#------------------------------------------------------------------------------
#$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176432 $
#$URL: svn://www.crystallography.net/cod/cif/2/22/53/2225345.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2225345
loop_
_publ_author_name
'Liu, Jian-Feng'
'Xu, Xue-Dan'
'Li, Hua-Qiong'
'Zhao, Guo-Liang'
_publ_section_title
Tetrakis(μ-3,4-dimethoxyphenylacetato)bis[(3,4-dimethoxyphenylacetato)(1,10-phenanthroline)dysprosium(III)]
_journal_coeditor_code           PV2234
_journal_issue                   3
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m291
_journal_paper_doi               10.1107/S1600536810005143
_journal_volume                  66
_journal_year                    2010
_chemical_formula_iupac          '[Dy2 (C10 H11 O4)6 (C12 H8 N2)2]'
_chemical_formula_moiety         'C84 H82 Dy2 N4 O24'
_chemical_formula_sum            'C84 H82 Dy2 N4 O24'
_chemical_formula_weight         1856.54
_chemical_name_systematic
;
Tetrakis(μ-3,4-dimethoxyphenylacetato)bis[(3,4-
dimethoxyphenylacetato)(1,10-phenanthroline)dysprosium(III)]
;
_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                90.9680(10)
_cell_angle_beta                 103.4610(10)
_cell_angle_gamma                115.5230(10)
_cell_formula_units_Z            1
_cell_length_a                   12.3287(2)
_cell_length_b                   12.3843(3)
_cell_length_c                   14.6667(3)
_cell_measurement_reflns_used    9399
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      25.00
_cell_measurement_theta_min      1.84
_cell_volume                     1947.70(7)
_computing_cell_refinement       'SAINT (Bruker, 2006)'
_computing_data_collection       'APEX2 (Bruker, 2006)'
_computing_data_reduction        'SAINT (Bruker, 2006)'
_computing_molecular_graphics    'SHELXTL (Sheldrick, 2008)'
_computing_publication_material  'SHELXTL (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS (Sheldrick, 2008)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Bruker APEXII 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  0.0350
_diffrn_reflns_av_sigmaI/netI    0.0361
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_number            26184
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.00
_diffrn_reflns_theta_min         1.84
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    1.986
_exptl_absorpt_correction_T_max  .874
_exptl_absorpt_correction_T_min  .641
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(SADABS; Sheldrick, 1996)'
_exptl_crystal_colour            pink
_exptl_crystal_density_diffrn    1.583
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       plate
_exptl_crystal_F_000             938
_exptl_crystal_size_max          .426
_exptl_crystal_size_mid          .191
_exptl_crystal_size_min          .068
_refine_diff_density_max         0.618
_refine_diff_density_min         -0.415
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.026
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     514
_refine_ls_number_reflns         6861
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.026
_refine_ls_R_factor_gt           0.0275
_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)+(0.0353P)²+0.1683P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0629
_refine_ls_wR_factor_ref         0.0664
_reflns_number_gt                5927
_reflns_number_total             6861
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            pv2234.cif
_cod_data_source_block           I
_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.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 

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.

Automatic conversion script
Id: cif_fix_values 1715 2011-07-08 13:25:40Z adriana 
;
_cod_original_sg_symbol_Hall     '-p 1'
_cod_database_code               2225345
_cod_database_fobs_code          2225345
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Dy Dy 0.177981(13) 0.606337(14) 0.531660(10) 0.04130(7) Uani d . 1 . .
N N1 0.3869(2) 0.6453(2) 0.5047(2) 0.0503(7) Uani d . 1 . .
O O1 0.2349(3) 1.0157(3) 0.06745(19) 0.0829(9) Uani d . 1 . .
C C1 0.3116(5) 1.0035(5) 0.0144(3) 0.1012(17) Uani d . 1 . .
H H1A 0.2851 1.0170 -0.0494 0.152 Uiso calc R 1 . .
H H1B 0.3055 0.9235 0.0144 0.152 Uiso calc R 1 . .
H H1C 0.3965 1.0616 0.0422 0.152 Uiso calc R 1 . .
N N2 0.3613(2) 0.6607(2) 0.68308(19) 0.0459(7) Uani d . 1 . .
C C2 0.2595(3) 0.9987(3) 0.1610(2) 0.0562(9) Uani d . 1 . .
O O2 0.1032(3) 1.0566(3) 0.1614(2) 0.0796(8) Uani d . 1 . .
O O3 0.2631(2) 0.8206(2) 0.56316(15) 0.0566(6) Uani d . 1 . .
C C3 0.3471(4) 0.9643(4) 0.2054(3) 0.0642(10) Uani d . 1 . .
H H3A 0.3941 0.9475 0.1713 0.077 Uiso calc R 1 . .
O O4 0.2246(2) 0.7496(2) 0.41548(15) 0.0475(5) Uani d . 1 . .
C C4 0.3663(4) 0.9542(4) 0.3007(3) 0.0642(10) Uani d . 1 . .
H H4A 0.4269 0.9313 0.3305 0.077 Uiso calc R 1 . .
O O5 0.3890(2) 0.2633(2) 0.86802(17) 0.0673(7) Uani d . 1 . .
C C5 0.2964(3) 0.9778(3) 0.3524(2) 0.0524(9) Uani d . 1 . .
O O6 0.3680(2) 0.0570(2) 0.80505(16) 0.0532(6) Uani d . 1 . .
C C6 0.2069(3) 1.0102(3) 0.3066(2) 0.0545(9) Uani d . 1 . .
H H6A 0.1586 1.0251 0.3404 0.065 Uiso calc R 1 . .
O O7 0.2059(2) 0.4291(2) 0.58527(16) 0.0494(6) Uani d . 1 . .
C C7 0.1870(3) 1.0212(3) 0.2118(3) 0.0566(9) Uani d . 1 . .
O O8 0.01314(19) 0.4012(2) 0.54405(14) 0.0460(5) Uani d . 1 . .
C C8 0.0165(4) 1.0668(4) 0.2060(4) 0.0875(14) Uani d . 1 . .
H H8A -0.0363 1.0931 0.1633 0.131 Uiso calc R 1 . .
