#------------------------------------------------------------------------------
#$Date: 2019-11-17 12:38:05 +0100 (dom 17 de nov de 2019) $
#$Revision: 230210 $
#$URL: svn://www.crystallography.net/cod/cif/7/05/78/7057818.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_7057818
loop_
_publ_author_name
'Zhang, Ya-Xin'
'Zhang, Yue-Hua'
'Liu, Bi-Ying'
'Wang, Wen-Min'
'Tang, Gong-Ping'
'Wei, Hai-Ying'
'Wu, Zhi-Lei'
_publ_section_title
;
 Synthesis, luminescence and magnetic properties of tetranuclear
 lanthanide-based (Eu4, Gd4 and Dy4) clusters
;
_journal_issue                   22
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              18305
_journal_paper_doi               10.1039/C8NJ04226H
_journal_volume                  42
_journal_year                    2018
_chemical_formula_moiety         '2(C70 H72 Dy2 N6 O8), 2(C2 H3 N)'
_chemical_formula_sum            'C144 H150 Dy4 N14 O16'
_chemical_formula_weight         2982.77
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   mixed
_audit_creation_date             2018-08-14
_audit_creation_method
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_audit_update_record
;
2018-08-14 deposited with the CCDC.
2018-10-08 downloaded from the CCDC.
;
_cell_angle_alpha                110.327(2)
_cell_angle_beta                 93.328(2)
_cell_angle_gamma                109.820(2)
_cell_formula_units_Z            2
_cell_length_a                   17.1171(8)
_cell_length_b                   20.3908(10)
_cell_length_c                   23.5026(12)
_cell_measurement_reflns_used    9820
_cell_measurement_temperature    150(2)
_cell_measurement_theta_max      25.32
_cell_measurement_theta_min      2.34
_cell_volume                     7091.4(6)
_computing_cell_refinement       'SAINT v8.37A (Bruker, 2015)'
_computing_data_reduction        'SAINT v8.37A (Bruker, 2015)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'XL (Sheldrick, 2008)'
_diffrn_ambient_temperature      150.0
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.992
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.1005
_diffrn_reflns_av_unetI/netI     0.0812
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.992
_diffrn_reflns_limit_h_max       20
_diffrn_reflns_limit_h_min       -20
_diffrn_reflns_limit_k_max       24
_diffrn_reflns_limit_k_min       -24
_diffrn_reflns_limit_l_max       28
_diffrn_reflns_limit_l_min       -28
_diffrn_reflns_number            109179
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.992
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         25.441
_diffrn_reflns_theta_min         2.092
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    2.147
_exptl_absorpt_correction_T_max  0.7452
_exptl_absorpt_correction_T_min  0.5926
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
SADABS-2016/2 (Bruker,2016/2) was used for absorption correction.
wR2(int) was 0.0823 before and 0.0618 after correction.
The Ratio of minimum to maximum transmission is 0.7952.
The λ/2 correction factor is Not present.
;
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    1.397
_exptl_crystal_description       block
_exptl_crystal_F_000             3008
_exptl_crystal_size_max          0.29
_exptl_crystal_size_mid          0.21
_exptl_crystal_size_min          0.11
_refine_diff_density_max         2.611
_refine_diff_density_min         -1.328
_refine_diff_density_rms         0.173
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.024
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1633
_refine_ls_number_reflns         26067
_refine_ls_number_restraints     98
_refine_ls_restrained_S_all      1.029
_refine_ls_R_factor_all          0.0992
_refine_ls_R_factor_gt           0.0525
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0864P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1265
_refine_ls_wR_factor_ref         0.1527
_reflns_Friedel_coverage         0.000
_reflns_number_gt                17111
_reflns_number_total             26067
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            c8nj04226h2.cif
_cod_data_source_block           mo_3
_cod_depositor_comments
'Adding full bibliography for 7057818--7057820.cif.'
_cod_database_code               7057818
_shelx_shelxl_version_number     2016/6
_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.
