#------------------------------------------------------------------------------
#$Date: 2019-11-23 20:35:56 +0200 (Sat, 23 Nov 2019) $
#$Revision: 234885 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/34/95/4349562.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_4349562
loop_
_publ_author_name
'Li, Jing'
'Wei, Rong-Min'
'Pu, Tian-Cheng'
'Cao, Fan'
'Yang, Li'
'Han, Yuan'
'Zhang, Yi-Quan'
'Zuo, Jing-Lin'
'Song, You'
_publ_section_title
;
 Tuning quantum tunnelling of magnetization through 3d--4f magnetic
 interactions: an alternative approach for manipulating single-molecule
 magnetism
;
_journal_issue                   1
_journal_name_full               'Inorganic Chemistry Frontiers'
_journal_page_first              114
_journal_paper_doi               10.1039/C6QI00407E
_journal_volume                  4
_journal_year                    2017
_chemical_formula_moiety         'C66 H66 Dy2 Mn2 N8 O20'
_chemical_formula_sum            'C66 H66 Dy2 Mn2 N8 O20'
_chemical_formula_weight         1726.15
_space_group_IT_number           14
_space_group_name_Hall           '-P 2ybc'
_space_group_name_H-M_alt        'P 1 21/c 1'
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_audit_update_record
;
2016-10-27 deposited with the CCDC.
2016-11-03 downloaded from the CCDC.
;
_cell_angle_alpha                90.00
_cell_angle_beta                 114.546(7)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   10.970(2)
_cell_length_b                   16.084(3)
_cell_length_c                   20.340(3)
_cell_measurement_reflns_used    6313
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      27.24
_cell_measurement_theta_min      2.30
_cell_volume                     3264.5(10)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_device_type  'CCD area detector'
_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  0.0353
_diffrn_reflns_av_sigmaI/netI    0.0437
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -9
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_l_max       14
_diffrn_reflns_limit_l_min       -26
_diffrn_reflns_number            21390
_diffrn_reflns_theta_full        27.57
_diffrn_reflns_theta_max         27.57
_diffrn_reflns_theta_min         1.68
_exptl_absorpt_coefficient_mu    2.723
_exptl_absorpt_correction_T_max  0.761
_exptl_absorpt_correction_T_min  0.728
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    1.756
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1720
_exptl_crystal_size_max          0.15
_exptl_crystal_size_mid          0.1
_exptl_crystal_size_min          0.1
_refine_diff_density_max         0.959
_refine_diff_density_min         -0.807
_refine_diff_density_rms         0.095
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.053
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     446
_refine_ls_number_reflns         7530
_refine_ls_number_restraints     21
_refine_ls_restrained_S_all      1.060
_refine_ls_R_factor_all          0.0590
_refine_ls_R_factor_gt           0.0383
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0337P)²+4.2106P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0819
_refine_ls_wR_factor_ref         0.0901
_reflns_number_gt                5740
_reflns_number_total             7530
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c6qi00407e2.cif
_cod_data_source_block           2
_cod_depositor_comments
;
The following automatic conversions were performed:

data item '_symmetry_cell_setting' value 'Monoclinic' was changed to
'monoclinic' 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 21/c'
_cod_original_formula_sum        'C66 H66 Dy2 Mn2 N8 O20 '
_cod_database_code               4349562
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
Dy1 Dy 1.01356(2) 0.561395(12) 0.856334(11) 0.03548(7) Uani 1 1 d .
Mn1 Mn 1.14536(6) 0.55347(4) 1.04802(4) 0.03688(16) Uani 1 1 d .
O1 O 0.9628(3) 0.58241(17) 0.95736(15) 0.0347(7) Uani 1 1 d .
O2 O 0.9248(3) 0.5691(2) 0.73939(17) 0.0475(8) Uani 1 1 d .
O3 O 0.8848(4) 0.5031(3) 0.6146(2) 0.0674(11) Uani 1 1 d .
