#------------------------------------------------------------------------------
#$Date: 2016-03-24 02:19:26 +0200 (Thu, 24 Mar 2016) $
#$Revision: 179572 $
#$URL: svn://www.crystallography.net/cod/cif/4/50/37/4503769.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_4503769
loop_
_publ_author_name
'Yang, Yu-ting'
'Luo, Feng'
'Che, Yun-xia'
'Zheng, Ji-min'
_publ_section_title
;
 Employing An Unprecedented Ferromagnetic Molecular Building Block (MBB)
 of [Co2Ln(μ3-OH)(CO2)5(N3)]2(Ln = Tb, Gd, Dy, Eu, Sm) to Construct a
 6-Connected α-Po Net
;
_journal_issue                   10
_journal_name_full               'Crystal Growth & Design'
_journal_page_first              3508
_journal_paper_doi               10.1021/cg800431b
_journal_volume                  8
_journal_year                    2008
_chemical_formula_sum            'C60 H42 Co4 Dy2 N16 O22'
_chemical_formula_weight         1899.82
_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                107.80(3)
_cell_angle_beta                 107.26(3)
_cell_angle_gamma                102.29(3)
_cell_formula_units_Z            1
_cell_length_a                   10.918(2)
_cell_length_b                   12.042(2)
_cell_length_c                   14.638(3)
_cell_measurement_reflns_used    14940
_cell_measurement_temperature    298(2)
_cell_measurement_theta_max      27.48
_cell_measurement_theta_min      3.04
_cell_volume                     1649.5(9)
_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      298(2)
_diffrn_measured_fraction_theta_full 0.979
_diffrn_measured_fraction_theta_max 0.979
_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  0.0267
_diffrn_reflns_av_sigmaI/netI    0.0341
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            16197
_diffrn_reflns_theta_full        27.48
_diffrn_reflns_theta_max         27.48
_diffrn_reflns_theta_min         3.04
_exptl_absorpt_coefficient_mu    3.309
_exptl_absorpt_correction_T_max  0.6981
_exptl_absorpt_correction_T_min  0.4697
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            Red
_exptl_crystal_density_diffrn    1.913
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Block
_exptl_crystal_F_000             930
_exptl_crystal_size_max          0.27
_exptl_crystal_size_mid          0.13
_exptl_crystal_size_min          0.12
_refine_diff_density_max         0.587
_refine_diff_density_min         -0.684
_refine_diff_density_rms         0.115
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.068
_refine_ls_hydrogen_treatment    refU
_refine_ls_matrix_type           full
_refine_ls_number_parameters     473
_refine_ls_number_reflns         7404
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.068
_refine_ls_R_factor_all          0.0263
_refine_ls_R_factor_gt           0.0230
_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)+(0.0339P)²+2.6449P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0674
_refine_ls_wR_factor_ref         0.0719
_reflns_number_gt                6879
_reflns_number_total             7404
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            cg800431b_si_004.cif
_cod_data_source_block           3
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to /home/saulius/struct/CIF-dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.1 from
2010-06-29.

'_exptl_absorpt_correction_type' value 'Multi-scan'
changed to 'multi-scan' according to
/home/saulius/struct/CIF-dictionaries/cif_core.dic dictionary named
'cif_core.dic' version 2.4.1 from
2010-06-29.

'_refine_ls_hydrogen_treatment' value 'refu' changed to
'refU' according to
/home/saulius/struct/CIF-dictionaries/cif_core.dic dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_values 1715 2011-07-08 13:25:40Z adriana 
;
_cod_original_cell_volume        1649.5(5)
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               4503769
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
C1 C 0.7363(4) 0.5045(4) 0.8490(3) 0.0295(8) Uani 1 1 d .
H1 H 0.7146 0.5152 0.9072 0.035 Uiso 1 1 calc R
C2 C 0.4248(3) 0.2961(3) 0.0483(2) 0.0218(6) Uani 1 1 d .
C3 C 0.8681(4) 0.5132(5) 0.8596(3) 0.0416(11) Uani 1 1 d .
H3 H 0.9329 0.5264 0.9233 0.050 Uiso 1 1 calc R
C4 C 0.8074(4) 0.8263(4) 0.8000(3) 0.0290(7) Uani 1 1 d .
H4 H 0.8194 0.8541 0.8698 0.035 Uiso 1 1 calc R
C5 C 0.6659(3) 0.7505(3) 0.6275(2) 0.0199(6) Uani 1 1 d .