;
_shelx_estimated_absorpt_t_max   0.798
_shelx_estimated_absorpt_t_min   0.575
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All O(H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2. Restrained distances
 C7-C6
 1.42 with sigma of 0.02
 O8-H8
 0.82 with sigma of 0.02
3. Rigid bond restraints
 C78, C79, C77
 with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.02
 C21, C22, C17
 with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.02
4. Uiso/Uaniso restraints and constraints
C78 \\sim C79 \\sim C76 \\sim C77: within 2A with sigma of 0.01 and sigma for
terminal atoms of 0.02
Uanis(C78) \\sim Ueq, Uanis(C77) \\sim Ueq: with sigma of 0.01 and sigma for
terminal atoms of 0.02
Uanis(C21) \\sim Ueq, Uanis(C20) \\sim Ueq, Uanis(C19) \\sim Ueq, Uanis(C18)
\\sim Ueq, Uanis(C17) \\sim Ueq: with sigma of 0.01 and sigma for terminal
atoms of 0.02
Uanis(N0AA) \\sim Ueq, Uanis(C0AA) \\sim Ueq, Uanis(C1AA) \\sim Ueq: with sigma
of 0.01 and sigma for terminal atoms of 0.02
Uanis(C138) \\sim Ueq: with sigma of 0.01 and sigma for terminal atoms of 0.02
Uanis(N3) \\sim Ueq: with sigma of 0.01 and sigma for terminal atoms of 0.02
5.a Ternary CH refined with riding coordinates:
 O16(H16)
5.b Aromatic/amide H refined with riding coordinates:
 C135(H135), C116(H116), C101(H101), C25(H25), C42(H42), C117(H117), C31(H31),
 C62(H62), C112(H112), C111(H111), C106(H106), C26(H26), C10(H10), C39(H39),
 C55(H55), C46(H46), C23(H23), C100(H100), C57(H57), C49(H49), C107(H107),
 C47(H47), C52(H52), C81(H81), C124(H124), C63(H63), C64(H64), C87(H87),
 C96(H96), C53(H53), C41(H41), C95(H95), C102(H102), C9(H9), C58(H58),
 C2AA(H2AA), C70(H70), C109(H109), C33(H33), C93(H93), C51(H51), C32(H32),
 C90(H90), C91(H91), C7(H7), C14(H14), C104(H104), C30(H30), C37(H37), C89(H89),
  C88(H88), C15(H15), C118(H118), C103(H103), C105(H105), C34(H34), C1(H1),
 C5(H5), C2(H2), C3(H3), C4(H4), C48(H48), C35(H35), C36(H36), C20(H20),
 C17(H17), C21(H21), C19(H19), C18(H18), C50(H50)
5.c Idealised Me refined as rotating group:
 C131(H13A,H13B,H13C), C65(H65A,H65B,H65C), C141(H14D,H14E,H14F), C127(H12A,
 H12B,H12C), C73(H73A,H73B,H73C), C130(H13D,H13E,H13F), C120(H12D,H12E,H12F),
 C66(H66A,H66B,H66C), C121(H12G,H12H,H12I), C84(H84A,H84B,H84C), C132(H13G,H13H,
 H13I), C85(H85A,H85B,H85C), C139(H13J,H13K,H13L), C76(H76A,H76B,H76C),
 C86(H86A,H86B,H86C), C140(H14A,H14B,H14C), C74(H74A,H74B,H74C), C67(H67A,H67B,
 H67C), C75(H75A,H75B,H75C), C138(H13M,H13N,H13O), C78(H78A,H78B,H78C),
 C77(H77A,H77B,H77C), C129(H12J,H12K,H12L), C128(H12M,H12N,H12O), C119(H11A,
 H11B,H11C), C1AA(H1AA,H1AB,H1AC)
;
_olex2_submission_special_instructions 'No special instructions were received'
loop_
_space_group_symop_operation_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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
Dy3 Dy -0.37069(2) 0.43415(2) 0.43086(2) 0.02285(10) Uani 1 1 d . .
