 0.091(4) Uani 1 1 d . . .
H13A H 0.9906 0.5052 -0.1784 0.109 Uiso 1 1 calc R U .
C14 C 0.8218(10) 0.5353(5) -0.1996(6) 0.080(3) Uani 1 1 d . . .
H14A H 0.8393 0.5791 -0.1984 0.096 Uiso 1 1 calc R U .
C15 C 0.7061(8) 0.5140(4) -0.2123(4) 0.058(2) Uani 1 1 d . . .
C16 C 0.6028(9) 0.5598(4) -0.2254(5) 0.068(3) Uani 1 1 d . . .
H16A H 0.5939 0.5814 -0.1851 0.081 Uiso 1 1 calc R U .
H16B H 0.6163 0.5920 -0.2571 0.081 Uiso 1 1 calc R U .
C17 C 0.7792(8) 0.3966(5) -0.0493(4) 0.060(2) Uani 1 1 d . . .
C18 C 0.8833(10) 0.4345(6) -0.0206(6) 0.100(4) Uani 1 1 d . . .
H18A H 0.8579 0.4775 -0.0130 0.150 Uiso 1 1 calc R U .
H18B H 0.9219 0.4157 0.0205 0.150 Uiso 1 1 calc R U .
H18C H 0.9396 0.4357 -0.0500 0.150 Uiso 1 1 calc R U .
C19 C 0.4003(8) 0.4183(4) -0.1085(4) 0.052(2) Uani 1 1 d . . .
C20 C 0.3044(13) 0.4665(6) -0.1188(6) 0.119(6) Uani 1 1 d . . .
H20A H 0.3130 0.4935 -0.1552 0.179 Uiso 1 1 calc R U .
H20B H 0.3102 0.4923 -0.0798 0.179 Uiso 1 1 calc R U .
H20C H 0.2269 0.4455 -0.1280 0.179 Uiso 1 1 calc R U .
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'
O O 0.0106 0.0060 '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'
Dy Dy -0.1892 4.4098 '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 Dy1 O5 68.15(17) . .
O2 Dy1 O3 76.64(18) . .
O5 Dy1 O3 80.45(16) . .
O2 Dy1 O1 127.64(19) . .
O5 Dy1 O1 155.24(18) . .
O3 Dy1 O1 85.12(19) . .
O2 Dy1 O7 142.7(2) . .
O5 Dy1 O7 84.5(2) . .
O3 Dy1 O7 74.1(2) . .
O1 Dy1 O7 72.2(2) . .
O2 Dy1 O9 75.29(18) . .
O5 Dy1 O9 68.17(16) . .
O3 Dy1 O9 143.81(17) . .
O1 Dy1 O9 130.46(18) . .
O7 Dy1 O9 118.4(2) . .
O2 Dy1 O10 94.4(2) . .
O5 Dy1 O10 120.30(17) . .
O3 Dy1 O10 152.96(18) . .
O1 Dy1 O10 80.35(19) . .
O7 Dy1 O10 121.8(2) . .
O9 Dy1 O10 52.13(17) . .
O2 Dy1 O8 148.4(2) . .
O5 Dy1 O8 92.60(19) . .
O3 Dy1 O8 126.3(2) . .
O1 Dy1 O8 79.9(2) . .
O7 Dy1 O8 52.3(2) . .
O9 Dy1 O8 74.3(2) . .
O10 Dy1 O8 73.3(2) . .
O2 Dy1 N1 64.6(2) . .
O5 Dy1 N1 131.4(2) . .
O3 Dy1 N1 78.39(18) . .
O1 Dy1 N1 63.7(2) . .
O7 Dy1 N1 129.3(2) . .
O9 Dy1 N1 108.97(19) . .
O10 Dy1 N1 74.7(2) . .
O8 Dy1 N1 134.7(2) . .
O2 Dy1 C17 157.3(2) . .
O5 Dy1 C17 89.2(2) . .
O3 Dy1 C17 99.6(3) . .