H H8B 0.0609 1.1246 0.2621 0.131 Uiso calc R 1 . .
H H8C -0.0335 0.9897 0.2226 0.131 Uiso calc R 1 . .
O O9 -0.1582(3) 0.6792(3) -0.0064(2) 0.0863(9) Uani d . 1 . .
C C9 0.3152(4) 0.9648(3) 0.4557(2) 0.0599(10) Uani d . 1 . .
H H9A 0.2761 1.0058 0.4827 0.072 Uiso calc R 1 . .
H H9B 0.4039 1.0056 0.4865 0.072 Uiso calc R 1 . .
C C10 0.2645(3) 0.8366(3) 0.4783(2) 0.0452(8) Uani d . 1 . .
O O10 -0.2506(3) 0.4530(3) -0.0641(2) 0.0989(11) Uani d . 1 . .
O O11 0.1139(2) 0.4816(2) 0.38781(15) 0.0482(6) Uani d . 1 . .
C C11 0.4211(4) 0.3853(4) 0.8958(3) 0.0858(14) Uani d . 1 . .
H H11A 0.4817 0.4130 0.9562 0.129 Uiso calc R 1 . .
H H11B 0.3479 0.3923 0.9005 0.129 Uiso calc R 1 . .
H H11C 0.4553 0.4335 0.8497 0.129 Uiso calc R 1 . .
C C12 0.3019(3) 0.2086(3) 0.7835(2) 0.0449(8) Uani d . 1 . .
O O12 -0.0940(2) 0.3744(2) 0.34464(14) 0.0528(6) Uani d . 1 . .
C C13 0.2243(3) 0.2534(3) 0.7331(2) 0.0457(8) Uani d . 1 . .
H H13A 0.2298 0.3261 0.7571 0.055 Uiso calc R 1 . .
C C14 0.1386(3) 0.1928(3) 0.6477(2) 0.0464(8) Uani d . 1 . .
C C15 0.1379(3) 0.0886(3) 0.6125(2) 0.0589(10) Uani d . 1 . .
H H15A 0.0858 0.0494 0.5531 0.071 Uiso calc R 1 . .
C C16 0.2124(3) 0.0407(3) 0.6630(2) 0.0544(9) Uani d . 1 . .
H H16A 0.2074 -0.0315 0.6383 0.065 Uiso calc R 1 . .
C C17 0.2931(3) 0.0986(3) 0.7490(2) 0.0422(7) Uani d . 1 . .
C C18 0.3356(4) -0.0674(3) 0.7839(3) 0.0643(10) Uani d . 1 . .
H H18A 0.3933 -0.0875 0.8275 0.096 Uiso calc R 1 . .
H H18B 0.3389 -0.0830 0.7205 0.096 Uiso calc R 1 . .
H H18C 0.2527 -0.1157 0.7894 0.096 Uiso calc R 1 . .
C C19 0.0456(3) 0.2354(3) 0.5983(3) 0.0555(9) Uani d . 1 . .
H H19A -0.0037 0.1815 0.5397 0.067 Uiso calc R 1 . .
H H19B -0.0105 0.2259 0.6374 0.067 Uiso calc R 1 . .
C C20 0.0937(3) 0.3622(3) 0.5749(2) 0.0405(7) Uani d . 1 . .
C C21 -0.1059(5) 0.8059(4) 0.0225(4) 0.1040(18) Uani d . 1 . .
H H21A -0.1436 0.8415 -0.0243 0.156 Uiso calc R 1 . .
H H21B -0.0176 0.8419 0.0294 0.156 Uiso calc R 1 . .
H H21C -0.1212 0.8195 0.0819 0.156 Uiso calc R 1 . .
C C22 -0.1141(4) 0.6150(4) 0.0525(3) 0.0619(10) Uani d . 1 . .
C C23 -0.0238(4) 0.6649(4) 0.1381(3) 0.0674(11) Uani d . 1 . .
H H23A 0.0099 0.7471 0.1584 0.081 Uiso calc R 1 . .
C C24 0.0166(4) 0.5926(4) 0.1936(3) 0.0626(10) Uani d . 1 . .
H H24A 0.0772 0.6267 0.2508 0.075 Uiso calc R 1 . .
C C25 -0.0327(3) 0.4709(3) 0.1643(2) 0.0505(9) Uani d . 1 . .
C C26 -0.1208(3) 0.4213(4) 0.0791(3) 0.0609(10) Uani d . 1 . .
H H26A -0.1533 0.3393 0.0589 0.073 Uiso calc R 1 . .
C C27 -0.1623(4) 0.4931(4) 0.0224(3) 0.0651(10) Uani d . 1 . .
C C28 -0.2940(5) 0.3346(5) -0.1046(4) 0.1117(19) Uani d . 1 . .
H H28A -0.3547 0.3192 -0.1639 0.168 Uiso calc R 1 . .
H H28B -0.3318 0.2802 -0.0628 0.168 Uiso calc R 1 . .
H H28C -0.2257 0.3227 -0.1149 0.168 Uiso calc R 1 . .
C C29 0.0135(3) 0.3945(3) 0.2268(2) 0.0553(9) Uani d . 1 . .
H H29A 0.0978 0.4133 0.2250 0.066 Uiso calc R 1 . .
H H29B -0.0391 0.3097 0.2030 0.066 Uiso calc R 1 . .
C C30 0.0115(3) 0.4185(3) 0.3286(2) 0.0473(8) Uani d . 1 . .
C C31 0.4017(4) 0.6446(3) 0.4185(3) 0.0638(10) Uani d . 1 . .
H H31A 0.3370 0.6388 0.3679 0.077 Uiso calc R 1 . .
C C32 0.5118(4) 0.6525(4) 0.4003(3) 0.0741(12) Uani d . 1 . .
H H32A 0.5205 0.6538 0.3390 0.089 Uiso calc R 1 . .
C C33 0.6049(4) 0.6581(3) 0.4738(4) 0.0760(13) Uani d . 1 . .
H H33A 0.6773 0.6611 0.4626 0.091 Uiso calc R 1 . .