H5 H 0.5798 0.7286 0.5768 0.024 Uiso 1 1 calc R
C6 C 0.9010(3) 0.7751(4) 0.6718(3) 0.0292(7) Uani 1 1 d .
H6 H 0.9743 0.7682 0.6532 0.035 Uiso 1 1 calc R
C7 C 0.7718(3) 0.7385(3) 0.5961(2) 0.0196(6) Uani 1 1 d .
C8 C 0.8314(3) 0.4675(3) 0.5849(2) 0.0200(6) Uani 1 1 d .
C9 C 0.7124(3) 0.1753(3) 0.0261(2) 0.0219(6) Uani 1 1 d .
C10 C 0.7464(3) 0.6732(3) 0.4829(2) 0.0191(6) Uani 1 1 d .
C11 C 0.4430(3) 0.3359(3) -0.1050(2) 0.0242(7) Uani 1 1 d .
H11 H 0.4983 0.4154 -0.0572 0.029 Uiso 1 1 calc R
C12 C 0.6724(3) 0.4693(3) 0.6761(2) 0.0208(6) Uani 1 1 d .
H12 H 0.6051 0.4537 0.6128 0.025 Uiso 1 1 calc R
C13 C 0.7071(3) 0.1912(3) 0.3946(2) 0.0215(6) Uani 1 1 d .
C14 C 0.6423(3) 0.0509(3) -0.0361(2) 0.0211(6) Uani 1 1 d .
H14 H 0.6058 0.0011 -0.0066 0.025 Uiso 1 1 calc R
C15 C 0.3936(3) 0.2514(3) -0.0669(2) 0.0230(6) Uani 1 1 d .
C16 C 0.7646(5) 0.2503(4) -0.0186(3) 0.0444(11) Uani 1 1 d .
H16 H 0.8119 0.3343 0.0200 0.053 Uiso 1 1 calc R
C17 C 0.8035(3) 0.4792(3) 0.6807(2) 0.0199(6) Uani 1 1 d .
C18 C 0.9033(3) 0.5023(4) 0.7749(3) 0.0321(8) Uani 1 1 d .
H18 H 0.9923 0.5103 0.7811 0.039 Uiso 1 1 calc R
C19 C 0.7553(3) 0.1476(3) 0.4807(3) 0.0249(7) Uani 1 1 d .
C20 C 0.8919(4) 0.1789(4) 0.5375(3) 0.0394(9) Uani 1 1 d .
H20 H 0.9567 0.2263 0.5228 0.047 Uiso 1 1 calc R
C21 C 0.9192(4) 0.8221(4) 0.7758(3) 0.0357(9) Uani 1 1 d .
H21 H 1.0054 0.8503 0.8281 0.043 Uiso 1 1 calc R
C22 C 0.7165(3) 0.2254(3) 0.1348(2) 0.0205(6) Uani 1 1 d .
C23 C 0.3415(4) 0.1927(3) -0.2730(3) 0.0365(9) Uani 1 1 d .
H23 H 0.3230 0.1718 -0.3435 0.044 Uiso 1 1 calc R
C24 C 0.6714(4) 0.0718(3) -0.1789(3) 0.0338(8) Uani 1 1 d .
H24 H 0.6545 0.0378 -0.2494 0.041 Uiso 1 1 calc R
C25 C 0.3158(5) 0.1320(4) -0.1372(3) 0.0383(9) Uani 1 1 d .
H25 H 0.2805 0.0728 -0.1148 0.046 Uiso 1 1 calc R
C26 C 0.7438(5) 0.1953(4) -0.1231(3) 0.0497(12) Uani 1 1 d .
H26 H 0.7791 0.2425 -0.1550 0.060 Uiso 1 1 calc R
C27 C 0.9312(5) 0.1378(5) 0.6174(4) 0.0554(13) Uani 1 1 d .
H27 H 1.0228 0.1560 0.6565 0.066 Uiso 1 1 calc R
C28 C 0.8320(5) 0.0702(6) 0.6372(4) 0.0591(14) Uani 1 1 d .
H28 H 0.8589 0.0422 0.6900 0.071 Uiso 1 1 calc R
C29 C 0.2910(6) 0.1018(4) -0.2415(3) 0.0496(12) Uani 1 1 d .
H29 H 0.2410 0.0213 -0.2900 0.060 Uiso 1 1 calc R
C30 C 0.6635(4) 0.0813(5) 0.5080(4) 0.0486(12) Uani 1 1 d .
H30 H 0.5713 0.0627 0.4706 0.058 Uiso 1 1 calc R
Co1 Co 0.56517(4) 0.53475(4) 0.25293(3) 0.01814(9) Uani 1 1 d .