O1 Dy1 C17 73.5(2) . .
O7 Dy1 C17 25.5(2) . .
O9 Dy1 C17 97.6(3) . .
O10 Dy1 C17 98.0(3) . .
O8 Dy1 C17 26.8(2) . .
N1 Dy1 C17 137.2(2) . .
O2 Dy1 C19 84.3(2) . .
O5 Dy1 C19 94.28(19) . .
O3 Dy1 C19 160.8(2) . .
O1 Dy1 C19 105.5(2) . .
O7 Dy1 C19 124.1(2) . .
O9 Dy1 C19 26.12(19) . .
O10 Dy1 C19 26.01(19) . .
O8 Dy1 C19 72.0(2) . .
N1 Dy1 C19 91.8(2) . .
C17 Dy1 C19 98.8(3) . .
O2 Dy1 Mn1 32.64(12) . .
O5 Dy1 Mn1 37.33(12) . .
O3 Dy1 Mn1 67.59(12) . .
O1 Dy1 Mn1 148.34(15) . .
O7 Dy1 Mn1 112.77(15) . .
O9 Dy1 Mn1 76.45(13) . .
O10 Dy1 Mn1 117.14(14) . .
O8 Dy1 Mn1 128.98(16) . .
N1 Dy1 Mn1 94.11(16) . .
C17 Dy1 Mn1 125.08(18) . .
C19 Dy1 Mn1 97.06(18) . .
O2 Mn1 O2 173.9(3) 2_654 .
O2 Mn1 O4 90.4(2) 2_654 2_654
O2 Mn1 O4 94.0(2) . 2_654
O2 Mn1 O4 94.0(2) 2_654 .
O2 Mn1 O4 90.4(2) . .
O4 Mn1 O4 86.7(4) 2_654 .
O2 Mn1 O5 93.0(2) 2_654 .
O2 Mn1 O5 82.5(2) . .
O4 Mn1 O5 176.6(2) 2_654 .
O4 Mn1 O5 93.1(2) . .
O2 Mn1 O5 82.5(2) 2_654 2_654
O2 Mn1 O5 93.0(2) . 2_654
O4 Mn1 O5 93.1(2) 2_654 2_654
O4 Mn1 O5 176.6(2) . 2_654
O5 Mn1 O5 87.4(3) . 2_654
O2 Mn1 Dy1 41.36(15) 2_654 2_654
O2 Mn1 Dy1 135.36(16) . 2_654
O4 Mn1 Dy1 81.28(17) 2_654 2_654
O4 Mn1 Dy1 133.08(17) . 2_654
O5 Mn1 Dy1 101.34(14) . 2_654
O5 Mn1 Dy1 43.54(13) 2_654 2_654
O2 Mn1 Dy1 135.36(16) 2_654 .
O2 Mn1 Dy1 41.36(15) . .
O4 Mn1 Dy1 133.08(17) 2_654 .
O4 Mn1 Dy1 81.28(17) . .
O5 Mn1 Dy1 43.54(13) . .
O5 Mn1 Dy1 101.34(14) 2_654 .
Dy1 Mn1 Dy1 137.14(6) 2_654 .
N2 Mn2 N2 138.9(3) 2_654 .
N2 Mn2 O9 97.3(2) 2_654 2_654
N2 Mn2 O9 86.9(2) . 2_654
N2 Mn2 O9 86.9(2) 2_654 .
N2 Mn2 O9 97.3(2) . .
O9 Mn2 O9 168.0(3) 2_654 .
N2 Mn2 O5 146.3(2) 2_654 .
N2 Mn2 O5 72.7(2) . .
O9 Mn2 O5 95.62(19) 2_654 .
O9 Mn2 O5 75.12(17) . .
N2 Mn2 O5 72.7(2) 2_654 2_654
N2 Mn2 O5 146.3(2) . 2_654
O9 Mn2 O5 75.11(17) 2_654 2_654
O9 Mn2 O5 95.62(19) . 2_654
O5 Mn2 O5 80.8(3) . 2_654
N2 Mn2 O6 69.46(17) 2_654 .