Dy4 Dy -0.59352(2) 0.40283(2) 0.47038(2) 0.02184(10) Uani 1 1 d . .
Dy1 Dy 0.12333(2) 0.04825(2) 0.01995(2) 0.02344(10) Uani 1 1 d . .
Dy2 Dy 0.00704(2) 0.16736(2) 0.07347(2) 0.02431(10) Uani 1 1 d . .
O13 O -0.3747(3) 0.3227(3) 0.3579(2) 0.0263(12) Uani 1 1 d . .
O3 O 0.1190(3) -0.0600(3) -0.0653(2) 0.0234(11) Uani 1 1 d . .
O2 O 0.1452(3) 0.1803(2) 0.0535(2) 0.0215(11) Uani 1 1 d . .
O12 O -0.3933(3) 0.4413(3) 0.3345(2) 0.0284(12) Uani 1 1 d . .
O6 O 0.1937(3) 0.0093(3) 0.0813(2) 0.0304(12) Uani 1 1 d . .
O10 O -0.3081(3) 0.5687(3) 0.4636(2) 0.0241(11) Uani 1 1 d . .
O9 O -0.6391(3) 0.4985(3) 0.4615(2) 0.0262(12) Uani 1 1 d . .
O11 O -0.4883(3) 0.3496(3) 0.4546(2) 0.0209(11) Uani 1 1 d . .
O14 O -0.6434(3) 0.3471(3) 0.3639(2) 0.0270(12) Uani 1 1 d . .
O1 O 0.0653(3) 0.0929(3) 0.1075(2) 0.0261(12) Uani 1 1 d . .
O5 O -0.0838(3) 0.2314(3) 0.0919(2) 0.0290(12) Uani 1 1 d . .
O4 O 0.0077(3) 0.2162(3) -0.0031(2) 0.0311(13) Uani 1 1 d . .
N10 N -0.2241(4) 0.4831(3) 0.4045(3) 0.0267(14) Uani 1 1 d . .
O7 O 0.2663(3) 0.0909(3) 0.0165(3) 0.0395(15) Uani 1 1 d . .
N8 N -0.7132(4) 0.5984(3) 0.4974(3) 0.0268(15) Uani 1 1 d . .
N12 N -0.5539(4) 0.3666(3) 0.5579(3) 0.0225(14) Uani 1 1 d . .
O8 O -0.0074(3) 0.0607(3) -0.0120(2) 0.0213(11) Uani 1 1 d D .
C44 C -0.6985(5) 0.5779(4) 0.4381(3) 0.0223(16) Uani 1 1 d . .
N7 N -0.7248(4) 0.6168(4) 0.2964(3) 0.0330(16) Uani 1 1 d . .
C59 C 0.1569(4) -0.0468(4) -0.1099(3) 0.0226(16) Uani 1 1 d . .
O15 O -0.6785(3) 0.2777(3) 0.4452(2) 0.0311(13) Uani 1 1 d . .
N11 N -0.4563(4) 0.1893(4) 0.5995(3) 0.0377(18) Uani 1 1 d . .
N5 N 0.2488(5) -0.0096(4) -0.2660(3) 0.0392(18) Uani 1 1 d . .
C131 C -0.7660(6) 0.3001(5) 0.2519(4) 0.045(2) Uani 1 1 d . .
H13A H -0.817689 0.265086 0.257407 0.068 Uiso 1 1 calc GR .
H13B H -0.776053 0.302448 0.211247 0.068 Uiso 1 1 calc GR .
H13C H -0.750255 0.350691 0.284403 0.068 Uiso 1 1 calc GR .
C113 C -0.4847(5) 0.3056(4) 0.4850(3) 0.0221(16) Uani 1 1 d . .
C126 C -0.3962(5) 0.2109(4) 0.2707(4) 0.035(2) Uani 1 1 d . .