O4 O 0.8634(3) 0.45603(18) 0.84806(16) 0.0382(7) Uani 1 1 d .
O5 O 1.1854(3) 0.51072(17) 0.96001(15) 0.0358(7) Uani 1 1 d .
O6 O 1.1546(3) 0.45234(19) 0.83568(17) 0.0458(8) Uani 1 1 d .
O7 O 1.1000(4) 0.7007(2) 0.9000(2) 0.0648(10) Uani 1 1 d .
O8 O 1.1964(4) 0.6387(3) 0.8413(2) 0.0617(10) Uani 1 1 d .
O9 O 1.2606(4) 0.7629(3) 0.8844(3) 0.0929(15) Uani 1 1 d .
O10 O 1.2225(4) 0.6802(2) 1.0771(3) 0.0811(13) Uani 1 1 d U
N1 N 0.8136(4) 0.6487(2) 0.82528(19) 0.0356(8) Uani 1 1 d .
N2 N 0.6604(3) 0.4958(2) 0.88511(19) 0.0363(8) Uani 1 1 d .
N3 N 1.1879(4) 0.7028(3) 0.8752(3) 0.0575(12) Uani 1 1 d .
N4 N 1.2233(7) 0.7949(4) 1.1461(4) 0.1027(19) Uani 1 1 d U
C1 C 0.8854(4) 0.6500(2) 0.9548(2) 0.0325(9) Uani 1 1 d .
C2 C 0.8832(4) 0.6831(3) 1.0168(2) 0.0381(10) Uani 1 1 d .
H26 H 0.9365 0.6594 1.0612 0.046 Uiso 1 1 calc R
C3 C 0.8035(5) 0.7507(3) 1.0144(3) 0.0476(12) Uani 1 1 d .
H25 H 0.8035 0.7726 1.0567 0.057 Uiso 1 1 calc R
C4 C 0.7241(6) 0.7852(3) 0.9482(3) 0.0576(14) Uani 1 1 d .
H11A H 0.6687 0.8299 0.9457 0.069 Uiso 1 1 calc R
C5 C 0.7263(5) 0.7538(3) 0.8855(3) 0.0515(13) Uani 1 1 d .
H10 H 0.6747 0.7788 0.8414 0.062 Uiso 1 1 calc R
C6 C 0.8048(4) 0.6851(3) 0.8876(2) 0.0364(9) Uani 1 1 d .
C7 C 0.7169(5) 0.6604(3) 0.7619(3) 0.0453(11) Uani 1 1 d .
H7 H 0.6455 0.6926 0.7606 0.054 Uiso 1 1 calc R
C8 C 0.7071(5) 0.6299(3) 0.6941(2) 0.0458(12) Uani 1 1 d .
C9 C 0.5858(6) 0.6439(3) 0.6327(3) 0.0582(14) Uani 1 1 d .
H5 H 0.5194 0.6759 0.6375 0.070 Uiso 1 1 calc R
C10 C 0.5636(6) 0.6117(4) 0.5668(3) 0.0634(16) Uani 1 1 d .
H6 H 0.4831 0.6219 0.5271 0.076 Uiso 1 1 calc R
C11 C 0.6620(6) 0.5638(3) 0.5592(3) 0.0576(14) Uani 1 1 d .
H1 H 0.6460 0.5405 0.5145 0.069 Uiso 1 1 calc R
C12 C 0.7828(5) 0.5502(3) 0.6167(3) 0.0510(12) Uani 1 1 d .
C13 C 0.8101(5) 0.5838(3) 0.6858(2) 0.0432(11) Uani 1 1 d .
C14 C 0.8649(8) 0.4572(4) 0.5517(4) 0.089(2) Uani 1 1 d .
H12A H 0.8459 0.4944 0.5111 0.106 Uiso 1 1 calc R
H12B H 0.7899 0.4193 0.5401 0.106 Uiso 1 1 calc R
C15 C 0.9903(9) 0.4098(5) 0.5670(4) 0.102(3) Uani 1 1 d .