Co2 Co 0.48255(4) 0.19731(4) 0.21906(3) 0.01775(9) Uani 1 1 d .
Dy1 Dy 0.819623(13) 0.440686(13) 0.364437(10) 0.01648(5) Uani 1 1 d .
H1A H 0.568(4) 0.408(3) 0.356(3) 0.016(8) Uiso 1 1 d .
N1 N 0.7690(3) 0.5536(3) 0.2535(2) 0.0252(6) Uani 1 1 d .
N2 N 0.7895(3) 0.5564(3) 0.1776(2) 0.0294(6) Uani 1 1 d .
N3 N 0.8105(4) 0.5618(4) 0.1068(3) 0.0524(11) Uani 1 1 d .
N4 N 0.4165(3) 0.3103(3) -0.2059(2) 0.0252(6) Uani 1 1 d .
N5 N 0.6818(3) 0.7921(3) 0.7277(2) 0.0221(5) Uani 1 1 d .
N6 N 0.6382(3) 0.4811(3) 0.7580(2) 0.0226(6) Uani 1 1 d .
N7 N 0.6987(4) 0.0421(5) 0.5849(4) 0.0747(17) Uani 1 1 d .
N8 N 0.6241(3) -0.0018(2) -0.1359(2) 0.0217(5) Uani 1 1 d .
O1 O 0.5853(2) 0.3903(2) 0.30098(16) 0.0180(4) Uani 1 1 d .
O2 O 0.4921(3) 0.4082(2) 0.10055(17) 0.0273(5) Uani 1 1 d .
O3 O 0.3791(3) 0.2189(2) 0.08181(18) 0.0308(6) Uani 1 1 d .
O4 O 0.6214(3) 0.1655(3) 0.1496(2) 0.0351(6) Uani 1 1 d .
O5 O 0.8105(3) 0.3234(2) 0.20117(18) 0.0288(5) Uani 1 1 d .
O6 O 0.5819(2) 0.1629(2) 0.34767(18) 0.0248(5) Uani 1 1 d .
O7 O 0.7987(2) 0.2535(2) 0.37596(18) 0.0253(5) Uani 1 1 d .
O8 O 0.7324(2) 0.4378(2) 0.50216(17) 0.0264(5) Uani 1 1 d .
O9 O 0.6328(2) 0.6522(2) 0.41478(17) 0.0236(5) Uani 1 1 d .
O10 O 0.8421(2) 0.6398(2) 0.46623(17) 0.0239(5) Uani 1 1 d .
O11 O 0.9524(2) 0.4899(2) 0.58973(19) 0.0264(5) Uani 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'
H H 0.0000 0.0000 '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'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Co Co 0.3494 0.9721 '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
N6 C1 C3 122.6(3) . .
O2 C2 O3 126.7(3) . .
O2 C2 C15 115.7(3) . .
O3 C2 C15 117.6(3) . .
C1 C3 C18 119.5(3) . .
N5 C4 C21 123.0(3) . .
N5 C5 C7 123.0(3) . .
C21 C6 C7 118.9(3) . .
C5 C7 C6 118.5(3) . .
C5 C7 C10 121.3(3) . .
C6 C7 C10 119.7(3) . .
O8 C8 O11 122.2(3) . .
O8 C8 C17 117.6(3) . .
O11 C8 C17 120.2(3) . .
C14 C9 C16 118.0(3) . .
C14 C9 C22 118.9(3) . .
C16 C9 C22 122.8(3) . .
O10 C10 O9 125.8(3) . .
O10 C10 C7 115.3(3) . .
O9 C10 C7 118.8(3) . .
N4 C11 C15 124.3(3) . .
N6 C12 C17 123.3(3) . .
O6 C13 O7 125.7(3) . .
O6 C13 C19 117.9(3) . .
O7 C13 C19 116.4(3) . .
N8 C14 C9 124.1(3) . .
C25 C15 C11 118.0(3) . .
C25 C15 C2 123.8(3) . .
C11 C15 C2 118.2(3) . .
C9 C16 C26 117.8(3) . .
C18 C17 C12 118.2(3) . .
C18 C17 C8 122.8(3) . .
C12 C17 C8 118.9(3) . .
C17 C18 C3 118.6(3) . .
C30 C19 C20 118.6(3) . .
C30 C19 C13 120.6(3) . .
C20 C19 C13 120.7(3) . .
C19 C20 C27 118.5(4) . .
C4 C21 C6 118.7(3) . .
O4 C22 O5 125.8(3) . .
O4 C22 C9 115.3(3) . .