N2 Mn2 O6 69.46(17) . .
O9 Mn2 O6 95.99(13) 2_654 .
O9 Mn2 O6 95.99(13) . .
O5 Mn2 O6 139.59(13) . .
O5 Mn2 O6 139.59(13) 2_654 .
C1 O1 Dy1 120.5(5) . .
C7 O2 Mn1 120.0(5) . .
C7 O2 Dy1 125.4(5) . .
Mn1 O2 Dy1 106.0(2) . .
C8 O3 Dy1 133.3(5) . .
C8 O4 Mn1 130.4(5) . .
C10 O5 Mn1 121.4(4) . .
C10 O5 Mn2 108.4(4) . .
Mn1 O5 Mn2 95.9(2) . .
C10 O5 Dy1 120.8(5) . .
Mn1 O5 Dy1 99.13(18) . .
Mn2 O5 Dy1 108.13(19) . .
C16 O6 C16 115.4(10) 2_654 .
C16 O6 Mn2 122.3(5) 2_654 .
C16 O6 Mn2 122.3(5) . .
C17 O7 Dy1 95.1(5) . .
C17 O8 Dy1 91.1(5) . .
C19 O9 Mn2 156.5(5) . .
C19 O9 Dy1 94.9(5) . .
Mn2 O9 Dy1 108.42(19) . .
C19 O10 Dy1 93.4(4) . .
O13 O12 N3 68.5(18) . .
O13 O12 O14 96(3) . 2_655
N3 O12 O14 49.3(11) . 2_655
O13 O12 O13 93(3) . 2_655
N3 O12 O13 47.8(14) . 2_655
O14 O12 O13 83(2) 2_655 2_655
O12 O13 N3 65.6(17) . .
O12 O13 O12 87(3) . 2_655
N3 O13 O12 46.5(13) . 2_655
O15 O14 N3 56(5) . .
O15 O14 O12 104(5) . 2_655
N3 O14 O12 49.1(11) . 2_655
O14 O15 O14 150(10) . 2_655
O14 O15 N3 75(6) . .
O14 O15 N3 75(6) 2_655 .
C6 N1 C2 119.6(7) . .
C6 N1 Dy1 119.6(5) . .
C2 N1 Dy1 120.8(5) . .
C11 N2 C15 120.2(7) . .
C11 N2 Mn2 116.6(5) . .
C15 N2 Mn2 122.8(6) . .
O15 N3 O12 129.4(16) . .
O15 N3 O12 129.4(16) . 2_655
O12 N3 O12 101(3) . 2_655
O15 N3 O14 49.0(17) . .
O12 N3 O14 168(2) . .
O12 N3 O14 81.6(18) 2_655 .
O15 N3 O14 49.0(17) . 2_655
O12 N3 O14 81.6(18) . 2_655
O12 N3 O14 168(2) 2_655 2_655
O14 N3 O14 98(3) . 2_655
O15 N3 O13 127(2) . .
O12 N3 O13 46(2) . .
O12 N3 O13 86(2) 2_655 .
O14 N3 O13 124(3) . .
O14 N3 O13 104(2) 2_655 .
O15 N3 O13 127(2) . 2_655
O12 N3 O13 86(2) . 2_655
O12 N3 O13 46(2) 2_655 2_655
O14 N3 O13 104(2) . 2_655
O14 N3 O13 124(3) 2_655 2_655
O13 N3 O13 105(4) . 2_655
O1 C1 C2 110.9(7) . .
N1 C2 C3 123.2(9) . .
N1 C2 C1 115.9(7) . .
C3 C2 C1 120.8(9) . .
C4 C3 C2 116.2(10) . .
C5 C4 C3 121.3(9) . .
C4 C5 C6 118.8(10) . .
N1 C6 C5 120.9(9) . .
N1 C6 C7 118.0(7) . .
C5 C6 C7 121.1(9) . .