C135 C -0.6986(5) 0.2156(4) 0.3371(4) 0.0278(18) Uani 1 1 d . .
H135 H -0.712860 0.168215 0.303565 0.033 Uiso 1 1 calc R .
C43 C -0.6568(5) 0.5256(4) 0.4210(3) 0.0234(16) Uani 1 1 d . .
C116 C -0.5322(6) 0.2952(5) 0.6347(4) 0.035(2) Uani 1 1 d . .
H116 H -0.524839 0.271064 0.661491 0.042 Uiso 1 1 calc R .
N4 N 0.1160(4) 0.3044(3) 0.1201(3) 0.0279(15) Uani 1 1 d . .
C65 C 0.0026(6) 0.2404(6) -0.1174(4) 0.052(3) Uani 1 1 d . .
H65A H 0.019553 0.199350 -0.116654 0.078 Uiso 1 1 calc GR .
H65B H 0.029462 0.260242 -0.146917 0.078 Uiso 1 1 calc GR .
H65C H -0.059131 0.221027 -0.130130 0.078 Uiso 1 1 calc GR .
C99 C -0.1186(5) 0.5928(4) 0.3950(4) 0.0312(19) Uani 1 1 d . .
N9 N -0.0157(4) 0.7012(4) 0.3836(3) 0.0380(17) Uani 1 1 d . .
N3 N 0.3862(6) 0.4654(5) 0.0968(5) 0.080(3) Uani 1 1 d . U
C11 C 0.0481(5) 0.0828(4) 0.1591(4) 0.0286(18) Uani 1 1 d . .
C61 C 0.1929(5) 0.0306(4) -0.1730(4) 0.0273(17) Uani 1 1 d . .
N2 N 0.0113(4) 0.1913(4) 0.1868(3) 0.0324(16) Uani 1 1 d . .
C114 C -0.5143(4) 0.3167(4) 0.5416(3) 0.0198(15) Uani 1 1 d . .
C28 C 0.1913(5) 0.3151(4) 0.1005(3) 0.0263(17) Uani 1 1 d . .
C101 C -0.1082(5) 0.4704(4) 0.3545(4) 0.0311(19) Uani 1 1 d . .
H101 H -0.080419 0.438368 0.334004 0.037 Uiso 1 1 calc R .
C133 C -0.6941(5) 0.2723(4) 0.2558(4) 0.0313(19) Uani 1 1 d . .
C27 C 0.2065(5) 0.2486(4) 0.0659(3) 0.0229(17) Uani 1 1 d . .
C22 C 0.5225(6) 0.5552(6) 0.0995(6) 0.072(4) Uani 1 1 d . U
C29 C 0.2537(5) 0.3869(4) 0.1123(4) 0.035(2) Uani 1 1 d . .
C25 C 0.3418(5) 0.3288(5) 0.0574(5) 0.044(2) Uani 1 1 d . .
H25 H 0.392283 0.332727 0.041570 0.053 Uiso 1 1 calc R .
C141 C -0.1539(8) 0.6284(8) 0.5955(6) 0.095(5) Uani 1 1 d . .
H14D H -0.134408 0.682982 0.619908 0.142 Uiso 1 1 calc GR .
H14E H -0.216024 0.606145 0.585930 0.142 Uiso 1 1 calc GR .
H14F H -0.132539 0.619840 0.556887 0.142 Uiso 1 1 calc GR .
C42 C -0.6413(5) 0.5040(4) 0.3617(4) 0.0300(18) Uani 1 1 d . .
H42 H -0.616079 0.467739 0.348408 0.036 Uiso 1 1 calc R .
C134 C -0.6749(5) 0.2800(4) 0.3235(4) 0.0266(17) Uani 1 1 d . .
C117 C -0.5700(6) 0.3460(5) 0.6516(4) 0.038(2) Uani 1 1 d . .
H117 H -0.589129 0.357872 0.689606 0.046 Uiso 1 1 calc R .