O5 C22 C9 118.8(3) . .
N4 C23 C29 122.8(3) . .
N8 C24 C26 122.6(3) . .
C15 C25 C29 118.9(3) . .
C24 C26 C16 120.0(3) . .
C28 C27 C20 118.5(4) . .
N7 C28 C27 123.9(4) . .
C25 C29 C23 119.3(4) . .
N7 C30 C19 124.0(4) . .
O2 Co1 O1 88.19(9) . .
O2 Co1 N6 90.59(11) . 2_666
O1 Co1 N6 98.35(10) . 2_666
O2 Co1 O9 174.60(9) . .
O1 Co1 O9 87.18(9) . .
N6 Co1 O9 87.35(10) 2_666 .
O2 Co1 N4 92.12(10) . 2_665
O1 Co1 N4 169.24(10) . 2_665
N6 Co1 N4 92.41(11) 2_666 2_665
O9 Co1 N4 92.96(10) . 2_665
O2 Co1 N1 86.76(11) . .
O1 Co1 N1 84.95(10) . .
N6 Co1 N1 175.71(10) 2_666 .
O9 Co1 N1 95.59(11) . .
N4 Co1 N1 84.33(11) 2_665 .
O2 Co1 Dy1 99.93(8) . .
O1 Co1 Dy1 42.37(6) . .
N6 Co1 Dy1 138.08(7) 2_666 .
O9 Co1 Dy1 78.42(7) . .
N4 Co1 Dy1 127.18(8) 2_665 .
N1 Co1 Dy1 45.90(8) . .
O6 Co2 O4 94.14(11) . .
O6 Co2 O3 175.87(10) . .
O4 Co2 O3 84.03(11) . .
O6 Co2 O1 91.62(10) . .
O4 Co2 O1 95.25(10) . .
O3 Co2 O1 92.23(10) . .
O6 Co2 N8 88.65(11) . 2_655
O4 Co2 N8 85.39(11) . 2_655
O3 Co2 N8 87.52(11) . 2_655
O1 Co2 N8 179.29(10) . 2_655
O6 Co2 N5 89.27(10) . 2_666
O4 Co2 N5 172.06(10) . 2_666
O3 Co2 N5 92.10(10) . 2_666
O1 Co2 N5 91.81(10) . 2_666
N8 Co2 N5 87.53(11) 2_655 2_666
O11 Dy1 O7 98.50(9) 2_766 .
O11 Dy1 O1 170.21(8) 2_766 .
O7 Dy1 O1 90.05(9) . .
O11 Dy1 O10 86.98(9) 2_766 .
O7 Dy1 O10 138.89(8) . .
O1 Dy1 O10 89.71(9) . .
O11 Dy1 O5 85.45(10) 2_766 .
O7 Dy1 O5 79.65(9) . .
O1 Dy1 O5 91.43(9) . .
O10 Dy1 O5 141.45(9) . .
O11 Dy1 N1 95.26(10) 2_766 .
O7 Dy1 N1 147.52(10) . .
O1 Dy1 N1 74.95(9) . .
O10 Dy1 N1 70.89(9) . .
O5 Dy1 N1 72.26(10) . .
O11 Dy1 O8 118.39(8) 2_766 .
O7 Dy1 O8 71.94(9) . .
O1 Dy1 O8 68.78(8) . .
O10 Dy1 O8 69.76(8) . .
O5 Dy1 O8 144.86(8) . .
N1 Dy1 O8 125.55(9) . .
O11 Dy1 Co1 133.04(7) 2_766 .
O7 Dy1 Co1 126.87(7) . .
O1 Dy1 Co1 37.58(5) . .
O10 Dy1 Co1 67.60(7) . .
O5 Dy1 Co1 90.93(7) . .
N1 Dy1 Co1 40.15(7) . .
O8 Dy1 Co1 89.92(6) . .
N2 N1 Co1 119.1(2) . .
N2 N1 Dy1 134.9(2) . .
Co1 N1 Dy1 93.95(10) . .
N3 N2 N1 178.4(5) . .
C11 N4 C23 116.6(3) . .
C11 N4 Co1 117.0(2) . 2_665
C23 N4 Co1 122.9(2) . 2_665
C5 N5 C4 117.7(3) . .
C5 N5 Co2 124.5(2) . 2_666
C4 N5 Co2 117.7(2) . 2_666
C12 N6 C1 117.7(3) . .
C12 N6 Co1 121.9(2) . 2_666
C1 N6 Co1 120.4(2) . 2_666
C30 N7 C28 116.6(4) . .