C C34 0.5935(3) 0.6595(3) 0.5658(3) 0.0620(11) Uani d . 1 . .
C C35 0.6869(3) 0.6620(4) 0.6466(4) 0.0800(14) Uani d . 1 . .
H H35A 0.7584 0.6600 0.6378 0.096 Uiso calc R 1 . .
C C36 0.6733(4) 0.6672(4) 0.7337(4) 0.0773(13) Uani d . 1 . .
H H36A 0.7353 0.6686 0.7846 0.093 Uiso calc R 1 . .
C C37 0.5655(3) 0.6707(3) 0.7505(3) 0.0567(10) Uani d . 1 . .
C C38 0.5496(4) 0.6802(3) 0.8402(3) 0.0664(11) Uani d . 1 . .
H H38A 0.6120 0.6869 0.8931 0.080 Uiso calc R 1 . .
C C39 0.4428(4) 0.6796(3) 0.8510(3) 0.0630(10) Uani d . 1 . .
H H39A 0.4315 0.6863 0.9110 0.076 Uiso calc R 1 . .
C C40 0.3506(3) 0.6686(3) 0.7704(2) 0.0537(9) Uani d . 1 . .
H H40A 0.2772 0.6666 0.7785 0.064 Uiso calc R 1 . .
C C41 0.4684(3) 0.6621(3) 0.6729(3) 0.0457(8) Uani d . 1 . .
C C42 0.4820(3) 0.6547(3) 0.5790(3) 0.0508(9) Uani d . 1 . .
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'
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_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
O8 Dy O12 2_566 2_566 75.76(7) ?
O8 Dy O11 2_566 . 75.61(8) ?
O12 Dy O11 2_566 . 138.17(8) ?
O8 Dy O3 2_566 . 89.20(8) ?
O12 Dy O3 2_566 . 79.24(8) ?
O11 Dy O3 . . 129.88(7) ?
O8 Dy O4 2_566 . 75.39(7) ?
O12 Dy O4 2_566 . 124.07(8) ?
O11 Dy O4 . . 76.27(7) ?
O3 Dy O4 . . 53.63(7) ?
O8 Dy O7 2_566 . 124.00(7) ?
O12 Dy O7 2_566 . 93.54(8) ?
O11 Dy O7 . . 78.13(8) ?
O3 Dy O7 . . 143.46(8) ?
O4 Dy O7 . . 142.07(7) ?
O8 Dy O8 2_566 . 73.21(8) ?
O12 Dy O8 2_566 . 71.42(8) ?
O11 Dy O8 . . 71.51(7) ?
O3 Dy O8 . . 148.60(8) ?
O4 Dy O8 . . 139.39(7) ?
O7 Dy O8 . . 51.68(7) ?
O8 Dy N1 2_566 . 141.81(8) ?
O12 Dy N1 2_566 . 139.40(9) ?
O11 Dy N1 . . 79.07(8) ?
O3 Dy N1 . . 85.52(9) ?
O4 Dy N1 . . 71.12(8) ?
O7 Dy N1 . . 76.92(8) ?
O8 Dy N1 . . 124.31(8) ?
O8 Dy N2 2_566 . 150.45(8) ?
O12 Dy N2 2_566 . 76.08(8) ?
O11 Dy N2 . . 133.00(8) ?
O3 Dy N2 . . 76.91(8) ?
O4 Dy N2 . . 114.21(8) ?
O7 Dy N2 . . 66.60(8) ?
O8 Dy N2 . . 105.80(7) ?
N1 Dy N2 . . 63.83(9) ?
O8 Dy C10 2_566 . 81.72(8) ?
O12 Dy C10 2_566 . 102.46(9) ?
O11 Dy C10 . . 102.86(9) ?
O3 Dy C10 . . 27.04(8) ?
O4 Dy C10 . . 26.60(8) ?
O7 Dy C10 . . 152.75(8) ?
O8 Dy C10 . . 154.93(8) ?
N1 Dy C10 . . 76.57(9) ?
N2 Dy C10 . . 95.80(9) ?
O8 Dy C20 2_566 . 99.15(8) ?
O12 Dy C20 2_566 . 81.93(8) ?
O11 Dy C20 . . 73.28(8) ?
O3 Dy C20 . . 156.83(8) ?
O4 Dy C20 . . 149.44(8) ?
O7 Dy C20 . . 25.34(7) ?
O8 Dy C20 . . 26.35(7) ?
N1 Dy C20 . . 100.38(9) ?
N2 Dy C20 . . 85.57(8) ?
C10 Dy C20 . . 175.59(9) ?
O8 Dy Dy 2_566 2_566 38.37(5) ?
O12 Dy Dy 2_566 2_566 69.31(5) ?
O11 Dy Dy . 2_566 69.27(5) ?
O3 Dy Dy . 2_566 123.04(6) ?
O4 Dy Dy . 2_566 109.98(5) ?
O7 Dy Dy . 2_566 86.08(5) ?
O8 Dy Dy . 2_566 34.84(5) ?
N1 Dy Dy . 2_566 146.56(7) ?
N2 Dy Dy . 2_566 134.08(6) ?
C10 Dy Dy . 2_566 120.10(6) ?
C20 Dy Dy . 2_566 60.91(6) ?
C31 N1 C42 . . 118.8(3) ?
C31 N1 Dy . . 121.0(2) ?
C42 N1 Dy . . 119.9(2) ?
C2 O1 C1 . . 117.3(3) ?
O1 C1 H1A . . 109.5 ?
O1 C1 H1B . . 109.5 ?
H1A C1 H1B . . 109.5 ?
O1 C1 H1C . . 109.5 ?
H1A C1 H1C . . 109.5 ?
H1B C1 H1C . . 109.5 ?
C40 N2 C41 . . 117.1(3) ?
C40 N2 Dy . . 124.0(2) ?
C41 N2 Dy . . 118.0(2) ?
C3 C2 O1 . . 125.5(4) ?
C3 C2 C7 . . 119.7(3) ?
O1 C2 C7 . . 114.8(3) ?
C7 O2 C8 . . 117.9(3) ?