O2 C7 C6 111.9(8) . .
O4 C8 O3 125.9(7) . .
O4 C8 C9 117.8(8) . .
O3 C8 C9 116.3(8) . .
O5 C10 C11 110.9(6) . .
N2 C11 C12 122.3(8) . .
N2 C11 C10 116.0(7) . .
C12 C11 C10 121.6(8) . .
C11 C12 C13 116.2(10) . .
C14 C13 C12 122.0(10) . .
C13 C14 C15 117.8(10) . .
N2 C15 C14 121.4(10) . .
N2 C15 C16 117.6(8) . .
C14 C15 C16 121.0(9) . .
O6 C16 C15 107.0(7) . .
O7 C17 O8 121.4(8) . .
O7 C17 C18 120.9(10) . .
O8 C17 C18 117.6(10) . .
O7 C17 Dy1 59.4(5) . .
O8 C17 Dy1 62.1(4) . .
C18 C17 Dy1 175.9(8) . .
O10 C19 O9 119.5(7) . .
O10 C19 C20 121.3(7) . .
O9 C19 C20 119.1(8) . .
O10 C19 Dy1 60.6(4) . .
O9 C19 Dy1 58.9(4) . .
C20 C19 Dy1 176.6(9) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Dy1 O2 2.376(5) .
Dy1 O5 2.412(5) .
Dy1 O3 2.425(5) .
Dy1 O1 2.428(6) .
Dy1 O7 2.439(6) .
Dy1 O9 2.453(5) .
Dy1 O10 2.490(5) .
Dy1 O8 2.494(6) .
Dy1 N1 2.521(6) .
Dy1 C17 2.822(9) .
Dy1 C19 2.853(8) .
Dy1 Mn1 3.4564(19) .
Mn1 O2 1.939(5) 2_654
Mn1 O2 1.939(5) .
Mn1 O4 2.078(6) 2_654
Mn1 O4 2.078(6) .
Mn1 O5 2.123(5) .
Mn1 O5 2.123(5) 2_654
Mn1 Dy1 3.4563(19) 2_654
Mn2 N2 2.200(6) 2_654
Mn2 N2 2.200(6) .
Mn2 O9 2.210(5) 2_654
Mn2 O9 2.210(5) .
Mn2 O5 2.262(5) .
Mn2 O5 2.262(5) 2_654
Mn2 O6 2.296(8) .
O1 C1 1.422(10) .
O2 C7 1.388(10) .
O3 C8 1.273(9) .
O4 C8 1.225(10) .
O5 C10 1.433(8) .
O6 C16 1.412(10) 2_654
O6 C16 1.412(10) .
O7 C17 1.220(11) .
O8 C17 1.271(11) .
O9 C19 1.261(9) .
O10 C19 1.254(9) .
O12 O13 1.00(4) .
O12 N3 1.274(17) .
O12 O14 1.67(3) 2_655
O12 O13 1.75(4) 2_655
O13 N3 1.302(19) .
O13 O12 1.75(4) 2_655
O14 O15 1.00(4) .
O14 N3 1.278(18) .
O14 O12 1.67(3) 2_655
O15 O14 1.00(4) 2_655
O15 N3 1.10(9) .
N1 C6 1.316(11) .
N1 C2 1.337(11) .
N2 C11 1.330(10) .
N2 C15 1.338(10) .
N3 O12 1.274(17) 2_655
N3 O14 1.278(18) 2_655
N3 O13 1.302(19) 2_655
C1 C2 1.478(13) .
C2 C3 1.396(12) .
C3 C4 1.367(15) .
C4 C5 1.367(15) .
C5 C6 1.399(12) .
C6 C7 1.478(12) .
C8 C9 1.477(12) .
C10 C11 1.487(11) .
C11 C12 1.386(12) .
C12 C13 1.387(14) .
C13 C14 1.366(16) .
C14 C15 1.378(13) .
C15 C16 1.516(13) .
C17 C18 1.470(13) .
C19 C20 1.487(12) .