C31 C 0.1610(6) 0.4406(5) 0.1648(5) 0.053(3) Uani 1 1 d . .
H31 H 0.147465 0.482925 0.186438 0.064 Uiso 1 1 calc R .
C62 C 0.1943(6) 0.0959(5) -0.1816(4) 0.037(2) Uani 1 1 d . .
H62 H 0.214101 0.105880 -0.215854 0.044 Uiso 1 1 calc R .
C110 C -0.4674(5) 0.2231(4) 0.5578(4) 0.0298(18) Uani 1 1 d . .
C12 C 0.0187(5) 0.1346(5) 0.2022(4) 0.0307(19) Uani 1 1 d . .
C45 C -0.7221(5) 0.6063(4) 0.3962(3) 0.0283(18) Uani 1 1 d . .
C112 C -0.4511(5) 0.2505(4) 0.4654(4) 0.0284(18) Uani 1 1 d . .
H112 H -0.432788 0.239935 0.427026 0.034 Uiso 1 1 calc R .
C40 C -0.7012(5) 0.5860(4) 0.3372(4) 0.0315(19) Uani 1 1 d . .
C56 C 0.2206(5) -0.0231(4) -0.2142(4) 0.0326(19) Uani 1 1 d . .
C111 C -0.4437(5) 0.2095(4) 0.5019(4) 0.0301(18) Uani 1 1 d . .
H111 H -0.421364 0.171297 0.486902 0.036 Uiso 1 1 calc R .
C106 C -0.4664(8) -0.0228(5) 0.6459(5) 0.071(4) Uani 1 1 d . .
H106 H -0.480673 -0.075887 0.630714 0.085 Uiso 1 1 calc R .
C122 C -0.3752(5) 0.4485(5) 0.2367(4) 0.037(2) Uani 1 1 d . .
C26 C 0.2813(5) 0.2568(4) 0.0457(4) 0.0319(19) Uani 1 1 d . .
H26 H 0.292277 0.213074 0.023581 0.038 Uiso 1 1 calc R .
C98 C -0.1926(5) 0.5589(4) 0.4141(4) 0.0279(18) Uani 1 1 d . .
C8 C 0.0035(5) 0.0660(6) 0.2696(4) 0.047(3) Uani 1 1 d . .
C10 C 0.0568(5) 0.0257(5) 0.1737(4) 0.036(2) Uani 1 1 d . .
H10 H 0.078459 -0.007976 0.147071 0.043 Uiso 1 1 calc R .
C39 C -0.6768(6) 0.6345(4) 0.2606(4) 0.035(2) Uani 1 1 d . .
H39 H -0.624028 0.628834 0.263150 0.041 Uiso 1 1 calc R .
C127 C -0.3432(6) 0.1921(5) 0.3128(4) 0.038(2) Uani 1 1 d . .
H12A H -0.282834 0.219438 0.315403 0.057 Uiso 1 1 calc GR .
H12B H -0.356418 0.137474 0.295678 0.057 Uiso 1 1 calc GR .
H12C H -0.356386 0.207289 0.354288 0.057 Uiso 1 1 calc GR .
C55 C 0.2382(6) -0.0652(5) -0.3174(4) 0.037(2) Uani 1 1 d . .
H55 H 0.210685 -0.115659 -0.320441 0.044 Uiso 1 1 calc R .
C108 C -0.4538(6) 0.0872(5) 0.6262(4) 0.039(2) Uani 1 1 d . .
C46 C -0.7658(6) 0.6547(5) 0.4169(4) 0.038(2) Uani 1 1 d . .
H46 H -0.783360 0.675028 0.390161 0.046 Uiso 1 1 calc R .
C23 C 0.4600(6) 0.4825(5) 0.0922(4) 0.042(2) Uani 1 1 d . .
H23 H 0.479664 0.442321 0.082465 0.050 Uiso 1 1 calc R .