H27A H 0.9982 0.3654 0.6001 0.153 Uiso 1 1 calc R
H27B H 1.0660 0.4463 0.5880 0.153 Uiso 1 1 calc R
H27C H 0.9876 0.3872 0.5228 0.153 Uiso 1 1 calc R
C16 C 0.7358(4) 0.4505(2) 0.7957(2) 0.0380(10) Uani 1 1 d .
C17 C 0.7092(5) 0.4220(3) 0.7264(3) 0.0479(12) Uani 1 1 d .
H29 H 0.7793 0.4052 0.7150 0.057 Uiso 1 1 calc R
C18 C 0.5782(6) 0.4186(3) 0.6742(3) 0.0570(14) Uani 1 1 d .
H24 H 0.5613 0.4000 0.6279 0.068 Uiso 1 1 calc R
C19 C 0.4741(5) 0.4422(3) 0.6900(3) 0.0559(13) Uani 1 1 d .
H23 H 0.3870 0.4401 0.6543 0.067 Uiso 1 1 calc R
C20 C 0.4972(5) 0.4691(3) 0.7585(3) 0.0487(12) Uani 1 1 d .
H22 H 0.4255 0.4845 0.7690 0.058 Uiso 1 1 calc R
C21 C 0.6274(4) 0.4733(3) 0.8118(2) 0.0383(10) Uani 1 1 d .
C22 C 0.5832(4) 0.5403(3) 0.9036(3) 0.0411(11) Uani 1 1 d .
H20 H 0.5042 0.5590 0.8666 0.049 Uiso 1 1 calc R
C23 C 0.6063(4) 0.5645(3) 0.9761(2) 0.0375(10) Uani 1 1 d .
C24 C 0.5117(5) 0.6178(3) 0.9831(3) 0.0496(12) Uani 1 1 d .
H16 H 0.4380 0.6340 0.9418 0.060 Uiso 1 1 calc R
C25 C 0.5239(5) 0.6467(3) 1.0487(3) 0.0524(13) Uani 1 1 d .
H17 H 0.4582 0.6812 1.0516 0.063 Uiso 1 1 calc R
C26 C 0.6341(5) 0.6247(3) 1.1108(3) 0.0479(12) Uani 1 1 d .
H18 H 0.6438 0.6448 1.1556 0.057 Uiso 1 1 calc R
C27 C 1.2709(4) 0.4273(3) 0.8944(2) 0.0389(10) Uani 1 1 d .
C28 C 1.2823(4) 0.4603(2) 0.9607(2) 0.0348(9) Uani 1 1 d .
C29 C 1.1138(6) 0.4063(4) 0.7689(3) 0.0583(14) Uani 1 1 d .
H19A H 1.1891 0.4021 0.7558 0.070 Uiso 1 1 calc R
H19B H 1.0429 0.4365 0.7308 0.070 Uiso 1 1 calc R
C30 C 1.0651(6) 0.3209(4) 0.7744(3) 0.0765(19) Uani 1 1 d .
H28A H 0.9930 0.3247 0.7894 0.115 Uiso 1 1 calc R
H28B H 1.1371 0.2892 0.8093 0.115 Uiso 1 1 calc R
H28C H 1.0339 0.2940 0.7282 0.115 Uiso 1 1 calc R
C31 C 1.1935(9) 0.7457(4) 1.0876(4) 0.103(3) Uani 1 1 d U
H31 H 1.1350 0.7714 1.0453 0.123 Uiso 1 1 calc R
C32 C 1.3277(11) 0.7752(7) 1.2181(5) 0.165(4) Uani 1 1 d U
H32A H 1.3998 0.7462 1.2130 0.248 Uiso 1 1 calc R
H32B H 1.2906 0.7407 1.2437 0.248 Uiso 1 1 calc R
H32C H 1.3610 0.8257 1.2446 0.248 Uiso 1 1 calc R
C33 C 1.1583(12) 0.8763(6) 1.1518(6) 0.177(5) Uani 1 1 d U
H33A H 1.0641 0.8677 1.1375 0.265 Uiso 1 1 calc R
H33B H 1.1714 0.9169 1.1207 0.265 Uiso 1 1 calc R
H33C H 1.1984 0.8957 1.2009 0.265 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'
Dy Dy -0.1892 4.4098 '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
O2 Dy1 O5 147.59(11) . .