C10 O3 Dy . . 94.1(2) ?
C2 C3 C4 . . 120.2(4) ?
C2 C3 H3A . . 119.9 ?
C4 C3 H3A . . 119.9 ?
C10 O4 Dy . . 91.09(19) ?
C3 C4 C5 . . 120.8(4) ?
C3 C4 H4A . . 119.6 ?
C5 C4 H4A . . 119.6 ?
C12 O5 C11 . . 117.3(3) ?
C6 C5 C4 . . 118.4(3) ?
C6 C5 C9 . . 120.5(3) ?
C4 C5 C9 . . 121.1(4) ?
C17 O6 C18 . . 116.2(3) ?
C5 C6 C7 . . 121.5(3) ?
C5 C6 H6A . . 119.2 ?
C7 C6 H6A . . 119.2 ?
C20 O7 Dy . . 95.75(19) ?
O2 C7 C6 . . 125.4(4) ?
O2 C7 C2 . . 115.2(3) ?
C6 C7 C2 . . 119.3(4) ?
C20 O8 Dy . 2_566 158.0(2) ?
C20 O8 Dy . . 92.64(19) ?
Dy O8 Dy 2_566 . 106.79(8) ?
O2 C8 H8A . . 109.5 ?
O2 C8 H8B . . 109.5 ?
H8A C8 H8B . . 109.5 ?
O2 C8 H8C . . 109.5 ?
H8A C8 H8C . . 109.5 ?
H8B C8 H8C . . 109.5 ?
C22 O9 C21 . . 116.9(3) ?
C5 C9 C10 . . 115.4(3) ?
C5 C9 H9A . . 108.4 ?
C10 C9 H9A . . 108.4 ?
C5 C9 H9B . . 108.4 ?
C10 C9 H9B . . 108.4 ?
H9A C9 H9B . . 107.5 ?
O4 C10 O3 . . 121.1(3) ?
O4 C10 C9 . . 121.1(3) ?
O3 C10 C9 . . 117.8(3) ?
O4 C10 Dy . . 62.31(17) ?
O3 C10 Dy . . 58.83(17) ?
C9 C10 Dy . . 176.4(2) ?
C27 O10 C28 . . 118.5(4) ?
C30 O11 Dy . . 135.4(2) ?
O5 C11 H11A . . 109.5 ?
O5 C11 H11B . . 109.5 ?
H11A C11 H11B . . 109.5 ?
O5 C11 H11C . . 109.5 ?
H11A C11 H11C . . 109.5 ?
H11B C11 H11C . . 109.5 ?
O5 C12 C13 . . 125.1(3) ?
O5 C12 C17 . . 115.2(3) ?
C13 C12 C17 . . 119.7(3) ?
C30 O12 Dy . 2_566 137.0(2) ?
C12 C13 C14 . . 121.6(3) ?
C12 C13 H13A . . 119.2 ?
C14 C13 H13A . . 119.2 ?
C15 C14 C13 . . 117.2(3) ?
C15 C14 C19 . . 121.4(3) ?
C13 C14 C19 . . 121.3(3) ?
C14 C15 C16 . . 121.9(3) ?
C14 C15 H15A . . 119.1 ?
C16 C15 H15A . . 119.1 ?
C17 C16 C15 . . 120.4(3) ?
C17 C16 H16A . . 119.8 ?
C15 C16 H16A . . 119.8 ?
C16 C17 O6 . . 124.6(3) ?
C16 C17 C12 . . 118.9(3) ?
O6 C17 C12 . . 116.4(3) ?
O6 C18 H18A . . 109.5 ?
O6 C18 H18B . . 109.5 ?
H18A C18 H18B . . 109.5 ?
O6 C18 H18C . . 109.5 ?
H18A C18 H18C . . 109.5 ?
H18B C18 H18C . . 109.5 ?
C20 C19 C14 . . 118.3(3) ?
C20 C19 H19A . . 107.7 ?
C14 C19 H19A . . 107.7 ?
C20 C19 H19B . . 107.7 ?
C14 C19 H19B . . 107.7 ?
H19A C19 H19B . . 107.1 ?
O7 C20 O8 . . 119.9(3) ?
O7 C20 C19 . . 123.0(3) ?
O8 C20 C19 . . 117.1(3) ?
O7 C20 Dy . . 58.91(17) ?
O8 C20 Dy . . 61.01(16) ?
C19 C20 Dy . . 177.8(2) ?
O9 C21 H21A . . 109.5 ?
O9 C21 H21B . . 109.5 ?
H21A C21 H21B . . 109.5 ?
O9 C21 H21C . . 109.5 ?
H21A C21 H21C . . 109.5 ?
H21B C21 H21C . . 109.5 ?
O9 C22 C27 . . 116.4(3) ?
O9 C22 C23 . . 124.1(4) ?
C27 C22 C23 . . 119.4(4) ?
C22 C23 C24 . . 120.3(4) ?
C22 C23 H23A . . 119.9 ?
C24 C23 H23A . . 119.9 ?
C25 C24 C23 . . 120.4(3) ?
C25 C24 H24A . . 119.8 ?
C23 C24 H24A . . 119.8 ?
C26 C25 C24 . . 119.6(4) ?
C26 C25 C29 . . 121.4(3) ?
C24 C25 C29 . . 119.0(3) ?
C25 C26 C27 . . 120.6(4) ?
C25 C26 H26A . . 119.7 ?
C27 C26 H26A . . 119.7 ?
C22 C27 O10 . . 114.7(4) ?
C22 C27 C26 . . 119.7(4) ?
O10 C27 C26 . . 125.6(4) ?
O10 C28 H28A . . 109.5 ?
O10 C28 H28B . . 109.5 ?
H28A C28 H28B . . 109.5 ?
O10 C28 H28C . . 109.5 ?
H28A C28 H28C . . 109.5 ?
H28B C28 H28C . . 109.5 ?
C25 C29 C30 . . 110.7(3) ?
C25 C29 H29A . . 109.5 ?
C30 C29 H29A . . 109.5 ?
C25 C29 H29B . . 109.5 ?
C30 C29 H29B . . 109.5 ?