C14 N8 C24 117.4(3) . .
C14 N8 Co2 118.8(2) . 2_655
C24 N8 Co2 123.8(2) . 2_655
Co1 O1 Co2 129.47(11) . .
Co1 O1 Dy1 100.05(9) . .
Co2 O1 Dy1 112.58(10) . .
C2 O2 Co1 138.5(2) . .
C2 O3 Co2 127.0(2) . .
C22 O4 Co2 139.1(2) . .
C22 O5 Dy1 125.9(2) . .
C13 O6 Co2 127.4(2) . .
C13 O7 Dy1 127.1(2) . .
C8 O8 Dy1 108.25(19) . .
C10 O9 Co1 124.2(2) . .
C10 O10 Dy1 124.8(2) . .
C8 O11 Dy1 167.1(2) . 2_766
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C1 N6 1.340(4) .
C1 C3 1.378(5) .
C2 O2 1.249(4) .
C2 O3 1.258(4) .
C2 C15 1.509(4) .
C3 C18 1.381(5) .
C4 N5 1.343(4) .
C4 C21 1.375(5) .
C5 N5 1.339(4) .
C5 C7 1.384(4) .
C6 C21 1.386(5) .
C6 C7 1.387(5) .
C7 C10 1.510(4) .
C8 O8 1.249(4) .
C8 O11 1.266(4) .
C8 C17 1.493(4) .
C9 C14 1.387(5) .
C9 C16 1.390(5) .
C9 C22 1.502(4) .
C10 O10 1.258(4) .
C10 O9 1.255(4) .
C11 N4 1.338(4) .
C11 C15 1.388(5) .
C12 N6 1.335(4) .
C12 C17 1.391(4) .
C13 O6 1.248(4) .
C13 O7 1.267(4) .
C13 C19 1.507(4) .
C14 N8 1.334(4) .
C15 C25 1.380(5) .
C16 C26 1.393(5) .
C17 C18 1.382(5) .
C19 C30 1.375(5) .
C19 C20 1.375(5) .
C20 C27 1.395(6) .
C22 O4 1.248(4) .
C22 O5 1.257(4) .
C23 N4 1.349(5) .
C23 C29 1.385(6) .
C24 N8 1.336(4) .
C24 C26 1.371(5) .
C25 C29 1.382(5) .
C27 C28 1.369(6) .
C28 N7 1.338(6) .
C30 N7 1.336(5) .
Co1 O2 2.069(3) .
Co1 O1 2.095(2) .
Co1 N6 2.140(3) 2_666
Co1 O9 2.151(2) .
Co1 N4 2.169(3) 2_665
Co1 N1 2.186(3) .
Co1 Dy1 3.3830(11) .
Co2 O6 2.086(2) .
Co2 O4 2.098(2) .
Co2 O3 2.116(2) .
Co2 O1 2.117(2) .
Co2 N8 2.150(3) 2_655
Co2 N5 2.170(3) 2_666
Dy1 O11 2.264(2) 2_766
Dy1 O7 2.280(2) .
Dy1 O1 2.315(2) .
Dy1 O10 2.319(2) .
Dy1 O5 2.335(2) .
Dy1 N1 2.435(3) .
Dy1 O8 2.478(2) .
N1 N2 1.204(4) .
N2 N3 1.144(4) .
N4 Co1 2.169(3) 2_665
N5 Co2 2.170(3) 2_666
N6 Co1 2.140(3) 2_666
N8 Co2 2.150(3) 2_655
O11 Dy1 2.264(2) 2_766
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
N6 C1 C3 C18 2.5(7) . .
N5 C5 C7 C6 -2.2(5) . .
N5 C5 C7 C10 170.4(3) . .
C21 C6 C7 C5 0.0(5) . .
C21 C6 C7 C10 -172.8(3) . .
C5 C7 C10 O10 -162.4(3) . .
C6 C7 C10 O10 10.2(4) . .
C5 C7 C10 O9 14.7(5) . .
C6 C7 C10 O9 -172.7(3) . .
C16 C9 C14 N8 1.3(6) . .
C22 C9 C14 N8 175.2(3) . .
N4 C11 C15 C25 2.3(5) . .
N4 C11 C15 C2 -176.1(3) . .
O2 C2 C15 C25 -177.2(4) . .
O3 C2 C15 C25 1.5(5) . .
O2 C2 C15 C11 1.1(5) . .
O3 C2 C15 C11 179.8(3) . .
C14 C9 C16 C26 -0.4(6) . .
C22 C9 C16 C26 -174.0(4) . .