O2 Dy1 O4 88.89(12) . .
O5 Dy1 O4 95.39(10) . .
O2 Dy1 O1 141.68(11) . .
O5 Dy1 O1 69.86(10) . .
O4 Dy1 O1 75.59(10) . .
O2 Dy1 O7 105.95(13) . .
O5 Dy1 O7 86.90(12) . .
O4 Dy1 O7 148.21(12) . .
O1 Dy1 O7 75.52(12) . .
O2 Dy1 N1 74.86(12) . .
O5 Dy1 N1 137.54(11) . .
O4 Dy1 N1 82.37(11) . .
O1 Dy1 N1 68.55(11) . .
O7 Dy1 N1 74.95(12) . .
O2 Dy1 O8 81.59(13) . .
O5 Dy1 O8 83.95(12) . .
O4 Dy1 O8 160.34(13) . .
O1 Dy1 O8 121.93(12) . .
O7 Dy1 O8 51.44(13) . .
N1 Dy1 O8 111.29(13) . .
O2 Dy1 O6 83.26(11) . .
O5 Dy1 O6 64.99(10) . .
O4 Dy1 O6 86.88(11) . .
O1 Dy1 O6 129.40(10) . .
O7 Dy1 O6 122.11(12) . .
N1 Dy1 O6 155.72(11) . .
O8 Dy1 O6 75.00(13) . .
O2 Dy1 N3 94.10(13) . .
O5 Dy1 N3 84.98(11) . .
O4 Dy1 N3 173.82(13) . .
O1 Dy1 N3 98.82(13) . .
O7 Dy1 N3 25.61(14) . .
N1 Dy1 N3 93.18(12) . .
O8 Dy1 N3 25.83(13) . .
O6 Dy1 N3 98.83(13) . .
O2 Dy1 Mn1 177.28(9) . .
O5 Dy1 Mn1 35.11(7) . .
O4 Dy1 Mn1 90.36(7) . .
O1 Dy1 Mn1 35.64(7) . .
O7 Dy1 Mn1 73.48(10) . .
N1 Dy1 Mn1 102.44(8) . .
O8 Dy1 Mn1 99.89(9) . .
O6 Dy1 Mn1 99.32(7) . .
N3 Dy1 Mn1 86.40(9) . .
O2 Dy1 Mn1 121.53(9) . 3_767
O5 Dy1 Mn1 73.87(7) . 3_767
O4 Dy1 Mn1 34.79(8) . 3_767
O1 Dy1 Mn1 42.71(7) . 3_767
O7 Dy1 Mn1 118.23(10) . 3_767
N1 Dy1 Mn1 81.46(8) . 3_767
O8 Dy1 Mn1 156.49(9) . 3_767
O6 Dy1 Mn1 101.74(8) . 3_767
N3 Dy1 Mn1 140.43(11) . 3_767
Mn1 Dy1 Mn1 57.20(2) . 3_767
O5 Mn1 O1 77.94(11) . .
O5 Mn1 N2 85.19(13) . 3_767
O1 Mn1 N2 162.82(13) . 3_767
O5 Mn1 O4 155.38(11) . 3_767
O1 Mn1 O4 116.98(12) . 3_767
N2 Mn1 O4 77.86(13) 3_767 3_767
O5 Mn1 O10 109.65(15) . .
O1 Mn1 O10 98.55(14) . .
N2 Mn1 O10 90.12(15) 3_767 .
O4 Mn1 O10 88.32(15) 3_767 .