H29A C29 H29B . . 108.1 ?
O11 C30 O12 . . 126.1(3) ?
O11 C30 C29 . . 117.6(3) ?
O12 C30 C29 . . 116.2(3) ?
N1 C31 C32 . . 122.4(4) ?
N1 C31 H31A . . 118.8 ?
C32 C31 H31A . . 118.8 ?
C33 C32 C31 . . 118.8(4) ?
C33 C32 H32A . . 120.6 ?
C31 C32 H32A . . 120.6 ?
C32 C33 C34 . . 120.7(4) ?
C32 C33 H33A . . 119.6 ?
C34 C33 H33A . . 119.6 ?
C33 C34 C42 . . 117.3(4) ?
C33 C34 C35 . . 123.6(4) ?
C42 C34 C35 . . 119.0(4) ?
C36 C35 C34 . . 121.3(4) ?
C36 C35 H35A . . 119.4 ?
C34 C35 H35A . . 119.4 ?
C35 C36 C37 . . 121.3(4) ?
C35 C36 H36A . . 119.3 ?
C37 C36 H36A . . 119.3 ?
C38 C37 C41 . . 117.5(3) ?
C38 C37 C36 . . 123.1(4) ?
C41 C37 C36 . . 119.4(4) ?
C39 C38 C37 . . 120.1(3) ?
C39 C38 H38A . . 120.0 ?
C37 C38 H38A . . 120.0 ?
C38 C39 C40 . . 118.7(4) ?
C38 C39 H39A . . 120.7 ?
C40 C39 H39A . . 120.7 ?
N2 C40 C39 . . 123.9(4) ?
N2 C40 H40A . . 118.0 ?
C39 C40 H40A . . 118.0 ?
N2 C41 C37 . . 122.8(3) ?
N2 C41 C42 . . 117.8(3) ?
C37 C41 C42 . . 119.4(3) ?
N1 C42 C34 . . 121.9(4) ?
N1 C42 C41 . . 118.7(3) ?
C34 C42 C41 . . 119.4(3) ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Dy O8 2_566 2.320(2) ?
Dy O12 2_566 2.343(2) ?
Dy O11 . 2.350(2) ?
Dy O3 . 2.385(2) ?
Dy O4 . 2.462(2) ?
Dy O7 . 2.478(2) ?
Dy O8 . 2.521(2) ?
Dy N1 . 2.536(3) ?
Dy N2 . 2.607(3) ?
Dy C10 . 2.780(3) ?
Dy C20 . 2.879(3) ?
Dy Dy 2_566 3.8882(3) ?
N1 C31 . 1.320(4) ?
N1 C42 . 1.363(4) ?
O1 C2 . 1.374(4) ?
O1 C1 . 1.408(5) ?
C1 H1A . 0.9600 ?
C1 H1B . 0.9600 ?
C1 H1C . 0.9600 ?
N2 C40 . 1.324(4) ?
N2 C41 . 1.355(4) ?
C2 C3 . 1.360(5) ?
C2 C7 . 1.397(5) ?
O2 C7 . 1.361(4) ?
O2 C8 . 1.423(5) ?
O3 C10 . 1.267(4) ?
C3 C4 . 1.379(5) ?
C3 H3A . 0.9300 ?
O4 C10 . 1.245(4) ?
C4 C5 . 1.385(5) ?
C4 H4A . 0.9300 ?
O5 C12 . 1.369(4) ?
O5 C11 . 1.413(4) ?
C5 C6 . 1.369(5) ?
C5 C9 . 1.500(5) ?
O6 C17 . 1.366(4) ?
O6 C18 . 1.423(4) ?
C6 C7 . 1.374(5) ?
C6 H6A . 0.9300 ?
O7 C20 . 1.238(4) ?
O8 C20 . 1.279(3) ?
O8 Dy 2_566 2.320(2) ?
C8 H8A . 0.9600 ?
C8 H8B . 0.9600 ?
C8 H8C . 0.9600 ?
O9 C22 . 1.360(4) ?
O9 C21 . 1.427(5) ?
C9 C10 . 1.509(5) ?
C9 H9A . 0.9700 ?
C9 H9B . 0.9700 ?
O10 C27 . 1.383(5) ?
O10 C28 . 1.391(6) ?
O11 C30 . 1.255(4) ?
C11 H11A . 0.9600 ?
C11 H11B . 0.9600 ?
C11 H11C . 0.9600 ?
C12 C13 . 1.383(4) ?
C12 C17 . 1.395(4) ?
O12 C30 . 1.257(4) ?
O12 Dy 2_566 2.343(2) ?
C13 C14 . 1.385(4) ?
C13 H13A . 0.9300 ?
C14 C15 . 1.377(5) ?
C14 C19 . 1.505(4) ?
C15 C16 . 1.383(4) ?
C15 H15A . 0.9300 ?
C16 C17 . 1.366(4) ?
C16 H16A . 0.9300 ?
C18 H18A . 0.9600 ?
C18 H18B . 0.9600 ?
C18 H18C . 0.9600 ?
C19 C20 . 1.499(5) ?
C19 H19A . 0.9700 ?
C19 H19B . 0.9700 ?
C21 H21A . 0.9600 ?
C21 H21B . 0.9600 ?
C21 H21C . 0.9600 ?
C22 C27 . 1.382(5) ?
C22 C23 . 1.388(5) ?
C23 C24 . 1.390(5) ?
C23 H23A . 0.9300 ?
C24 C25 . 1.375(5) ?
C24 H24A . 0.9300 ?
C25 C26 . 1.374(5) ?
C25 C29 . 1.519(5) ?
C26 C27 . 1.401(5) ?
C26 H26A . 0.9300 ?
C28 H28A . 0.9600 ?
C28 H28B . 0.9600 ?
C28 H28C . 0.9600 ?
C29 C30 . 1.525(4) ?
C29 H29A . 0.9700 ?
C29 H29B . 0.9700 ?
C31 C32 . 1.406(5) ?
C31 H31A . 0.9300 ?
C32 C33 . 1.355(6) ?
C32 H32A . 0.9300 ?
C33 C34 . 1.389(6) ?