N6 C12 C17 C18 0.1(5) . .
N6 C12 C17 C8 -178.5(3) . .
O8 C8 C17 C18 175.0(3) . .
O11 C8 C17 C18 -6.6(5) . .
O8 C8 C17 C12 -6.5(5) . .
O11 C8 C17 C12 172.0(3) . .
C12 C17 C18 C3 0.6(6) . .
C8 C17 C18 C3 179.2(4) . .
C1 C3 C18 C17 -1.8(7) . .
O6 C13 C19 C30 -1.6(5) . .
O7 C13 C19 C30 178.8(4) . .
O6 C13 C19 C20 -178.1(4) . .
O7 C13 C19 C20 2.3(5) . .
C30 C19 C20 C27 2.5(7) . .
C13 C19 C20 C27 179.0(4) . .
N5 C4 C21 C6 -3.1(6) . .
C7 C6 C21 C4 2.5(6) . .
C14 C9 C22 O4 -23.7(5) . .
C16 C9 C22 O4 149.9(4) . .
C14 C9 C22 O5 158.0(3) . .
C16 C9 C22 O5 -28.3(5) . .
C11 C15 C25 C29 0.2(6) . .
C2 C15 C25 C29 178.5(4) . .
N8 C24 C26 C16 -3.4(8) . .
C9 C16 C26 C24 1.4(8) . .
C19 C20 C27 C28 -1.2(8) . .
C20 C27 C28 N7 -0.8(10) . .
C15 C25 C29 C23 -1.8(7) . .
N4 C23 C29 C25 1.1(8) . .
C20 C19 C30 N7 -1.9(8) . .
C13 C19 C30 N7 -178.4(5) . .
O2 Co1 Dy1 O11 99.65(11) . 2_766
O1 Co1 Dy1 O11 175.79(12) . 2_766
N6 Co1 Dy1 O11 -158.20(15) 2_666 2_766
O9 Co1 Dy1 O11 -85.59(11) . 2_766
N4 Co1 Dy1 O11 -0.71(13) 2_665 2_766
N1 Co1 Dy1 O11 24.10(14) . 2_766
O2 Co1 Dy1 O7 -62.73(10) . .
O1 Co1 Dy1 O7 13.41(11) . .
N6 Co1 Dy1 O7 39.43(14) 2_666 .
O9 Co1 Dy1 O7 112.04(10) . .
N4 Co1 Dy1 O7 -163.09(12) 2_665 .
N1 Co1 Dy1 O7 -138.27(13) . .
O2 Co1 Dy1 O1 -76.14(12) . .
N6 Co1 Dy1 O1 26.02(15) 2_666 .
O9 Co1 Dy1 O1 98.63(11) . .
N4 Co1 Dy1 O1 -176.50(13) 2_665 .
N1 Co1 Dy1 O1 -151.68(14) . .
O2 Co1 Dy1 O10 162.07(9) . .
O1 Co1 Dy1 O10 -121.79(11) . .
N6 Co1 Dy1 O10 -95.77(13) 2_666 .
O9 Co1 Dy1 O10 -23.16(9) . .
N4 Co1 Dy1 O10 61.71(11) 2_665 .
N1 Co1 Dy1 O10 86.53(13) . .
O2 Co1 Dy1 O5 15.00(9) . .
O1 Co1 Dy1 O5 91.14(11) . .
N6 Co1 Dy1 O5 117.16(13) 2_666 .
O9 Co1 Dy1 O5 -170.23(9) . .
N4 Co1 Dy1 O5 -85.36(12) 2_665 .
N1 Co1 Dy1 O5 -60.54(13) . .
O2 Co1 Dy1 N1 75.55(13) . .
O1 Co1 Dy1 N1 151.68(14) . .
N6 Co1 Dy1 N1 177.70(16) 2_666 .
O9 Co1 Dy1 N1 -109.69(13) . .
N4 Co1 Dy1 N1 -24.81(14) 2_665 .
O2 Co1 Dy1 O8 -129.86(9) . .
O1 Co1 Dy1 O8 -53.72(11) . .
N6 Co1 Dy1 O8 -27.71(13) 2_666 .
O9 Co1 Dy1 O8 44.90(9) . .
N4 Co1 Dy1 O8 129.78(11) 2_665 .
N1 Co1 Dy1 O8 154.59(12) . .
O2 Co1 N1 N2 40.8(3) . .
O1 Co1 N1 N2 129.2(3) . .
N6 Co1 N1 N2 -11.1(17) 2_666 .
O9 Co1 N1 N2 -144.1(3) . .