O5 Mn1 O1 86.57(11) . 3_767
O1 Mn1 O1 83.89(10) . 3_767
N2 Mn1 O1 91.93(12) 3_767 3_767
O4 Mn1 O1 76.40(10) 3_767 3_767
O10 Mn1 O1 163.78(14) . 3_767
O5 Mn1 Dy1 38.76(7) . .
O1 Mn1 Dy1 40.21(8) . .
N2 Mn1 Dy1 123.55(10) 3_767 .
O4 Mn1 Dy1 155.90(8) 3_767 .
O10 Mn1 Dy1 101.44(13) . .
O1 Mn1 Dy1 90.81(7) 3_767 .
O5 Mn1 Dy1 127.05(8) . 3_767
O1 Mn1 Dy1 95.01(8) . 3_767
N2 Mn1 Dy1 92.52(10) 3_767 3_767
O4 Mn1 Dy1 37.79(8) 3_767 3_767
O10 Mn1 Dy1 123.27(13) . 3_767
O1 Mn1 Dy1 40.56(7) 3_767 3_767
Dy1 Mn1 Dy1 122.80(2) . 3_767
C1 O1 Mn1 123.5(3) . .
C1 O1 Dy1 116.5(2) . .
Mn1 O1 Dy1 104.15(11) . .
C1 O1 Mn1 115.0(2) . 3_767
Mn1 O1 Mn1 96.11(10) . 3_767
Dy1 O1 Mn1 96.73(10) . 3_767
C13 O2 Dy1 140.2(3) . .
C12 O3 C14 119.8(5) . .
C16 O4 Mn1 108.2(3) . 3_767
C16 O4 Dy1 124.8(3) . .
Mn1 O4 Dy1 107.42(12) 3_767 .
C28 O5 Mn1 129.1(3) . .
C28 O5 Dy1 124.6(3) . .
Mn1 O5 Dy1 106.13(11) . .
C27 O6 C29 118.2(4) . .
C27 O6 Dy1 118.1(3) . .
C29 O6 Dy1 123.2(3) . .
N3 O7 Dy1 97.2(3) . .
N3 O8 Dy1 95.4(3) . .
C31 O10 Mn1 143.1(6) . .
C7 N1 C6 119.4(4) . .
C7 N1 Dy1 127.7(3) . .
C6 N1 Dy1 112.7(2) . .
C22 N2 C21 122.6(4) . .
C22 N2 Mn1 128.6(3) . 3_767
C21 N2 Mn1 108.8(3) . 3_767
O9 N3 O7 121.4(6) . .
O9 N3 O8 122.6(5) . .
O7 N3 O8 116.0(4) . .
O9 N3 Dy1 178.5(5) . .
O7 N3 Dy1 57.2(3) . .
O8 N3 Dy1 58.8(2) . .
C31 N4 C32 123.6(8) . .
C31 N4 C33 128.5(8) . .
C32 N4 C33 107.9(8) . .
O1 C1 C2 121.3(4) . .
O1 C1 C6 119.2(4) . .
C2 C1 C6 119.5(4) . .
C1 C2 C3 121.5(4) . .
C1 C2 H26 119.2 . .
C3 C2 H26 119.2 . .
C4 C3 C2 118.9(5) . .
C4 C3 H25 120.5 . .
C2 C3 H25 120.5 . .
C3 C4 C5 120.5(4) . .
C3 C4 H11A 119.8 . .
C5 C4 H11A 119.8 . .
C4 C5 C6 120.7(4) . .
C4 C5 H10 119.6 . .
C6 C5 H10 119.6 . .
C5 C6 C1 118.8(4) . .
C5 C6 N1 124.4(4) . .
C1 C6 N1 116.7(4) . .
N1 C7 C8 127.8(5) . .
N1 C7 H7 116.1 . .
C8 C7 H7 116.1 . .
C9 C8 C13 118.9(5) . .
C9 C8 C7 117.6(5) . .
C13 C8 C7 123.5(4) . .