C33 H33A . 0.9300 ?
C34 C42 . 1.408(4) ?
C34 C35 . 1.436(6) ?
C35 C36 . 1.331(6) ?
C35 H35A . 0.9300 ?
C36 C37 . 1.424(5) ?
C36 H36A . 0.9300 ?
C37 C38 . 1.385(5) ?
C37 C41 . 1.411(5) ?
C38 C39 . 1.359(5) ?
C38 H38A . 0.9300 ?
C39 C40 . 1.394(5) ?
C39 H39A . 0.9300 ?
C40 H40A . 0.9300 ?
C41 C42 . 1.432(5) ?
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_site_symmetry_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
C1 H1A O6 1_564 0.96 2.54 3.320(5) 138.1
C16 H16A O3 1_545 0.93 2.53 3.425(4) 160.9
C18 H18B O3 1_545 0.96 2.36 3.262(4) 156.3
C21 H21A O1 2_575 0.96 2.49 3.362(6) 150.5
C21 H21A O2 2_575 0.96 2.43 3.214(5) 138.9
C33 H33A O7 2_666 0.93 2.38 3.231(4) 152.7
C31 H31A O4 . 0.93 2.52 2.977(4) 110.6
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_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion
_geom_torsion_publ_flag
O8 Dy N1 C31 2_566 . . . -15.6(3) ?
O12 Dy N1 C31 2_566 . . . -166.3(2) ?
O11 Dy N1 C31 . . . . 33.5(3) ?
O3 Dy N1 C31 . . . . -98.5(3) ?
O4 Dy N1 C31 . . . . -45.5(3) ?
O7 Dy N1 C31 . . . . 113.7(3) ?
O8 Dy N1 C31 . . . . 92.0(3) ?
N2 Dy N1 C31 . . . . -176.1(3) ?
C10 Dy N1 C31 . . . . -72.7(3) ?
C20 Dy N1 C31 . . . . 104.1(3) ?
Dy Dy N1 C31 2_566 . . . 52.4(3) ?
O8 Dy N1 C42 2_566 . . . 171.3(2) ?
O12 Dy N1 C42 2_566 . . . 20.6(3) ?
O11 Dy N1 C42 . . . . -139.6(2) ?
O3 Dy N1 C42 . . . . 88.3(2) ?
O4 Dy N1 C42 . . . . 141.3(3) ?
O7 Dy N1 C42 . . . . -59.4(2) ?
O8 Dy N1 C42 . . . . -81.1(3) ?
N2 Dy N1 C42 . . . . 10.7(2) ?
C10 Dy N1 C42 . . . . 114.2(3) ?
C20 Dy N1 C42 . . . . -69.1(2) ?
Dy Dy N1 C42 2_566 . . . -120.8(2) ?
O8 Dy N2 C40 2_566 . . . 24.7(3) ?
O12 Dy N2 C40 2_566 . . . 6.7(3) ?
O11 Dy N2 C40 . . . . -138.2(2) ?
O3 Dy N2 C40 . . . . 88.7(3) ?
O4 Dy N2 C40 . . . . 128.1(3) ?
O7 Dy N2 C40 . . . . -93.5(3) ?
O8 Dy N2 C40 . . . . -59.0(3) ?
N1 Dy N2 C40 . . . . -179.9(3) ?
C10 Dy N2 C40 . . . . 108.1(3) ?
C20 Dy N2 C40 . . . . -76.1(3) ?
Dy Dy N2 C40 2_566 . . . -35.0(3) ?
O8 Dy N2 C41 2_566 . . . -166.39(19) ?
O12 Dy N2 C41 2_566 . . . 175.6(2) ?
O11 Dy N2 C41 . . . . 30.7(3) ?
O3 Dy N2 C41 . . . . -102.4(2) ?
O4 Dy N2 C41 . . . . -63.0(2) ?
O7 Dy N2 C41 . . . . 75.4(2) ?
O8 Dy N2 C41 . . . . 109.9(2) ?
N1 Dy N2 C41 . . . . -11.0(2) ?
C10 Dy N2 C41 . . . . -83.0(2) ?
C20 Dy N2 C41 . . . . 92.8(2) ?
Dy Dy N2 C41 2_566 . . . 133.93(19) ?
C1 O1 C2 C3 . . . . -4.0(6) ?
C1 O1 C2 C7 . . . . 175.2(4) ?
O8 Dy O3 C10 2_566 . . . -73.18(19) ?
O12 Dy O3 C10 2_566 . . . -148.8(2) ?
O11 Dy O3 C10 . . . . -2.8(2) ?
O4 Dy O3 C10 . . . . -0.82(17) ?
O7 Dy O3 C10 . . . . 129.84(19) ?
O8 Dy O3 C10 . . . . -127.92(19) ?
N1 Dy O3 C10 . . . . 68.97(19) ?
N2 Dy O3 C10 . . . . 133.1(2) ?
C20 Dy O3 C10 . . . . 175.0(2) ?
Dy Dy O3 C10 2_566 . . . -92.39(18) ?
O1 C2 C3 C4 . . . . 177.7(4) ?
C7 C2 C3 C4 . . . . -1.5(6) ?
O8 Dy O4 C10 2_566 . . . 100.86(19) ?
O12 Dy O4 C10 2_566 . . . 39.8(2) ?
O11 Dy O4 C10 . . . . 179.28(19) ?
O3 Dy O4 C10 . . . . 0.83(17) ?
O7 Dy O4 C10 . . . . -131.87(19) ?
O8 Dy O4 C10 . . . . 141.16(18) ?
N1 Dy O4 C10 . . . . -97.76(19) ?
N2 Dy O4 C10 . . . . -49.4(2) ?
C20 Dy O4 C10 . . . . -175.94(18) ?
Dy Dy O4 C10 2_566 . . . 117.75(17) ?
C2 C3 C4 C5 . . . . 0.6(6) ?
C3 C4 C5 C6 . . . . 0.7(6) ?
C3 C4 C5 C9 . . . . 178.8(3) ?
C4 C5 C6 C7 . . . . -1.0(5) ?
C9 C5 C6 C7 . . . . -179.1(3) ?