N4 Co1 N1 N2 -51.7(3) 2_665 .
Dy1 Co1 N1 N2 147.9(3) . .
O2 Co1 N1 Dy1 -107.18(10) . .
O1 Co1 N1 Dy1 -18.72(9) . .
N6 Co1 N1 Dy1 -159.0(15) 2_666 .
O9 Co1 N1 Dy1 67.94(10) . .
N4 Co1 N1 Dy1 160.37(11) 2_665 .
O11 Dy1 N1 N2 58.4(4) 2_766 .
O7 Dy1 N1 N2 -56.5(4) . .
O1 Dy1 N1 N2 -121.7(4) . .
O10 Dy1 N1 N2 143.3(4) . .
O5 Dy1 N1 N2 -25.2(3) . .
O8 Dy1 N1 N2 -170.9(3) . .
Co1 Dy1 N1 N2 -139.1(4) . .
O11 Dy1 N1 Co1 -162.56(10) 2_766 .
O7 Dy1 N1 Co1 82.55(18) . .
O1 Dy1 N1 Co1 17.43(9) . .
O10 Dy1 N1 Co1 -77.60(11) . .
O5 Dy1 N1 Co1 113.93(12) . .
O8 Dy1 N1 Co1 -31.83(15) . .
Co1 N1 N2 N3 106(14) . .
Dy1 N1 N2 N3 -122(14) . .
C15 C11 N4 C23 -3.1(5) . .
C15 C11 N4 Co1 156.8(3) . 2_665
C29 C23 N4 C11 1.3(6) . .
C29 C23 N4 Co1 -157.2(4) . 2_665
C7 C5 N5 C4 1.7(5) . .
C7 C5 N5 Co2 -176.3(2) . 2_666
C21 C4 N5 C5 1.0(6) . .
C21 C4 N5 Co2 179.1(3) . 2_666
C17 C12 N6 C1 0.5(5) . .
C17 C12 N6 Co1 180.0(2) . 2_666
C3 C1 N6 C12 -1.7(6) . .
C3 C1 N6 Co1 178.7(3) . 2_666
C19 C30 N7 C28 -0.1(9) . .
C27 C28 N7 C30 1.5(10) . .
C9 C14 N8 C24 -3.1(5) . .
C9 C14 N8 Co2 178.3(3) . 2_655
C26 C24 N8 C14 4.1(6) . .
C26 C24 N8 Co2 -177.3(4) . 2_655
O2 Co1 O1 Co2 -23.73(14) . .
N6 Co1 O1 Co2 66.60(15) 2_666 .
O9 Co1 O1 Co2 153.51(14) . .
N4 Co1 O1 Co2 -115.5(5) 2_665 .
N1 Co1 O1 Co2 -110.63(15) . .
Dy1 Co1 O1 Co2 -130.63(18) . .
O2 Co1 O1 Dy1 106.90(10) . .
N6 Co1 O1 Dy1 -162.77(10) 2_666 .
O9 Co1 O1 Dy1 -75.87(10) . .
N4 Co1 O1 Dy1 15.1(6) 2_665 .
N1 Co1 O1 Dy1 20.00(10) . .
O6 Co2 O1 Co1 -177.38(14) . .
O4 Co2 O1 Co1 88.32(15) . .
O3 Co2 O1 Co1 4.11(15) . .
N8 Co2 O1 Co1 -66(8) 2_655 .
N5 Co2 O1 Co1 -88.06(15) 2_666 .
O6 Co2 O1 Dy1 56.66(10) . .
O4 Co2 O1 Dy1 -37.65(12) . .
O3 Co2 O1 Dy1 -121.85(11) . .
N8 Co2 O1 Dy1 168(44) 2_655 .
N5 Co2 O1 Dy1 145.98(11) 2_666 .
O11 Dy1 O1 Co1 -18.4(5) 2_766 .
O7 Dy1 O1 Co1 -169.31(9) . .
O10 Dy1 O1 Co1 51.80(9) . .
O5 Dy1 O1 Co1 -89.66(10) . .
N1 Dy1 O1 Co1 -18.46(9) . .
O8 Dy1 O1 Co1 120.14(11) . .
O11 Dy1 O1 Co2 122.2(5) 2_766 .
O7 Dy1 O1 Co2 -28.69(10) . .
O10 Dy1 O1 Co2 -167.59(10) . .
O5 Dy1 O1 Co2 50.95(11) . .
N1 Dy1 O1 Co2 122.15(12) . .
O8 Dy1 O1 Co2 -99.25(11) . .