C10 C9 C8 121.8(6) . .
C10 C9 H5 119.1 . .
C8 C9 H5 119.1 . .
C9 C10 C11 119.4(5) . .
C9 C10 H6 120.3 . .
C11 C10 H6 120.3 . .
C12 C11 C10 121.0(5) . .
C12 C11 H1 119.5 . .
C10 C11 H1 119.5 . .
O3 C12 C11 125.1(5) . .
O3 C12 C13 113.8(4) . .
C11 C12 C13 121.1(5) . .
O2 C13 C12 119.7(5) . .
O2 C13 C8 122.5(4) . .
C12 C13 C8 117.8(4) . .
O3 C14 C15 107.2(6) . .
O3 C14 H12A 110.3 . .
C15 C14 H12A 110.3 . .
O3 C14 H12B 110.3 . .
C15 C14 H12B 110.3 . .
H12A C14 H12B 108.5 . .
C14 C15 H27A 109.5 . .
C14 C15 H27B 109.5 . .
H27A C15 H27B 109.5 . .
C14 C15 H27C 109.5 . .
H27A C15 H27C 109.5 . .
H27B C15 H27C 109.5 . .
O4 C16 C17 121.9(4) . .
O4 C16 C21 119.5(4) . .
C17 C16 C21 118.6(4) . .
C18 C17 C16 120.2(5) . .
C18 C17 H29 119.9 . .
C16 C17 H29 119.9 . .
C19 C18 C17 120.7(5) . .
C19 C18 H24 119.6 . .
C17 C18 H24 119.6 . .
C18 C19 C20 120.4(5) . .
C18 C19 H23 119.8 . .
C20 C19 H23 119.8 . .
C19 C20 C21 120.1(5) . .
C19 C20 H22 120.0 . .
C21 C20 H22 120.0 . .
C20 C21 C16 120.0(4) . .
C20 C21 N2 124.0(4) . .
C16 C21 N2 116.0(4) . .
N2 C22 C23 126.5(4) . .
N2 C22 H20 116.7 . .
C23 C22 H20 116.7 . .
C24 C23 C28 118.5(4) . 3_767
C24 C23 C22 116.6(4) . .
C28 C23 C22 124.9(4) 3_767 .
C25 C24 C23 122.2(5) . .
C25 C24 H16 118.9 . .
C23 C24 H16 118.9 . .
C24 C25 C26 119.9(5) . .
C24 C25 H17 120.1 . .
C26 C25 H17 120.1 . .
C27 C26 C25 119.3(5) 3_767 .
C27 C26 H18 120.4 3_767 .
C25 C26 H18 120.4 . .
C26 C27 O6 124.3(4) 3_767 .
C26 C27 C28 122.4(4) 3_767 .
O6 C27 C28 113.4(4) . .
O5 C28 C27 117.9(4) . .
O5 C28 C23 124.4(4) . 3_767
C27 C28 C23 117.7(4) . 3_767
O6 C29 C30 112.4(5) . .
O6 C29 H19A 109.1 . .
C30 C29 H19A 109.1 . .
O6 C29 H19B 109.1 . .
C30 C29 H19B 109.1 . .
H19A C29 H19B 107.9 . .
C29 C30 H28A 109.5 . .
C29 C30 H28B 109.5 . .
H28A C30 H28B 109.5 . .
C29 C30 H28C 109.5 . .
H28A C30 H28C 109.5 . .
H28B C30 H28C 109.5 . .
O10 C31 N4 135.9(9) . .
O10 C31 H31 112.0 . .
N4 C31 H31 112.0 . .
N4 C32 H32A 109.5 . .
N4 C32 H32B 109.5 . .
H32A C32 H32B 109.5 . .
N4 C32 H32C 109.5 . .
H32A C32 H32C 109.5 . .
H32B C32 H32C 109.5 . .
N4 C33 H33A 109.5 . .
N4 C33 H33B 109.5 . .
H33A C33 H33B 109.5 . .