C100 C -0.0754(5) 0.5454(5) 0.3647(4) 0.034(2) Uani 1 1 d . .
H100 H -0.024316 0.566075 0.351796 0.041 Uiso 1 1 calc R .
C57 C 0.2197(5) -0.0837(5) -0.1996(4) 0.034(2) Uani 1 1 d . .
H57 H 0.241341 -0.118207 -0.225190 0.041 Uiso 1 1 calc R .
C137 C -0.7390(6) 0.1428(4) 0.4062(4) 0.038(2) Uani 1 1 d . .
C49 C 0.2968(7) 0.0187(6) -0.3732(5) 0.053(3) Uani 1 1 d . .
H49 H 0.303298 0.062377 -0.337898 0.064 Uiso 1 1 calc R .
C54 C 0.2677(6) -0.0522(5) -0.3709(4) 0.041(2) Uani 1 1 d . .
C60 C 0.1624(4) 0.0186(4) -0.1213(3) 0.0215(16) Uani 1 1 d . .
C136 C -0.7029(5) 0.2151(5) 0.3952(4) 0.0303(19) Uani 1 1 d . .
C107 C -0.4679(8) 0.0122(5) 0.6055(5) 0.072(4) Uani 1 1 d . .
H107 H -0.478951 -0.016589 0.562240 0.086 Uiso 1 1 calc R .
C38 C -0.6990(6) 0.6633(4) 0.2154(4) 0.038(2) Uani 1 1 d . .
C13 C -0.0003(5) 0.1265(5) 0.2573(4) 0.040(2) Uani 1 1 d . .
C73 C -0.1498(7) 0.3290(6) 0.1699(5) 0.065(3) Uani 1 1 d . .
H73A H -0.145619 0.286487 0.178523 0.098 Uiso 1 1 calc GR .
H73B H -0.196681 0.340887 0.186571 0.098 Uiso 1 1 calc GR .
H73C H -0.096690 0.373365 0.189313 0.098 Uiso 1 1 calc GR .
C47 C -0.7827(6) 0.6723(5) 0.4736(4) 0.037(2) Uani 1 1 d . .
H47 H -0.814014 0.703485 0.486652 0.044 Uiso 1 1 calc R .
C52 C 0.2832(7) -0.1075(7) -0.4766(5) 0.061(3) Uani 1 1 d . .
H52 H 0.280595 -0.150396 -0.511217 0.073 Uiso 1 1 calc R .
C97 C -0.2377(5) 0.6028(4) 0.4446(4) 0.0327(19) Uani 1 1 d . .
C130 C -0.6157(6) 0.3223(5) 0.2420(4) 0.040(2) Uani 1 1 d . .
H13D H -0.628400 0.320416 0.200115 0.061 Uiso 1 1 calc GR .
H13E H -0.569884 0.304315 0.244928 0.061 Uiso 1 1 calc GR .
H13F H -0.597957 0.374634 0.272058 0.061 Uiso 1 1 calc GR .
C83 C 0.2704(5) -0.0482(5) 0.1227(4) 0.039(2) Uani 1 1 d . .
C81 C 0.3286(6) 0.0287(5) 0.0592(5) 0.045(2) Uani 1 1 d . .
H81 H 0.378008 0.018630 0.065179 0.054 Uiso 1 1 calc R .
C124 C -0.3781(5) 0.3346(4) 0.2620(4) 0.0310(18) Uani 1 1 d . .
H124 H -0.372113 0.312213 0.220568 0.037 Uiso 1 1 calc R .
C115 C -0.5042(5) 0.2777(4) 0.5788(3) 0.0253(17) Uani 1 1 d . .
C63 C 0.1669(6) 0.1445(5) -0.1403(4) 0.039(2) Uani 1 1 d . .
H63 H 0.166333 0.188268 -0.146039 0.047 Uiso 1 1 calc R .
C142 C -0.1210(8) 0.5916(8) 0.6325(7) 0.087(4) Uani 1 1 d . .