Co1 Dy1 O1 Co2 140.61(14) . .
O3 C2 O2 Co1 -1.7(6) . .
C15 C2 O2 Co1 176.9(2) . .
O1 Co1 O2 C2 32.2(4) . .
N6 Co1 O2 C2 -66.1(4) 2_666 .
O9 Co1 O2 C2 1.4(13) . .
N4 Co1 O2 C2 -158.5(4) 2_665 .
N1 Co1 O2 C2 117.3(4) . .
Dy1 Co1 O2 C2 73.1(4) . .
O2 C2 O3 Co2 -43.9(5) . .
C15 C2 O3 Co2 137.6(3) . .
O6 Co2 O3 C2 -122.9(12) . .
O4 Co2 O3 C2 -59.1(3) . .
O1 Co2 O3 C2 35.9(3) . .
N8 Co2 O3 C2 -144.7(3) 2_655 .
N5 Co2 O3 C2 127.8(3) 2_666 .
O5 C22 O4 Co2 44.7(6) . .
C9 C22 O4 Co2 -133.4(3) . .
O6 Co2 O4 C22 -106.0(4) . .
O3 Co2 O4 C22 77.7(4) . .
O1 Co2 O4 C22 -14.0(4) . .
N8 Co2 O4 C22 165.7(4) 2_655 .
N5 Co2 O4 C22 138.8(7) 2_666 .
O4 C22 O5 Dy1 -10.0(5) . .
C9 C22 O5 Dy1 168.0(2) . .
O11 Dy1 O5 C22 156.2(3) 2_766 .
O7 Dy1 O5 C22 56.7(3) . .
O1 Dy1 O5 C22 -33.1(3) . .
O10 Dy1 O5 C22 -124.4(3) . .
N1 Dy1 O5 C22 -106.8(3) . .
O8 Dy1 O5 C22 20.5(4) . .
Co1 Dy1 O5 C22 -70.7(3) . .
O7 C13 O6 Co2 4.3(5) . .
C19 C13 O6 Co2 -175.2(2) . .
O4 Co2 O6 C13 37.3(3) . .
O3 Co2 O6 C13 100.8(13) . .
O1 Co2 O6 C13 -58.1(3) . .
N8 Co2 O6 C13 122.6(3) 2_655 .
N5 Co2 O6 C13 -149.9(3) 2_666 .
O6 C13 O7 Dy1 51.7(4) . .
C19 C13 O7 Dy1 -128.8(3) . .
O11 Dy1 O7 C13 153.3(3) 2_766 .
O1 Dy1 O7 C13 -31.5(3) . .
O10 Dy1 O7 C13 58.1(3) . .
O5 Dy1 O7 C13 -122.9(3) . .
N1 Dy1 O7 C13 -92.7(3) . .
O8 Dy1 O7 C13 36.1(3) . .
Co1 Dy1 O7 C13 -39.6(3) . .
O11 C8 O8 Dy1 -1.9(4) . .
C17 C8 O8 Dy1 176.5(2) . .
O11 Dy1 O8 C8 -5.8(3) 2_766 .
O7 Dy1 O8 C8 84.3(2) . .
O1 Dy1 O8 C8 -178.4(2) . .
O10 Dy1 O8 C8 -80.5(2) . .
O5 Dy1 O8 C8 121.9(2) . .
N1 Dy1 O8 C8 -126.7(2) . .
Co1 Dy1 O8 C8 -146.6(2) . .
O10 C10 O9 Co1 7.5(4) . .
C7 C10 O9 Co1 -169.3(2) . .
O2 Co1 O9 C10 91.6(10) . .
O1 Co1 O9 C10 60.7(2) . .
N6 Co1 O9 C10 159.2(3) 2_666 .
N4 Co1 O9 C10 -108.5(3) 2_665 .
N1 Co1 O9 C10 -23.9(3) . .
Dy1 Co1 O9 C10 18.9(2) . .
O9 C10 O10 Dy1 -49.7(4) . .
C7 C10 O10 Dy1 127.1(2) . .
O11 Dy1 O10 C10 -176.7(2) 2_766 .
O7 Dy1 O10 C10 -77.2(3) . .
O1 Dy1 O10 C10 12.5(2) . .
O5 Dy1 O10 C10 104.5(3) . .
N1 Dy1 O10 C10 86.7(2) . .
O8 Dy1 O10 C10 -54.9(2) . .
Co1 Dy1 O10 C10 43.7(2) . .
O8 C8 O11 Dy1 149.7(8) . 2_766
C17 C8 O11 Dy1 -28.7(12) . 2_766