N4 C33 H33C 109.5 . .
H33A C33 H33C 109.5 . .
H33B C33 H33C 109.5 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Dy1 O2 2.167(3) .
Dy1 O5 2.316(3) .
Dy1 O4 2.321(3) .
Dy1 O1 2.366(3) .
Dy1 O7 2.451(4) .
Dy1 N1 2.456(4) .
Dy1 O8 2.484(4) .
Dy1 O6 2.488(3) .
Dy1 N3 2.893(5) .
Dy1 Mn1 3.5532(9) .
Dy1 Mn1 3.6132(8) 3_767
Mn1 O5 2.127(3) .
Mn1 O1 2.135(3) .
Mn1 N2 2.147(3) 3_767
Mn1 O4 2.161(3) 3_767
Mn1 O10 2.191(4) .
Mn1 O1 2.468(3) 3_767
Mn1 Dy1 3.6132(8) 3_767
O1 C1 1.367(5) .
O1 Mn1 2.468(3) 3_767
O2 C13 1.299(5) .
O3 C12 1.368(6) .
O3 C14 1.412(7) .
O4 C16 1.364(5) .
O4 Mn1 2.161(3) 3_767
O5 C28 1.333(5) .
O6 C27 1.396(5) .
O6 C29 1.445(6) .
O7 N3 1.260(6) .
O8 N3 1.266(6) .
O9 N3 1.217(6) .
O10 C31 1.146(7) .
N1 C7 1.299(5) .
N1 C6 1.435(6) .
N2 C22 1.280(6) .
N2 C21 1.427(6) .
N2 Mn1 2.147(3) 3_767
N4 C31 1.353(9) .
N4 C32 1.470(10) .
N4 C33 1.518(11) .
C1 C2 1.378(6) .
C1 C6 1.402(6) .
C2 C3 1.383(6) .
C2 H26 0.9300 .
C3 C4 1.381(7) .
C3 H25 0.9300 .
C4 C5 1.381(7) .
C4 H11A 0.9300 .
C5 C6 1.390(6) .
C5 H10 0.9300 .
C7 C8 1.426(7) .
C7 H7 0.9300 .
C8 C9 1.414(6) .
C8 C13 1.418(7) .
C9 C10 1.362(7) .
C9 H5 0.9300 .
C10 C11 1.387(8) .
C10 H6 0.9300 .
C11 C12 1.372(7) .
C11 H1 0.9300 .
C12 C13 1.417(7) .
C14 C15 1.488(10) .
C14 H12A 0.9700 .
C14 H12B 0.9700 .
C15 H27A 0.9600 .
C15 H27B 0.9600 .
C15 H27C 0.9600 .
C16 C17 1.393(6) .
C16 C21 1.407(6) .
C17 C18 1.388(7) .
C17 H29 0.9300 .
C18 C19 1.362(8) .
C18 H24 0.9300 .
C19 C20 1.378(7) .
C19 H23 0.9300 .
C20 C21 1.391(6) .
C20 H22 0.9300 .
C22 C23 1.441(6) .
C22 H20 0.9300 .
C23 C24 1.398(6) .
C23 C28 1.414(6) 3_767
C24 C25 1.365(7) .
C24 H16 0.9300 .
C25 C26 1.384(7) .
C25 H17 0.9300 .
C26 C27 1.373(6) 3_767
C26 H18 0.9300 .
C27 C26 1.373(6) 3_767
C27 C28 1.406(6) .
C28 C23 1.414(6) 3_767
C29 C30 1.495(8) .
C29 H19A 0.9700 .
C29 H19B 0.9700 .
C30 H28A 0.9600 .
C30 H28B 0.9600 .
C30 H28C 0.9600 .
C31 H31 0.9300 .
C32 H32A 0.9600 .
C32 H32B 0.9600 .
C32 H32C 0.9600 .
C33 H33A 0.9600 .
C33 H33B 0.9600 .
C33 H33C 0.9600 .