O8 Dy O7 C20 2_566 . . . -12.6(2) ?
O12 Dy O7 C20 2_566 . . . 62.65(19) ?
O11 Dy O7 C20 . . . . -75.93(19) ?
O3 Dy O7 C20 . . . . 139.31(19) ?
O4 Dy O7 C20 . . . . -124.29(19) ?
O8 Dy O7 C20 . . . . -0.23(17) ?
N1 Dy O7 C20 . . . . -157.3(2) ?
N2 Dy O7 C20 . . . . 135.8(2) ?
C10 Dy O7 C20 . . . . -171.0(2) ?
Dy Dy O7 C20 2_566 . . . -6.31(18) ?
C8 O2 C7 C6 . . . . -9.5(6) ?
C8 O2 C7 C2 . . . . 172.6(4) ?
C5 C6 C7 O2 . . . . -177.7(3) ?
C5 C6 C7 C2 . . . . 0.1(5) ?
C3 C2 C7 O2 . . . . 179.2(3) ?
O1 C2 C7 O2 . . . . -0.1(5) ?
C3 C2 C7 C6 . . . . 1.2(6) ?
O1 C2 C7 C6 . . . . -178.1(3) ?
O8 Dy O8 C20 2_566 . . . 169.6(2) ?
O12 Dy O8 C20 2_566 . . . -110.19(18) ?
O11 Dy O8 C20 . . . . 89.53(18) ?
O3 Dy O8 C20 . . . . -131.90(19) ?
O4 Dy O8 C20 . . . . 128.75(17) ?
O7 Dy O8 C20 . . . . 0.23(16) ?
N1 Dy O8 C20 . . . . 27.6(2) ?
N2 Dy O8 C20 . . . . -41.22(18) ?
C10 Dy O8 C20 . . . . 170.3(2) ?
Dy Dy O8 C20 2_566 . . . 169.6(2) ?
O8 Dy O8 Dy 2_566 . . 2_566 0.0 ?
O12 Dy O8 Dy 2_566 . . 2_566 80.24(9) ?
O11 Dy O8 Dy . . . 2_566 -80.05(9) ?
O3 Dy O8 Dy . . . 2_566 58.52(16) ?
O4 Dy O8 Dy . . . 2_566 -40.83(14) ?
O7 Dy O8 Dy . . . 2_566 -169.35(13) ?
N1 Dy O8 Dy . . . 2_566 -142.00(9) ?
N2 Dy O8 Dy . . . 2_566 149.20(9) ?
C10 Dy O8 Dy . . . 2_566 0.7(2) ?
C20 Dy O8 Dy . . . 2_566 -169.6(2) ?
C6 C5 C9 C10 . . . . 104.3(4) ?
C4 C5 C9 C10 . . . . -73.8(5) ?
Dy O4 C10 O3 . . . . -1.5(3) ?
Dy O4 C10 C9 . . . . 178.9(3) ?
Dy O3 C10 O4 . . . . 1.5(3) ?
Dy O3 C10 C9 . . . . -178.8(3) ?
C5 C9 C10 O4 . . . . 8.8(5) ?
C5 C9 C10 O3 . . . . -170.9(3) ?
O8 Dy C10 O4 2_566 . . . -73.80(18) ?
O12 Dy C10 O4 2_566 . . . -147.15(17) ?
O11 Dy C10 O4 . . . . -0.71(19) ?
O3 Dy C10 O4 . . . . -178.5(3) ?
O7 Dy C10 O4 . . . . 88.3(3) ?
O8 Dy C10 O4 . . . . -74.5(3) ?
N1 Dy C10 O4 . . . . 74.55(18) ?
N2 Dy C10 O4 . . . . 135.87(18) ?
Dy Dy C10 O4 2_566 . . . -74.02(19) ?
O8 Dy C10 O3 2_566 . . . 104.72(19) ?
O12 Dy C10 O3 2_566 . . . 31.4(2) ?
O11 Dy C10 O3 . . . . 177.81(18) ?
O4 Dy C10 O3 . . . . 178.5(3) ?
O7 Dy C10 O3 . . . . -93.2(3) ?
O8 Dy C10 O3 . . . . 104.1(2) ?
N1 Dy C10 O3 . . . . -106.9(2) ?
N2 Dy C10 O3 . . . . -45.61(19) ?
Dy Dy C10 O3 2_566 . . . 104.51(18) ?
O8 Dy O11 C30 2_566 . . . -22.2(3) ?
O12 Dy O11 C30 2_566 . . . 25.9(3) ?
O3 Dy O11 C30 . . . . -98.7(3) ?
O4 Dy O11 C30 . . . . -100.3(3) ?
O7 Dy O11 C30 . . . . 107.9(3) ?
O8 Dy O11 C30 . . . . 54.6(3) ?
N1 Dy O11 C30 . . . . -173.3(3) ?
N2 Dy O11 C30 . . . . 149.2(3) ?
C10 Dy O11 C30 . . . . -100.0(3) ?
C20 Dy O11 C30 . . . . 82.2(3) ?
Dy Dy O11 C30 2_566 . . . 17.6(3) ?
C11 O5 C12 C13 . . . . -14.3(5) ?
C11 O5 C12 C17 . . . . 166.5(3) ?
O5 C12 C13 C14 . . . . 179.8(3) ?
C17 C12 C13 C14 . . . . -1.0(5) ?
C12 C13 C14 C15 . . . . -3.1(5) ?
C12 C13 C14 C19 . . . . 173.6(3) ?
C13 C14 C15 C16 . . . . 4.9(5) ?
C19 C14 C15 C16 . . . . -171.9(3) ?
C14 C15 C16 C17 . . . . -2.4(6) ?
C15 C16 C17 O6 . . . . 178.3(3) ?
C15 C16 C17 C12 . . . . -1.9(5) ?
C18 O6 C17 C16 . . . . -17.1(5) ?
C18 O6 C17 C12 . . . . 163.1(3) ?
O5 C12 C17 C16 . . . . -177.2(3) ?
C13 C12 C17 C16 . . . . 3.6(5) ?