C64 C 0.1394(5) 0.1301(4) -0.0894(4) 0.0280(18) Uani 1 1 d . .
H64 H 0.121914 0.165623 -0.060502 0.034 Uiso 1 1 calc R .
N6 N 0.1365(4) 0.0691(3) -0.0796(3) 0.0248(14) Uani 1 1 d . .
C87 C 0.0656(6) 0.8319(5) 0.3087(5) 0.058(3) Uani 1 1 d . .
H87 H 0.014516 0.837424 0.297925 0.069 Uiso 1 1 calc R .
C96 C -0.2115(6) 0.6764(5) 0.4530(5) 0.044(2) Uani 1 1 d . .
H96 H -0.241772 0.706101 0.473203 0.052 Uiso 1 1 calc R .
C94 C -0.0917(5) 0.6700(5) 0.4028(4) 0.040(2) Uani 1 1 d . .
C80 C 0.3283(6) 0.0733(5) 0.0247(4) 0.044(2) Uani 1 1 d . .
C69 C -0.0083(5) 0.2713(5) -0.0063(4) 0.0307(18) Uani 1 1 d . .
C125 C -0.3805(5) 0.2941(4) 0.3000(3) 0.0251(17) Uani 1 1 d . .
C53 C 0.2606(7) -0.1153(6) -0.4229(4) 0.058(3) Uani 1 1 d . .
H53 H 0.239980 -0.164088 -0.421527 0.070 Uiso 1 1 calc R .
C41 C -0.6619(5) 0.5344(4) 0.3203(4) 0.0311(19) Uani 1 1 d . .
H41 H -0.648687 0.519548 0.280268 0.037 Uiso 1 1 calc R .
C24 C 0.3308(5) 0.3931(4) 0.0905(5) 0.042(2) Uani 1 1 d . .
C95 C -0.1373(6) 0.7096(5) 0.4310(5) 0.053(3) Uani 1 1 d . .
H95 H -0.119882 0.761247 0.436584 0.063 Uiso 1 1 calc R .
C102 C -0.1829(5) 0.4407(4) 0.3743(4) 0.0301(18) Uani 1 1 d . .
H102 H -0.205372 0.388063 0.366055 0.036 Uiso 1 1 calc R .
C9 C 0.0339(5) 0.0168(5) 0.2280(4) 0.043(2) Uani 1 1 d . .
H9 H 0.039133 -0.023870 0.236631 0.052 Uiso 1 1 calc R .
C58 C 0.1886(5) -0.0964(4) -0.1494(4) 0.0281(18) Uani 1 1 d . .
H58 H 0.188951 -0.139094 -0.141760 0.034 Uiso 1 1 calc R .
C2AA C -0.0129(6) 0.2413(5) 0.2268(4) 0.044(2) Uani 1 1 d . .
H2AA H -0.018037 0.280886 0.216366 0.053 Uiso 1 1 calc R .
C120 C -0.2915(7) 0.5198(7) 0.2660(6) 0.070(4) Uani 1 1 d . .
H12D H -0.292175 0.547767 0.309264 0.105 Uiso 1 1 calc GR .
H12E H -0.286361 0.552444 0.242975 0.105 Uiso 1 1 calc GR .
H12F H -0.243189 0.504203 0.264399 0.105 Uiso 1 1 calc GR .
C70 C -0.0616(5) 0.3017(5) 0.0286(4) 0.039(2) Uani 1 1 d . .
H70 H -0.071741 0.341549 0.021491 0.047 Uiso 1 1 calc R .
C71 C -0.1003(5) 0.2780(5) 0.0724(4) 0.036(2) Uani 1 1 d . .
C109 C -0.4632(6) 0.1222(5) 0.5827(4) 0.041(2) Uani 1 1 d . .
H109 H -0.475213 0.092275 0.539567 0.049 Uiso 1 1 calc R .
C33 C -0.6460(7) 0.6790(5) 0.1769(5) 0.057(3) Uani 1 1 d . .