O5 C12 C17 O6 . . . . 2.7(4) ?
C13 C12 C17 O6 . . . . -176.6(3) ?
C15 C14 C19 C20 . . . . -127.0(4) ?
C13 C14 C19 C20 . . . . 56.4(5) ?
Dy O7 C20 O8 . . . . 0.4(3) ?
Dy O7 C20 C19 . . . . -178.8(3) ?
Dy O8 C20 O7 2_566 . . . 152.0(4) ?
Dy O8 C20 O7 . . . . -0.4(3) ?
Dy O8 C20 C19 2_566 . . . -28.7(7) ?
Dy O8 C20 C19 . . . . 178.8(3) ?
Dy O8 C20 Dy 2_566 . . . 152.4(5) ?
C14 C19 C20 O7 . . . . 7.9(5) ?
C14 C19 C20 O8 . . . . -171.3(3) ?
O8 Dy C20 O7 2_566 . . . 169.48(18) ?
O12 Dy C20 O7 2_566 . . . -116.45(19) ?
O11 Dy C20 O7 . . . . 97.62(19) ?
O3 Dy C20 O7 . . . . -80.6(3) ?
O4 Dy C20 O7 . . . . 92.8(2) ?
O8 Dy C20 O7 . . . . 179.6(3) ?
N1 Dy C20 O7 . . . . 22.5(2) ?
N2 Dy C20 O7 . . . . -39.90(19) ?
Dy Dy C20 O7 2_566 . . . 172.8(2) ?
O8 Dy C20 O8 2_566 . . . -10.1(2) ?
O12 Dy C20 O8 2_566 . . . 63.97(17) ?
O11 Dy C20 O8 . . . . -81.97(17) ?
O3 Dy C20 O8 . . . . 99.8(3) ?
O4 Dy C20 O8 . . . . -86.8(2) ?
O7 Dy C20 O8 . . . . -179.6(3) ?
N1 Dy C20 O8 . . . . -157.13(17) ?
N2 Dy C20 O8 . . . . 140.51(17) ?
Dy Dy C20 O8 2_566 . . . -6.79(14) ?
C21 O9 C22 C27 . . . . -177.9(4) ?
C21 O9 C22 C23 . . . . 0.8(6) ?
O9 C22 C23 C24 . . . . -179.5(4) ?
C27 C22 C23 C24 . . . . -0.8(6) ?
C22 C23 C24 C25 . . . . -0.1(6) ?
C23 C24 C25 C26 . . . . 1.0(5) ?
C23 C24 C25 C29 . . . . -179.9(3) ?
C24 C25 C26 C27 . . . . -1.0(5) ?
C29 C25 C26 C27 . . . . 180.0(3) ?
O9 C22 C27 O10 . . . . -0.5(5) ?
C23 C22 C27 O10 . . . . -179.3(4) ?
O9 C22 C27 C26 . . . . 179.7(3) ?
C23 C22 C27 C26 . . . . 0.9(6) ?
C28 O10 C27 C22 . . . . 173.1(4) ?
C28 O10 C27 C26 . . . . -7.1(6) ?
C25 C26 C27 C22 . . . . 0.0(6) ?
C25 C26 C27 O10 . . . . -179.8(4) ?
C26 C25 C29 C30 . . . . -131.6(3) ?
C24 C25 C29 C30 . . . . 49.3(4) ?
Dy O11 C30 O12 . . . . -24.2(5) ?
Dy O11 C30 C29 . . . . 154.3(2) ?
Dy O12 C30 O11 2_566 . . . 10.4(6) ?
Dy O12 C30 C29 2_566 . . . -168.1(2) ?
C25 C29 C30 O11 . . . . -104.8(3) ?
C25 C29 C30 O12 . . . . 73.9(4) ?
C42 N1 C31 C32 . . . . 0.4(5) ?
Dy N1 C31 C32 . . . . -172.8(3) ?
N1 C31 C32 C33 . . . . 1.6(6) ?
C31 C32 C33 C34 . . . . -1.7(6) ?
C32 C33 C34 C42 . . . . 0.1(6) ?
C32 C33 C34 C35 . . . . 178.2(4) ?
C33 C34 C35 C36 . . . . 177.8(4) ?
C42 C34 C35 C36 . . . . -4.1(6) ?
C34 C35 C36 C37 . . . . -0.1(7) ?
C35 C36 C37 C38 . . . . -177.8(4) ?
C35 C36 C37 C41 . . . . 3.4(6) ?
C41 C37 C38 C39 . . . . 0.7(5) ?
C36 C37 C38 C39 . . . . -178.1(4) ?
C37 C38 C39 C40 . . . . 0.4(6) ?
C41 N2 C40 C39 . . . . 0.9(5) ?
Dy N2 C40 C39 . . . . 169.9(3) ?
C38 C39 C40 N2 . . . . -1.3(6) ?
C40 N2 C41 C37 . . . . 0.3(5) ?
Dy N2 C41 C37 . . . . -169.4(2) ?
C40 N2 C41 C42 . . . . -179.5(3) ?
Dy N2 C41 C42 . . . . 10.8(4) ?
C38 C37 C41 N2 . . . . -1.1(5) ?
C36 C37 C41 N2 . . . . 177.8(3) ?
C38 C37 C41 C42 . . . . 178.7(3) ?
C36 C37 C41 C42 . . . . -2.4(5) ?
C31 N1 C42 C34 . . . . -2.2(5) ?
Dy N1 C42 C34 . . . . 171.0(2) ?
C31 N1 C42 C41 . . . . 176.6(3) ?
Dy N1 C42 C41 . . . . -10.1(4) ?
C33 C34 C42 N1 . . . . 2.0(5) ?
C35 C34 C42 N1 . . . . -176.3(3) ?
C33 C34 C42 C41 . . . . -176.8(3) ?
C35 C34 C42 C41 . . . . 4.9(5) ?
N2 C41 C42 N1 . . . . -0.8(4) ?
C37 C41 C42 N1 . . . . 179.4(3) ?
N2 C41 C42 C34 . . . . 178.1(3) ?
C37 C41 C42 C34 . . . . -1.7(5) ?