H33 H -0.594841 0.670696 0.179718 0.069 Uiso 1 1 calc R .
C93 C -0.0117(6) 0.7497(5) 0.3601(5) 0.045(2) Uani 1 1 d . .
H93 H -0.059853 0.761668 0.354728 0.054 Uiso 1 1 calc R .
C92 C 0.0662(6) 0.7878(5) 0.3410(4) 0.039(2) Uani 1 1 d . .
C51 C 0.3098(7) -0.0367(7) -0.4794(5) 0.062(3) Uani 1 1 d . .
H51 H 0.323199 -0.030995 -0.516553 0.075 Uiso 1 1 calc R .
C32 C 0.1038(5) 0.3663(5) 0.1513(4) 0.039(2) Uani 1 1 d . .
H32 H 0.052287 0.360359 0.165877 0.046 Uiso 1 1 calc R .
C90 C 0.2139(7) 0.8192(6) 0.3423(6) 0.066(3) Uani 1 1 d . .
H90 H 0.265496 0.815316 0.354525 0.079 Uiso 1 1 calc R .
C79 C 0.4102(7) 0.1057(8) 0.0004(7) 0.081(3) Uani 1 1 d . U
C91 C 0.1397(6) 0.7816(5) 0.3578(5) 0.047(2) Uani 1 1 d . .
H91 H 0.140302 0.751178 0.380530 0.057 Uiso 1 1 calc R .
C66 C 0.1275(6) 0.3326(5) -0.0336(5) 0.046(2) Uani 1 1 d . .
H66A H 0.143030 0.291357 -0.031378 0.069 Uiso 1 1 calc GR .
H66B H 0.146932 0.374784 0.006944 0.069 Uiso 1 1 calc GR .
H66C H 0.154247 0.349744 -0.064403 0.069 Uiso 1 1 calc GR .
C7 C -0.0453(7) 0.0017(9) 0.3324(6) 0.086(5) Uani 1 1 d D .
H7 H -0.051375 -0.044885 0.300580 0.103 Uiso 1 1 calc R .
C14 C -0.0258(6) 0.1839(7) 0.2979(4) 0.056(3) Uani 1 1 d . .
H14 H -0.038845 0.181969 0.336152 0.068 Uiso 1 1 calc R .
N13 N -0.0942(7) 0.5630(7) 0.6624(6) 0.100(4) Uani 1 1 d . .
N1 N -0.0213(5) 0.0611(7) 0.3246(4) 0.074(3) Uani 1 1 d . .
C123 C -0.3840(5) 0.4056(5) 0.2811(4) 0.0298(18) Uani 1 1 d . .
C6 C -0.0648(8) 0.0059(7) 0.3955(5) 0.069(3) Uani 1 1 d D .
C121 C -0.4472(6) 0.4737(5) 0.2328(4) 0.047(2) Uani 1 1 d . .
H12G H -0.456620 0.497042 0.274517 0.070 Uiso 1 1 calc GR .
H12H H -0.498653 0.429872 0.207798 0.070 Uiso 1 1 calc GR .
H12I H -0.433563 0.510714 0.213470 0.070 Uiso 1 1 calc GR .
C84 C 0.3503(6) -0.0670(6) 0.1199(5) 0.056(3) Uani 1 1 d . .
H84A H 0.400725 -0.020107 0.132676 0.084 Uiso 1 1 calc GR .
H84B H 0.347692 -0.100188 0.077438 0.084 Uiso 1 1 calc GR .
H84C H 0.353348 -0.092754 0.147756 0.084 Uiso 1 1 calc GR .
C104 C -0.4270(9) 0.0951(6) 0.7291(5) 0.080(4) Uani 1 1 d . .
H104 H -0.409892 0.124606 0.772413 0.097 Uiso 1 1 calc R .
C132 C -0.7204(6) 0.1910(5) 0.2081(4) 0.040(2) Uani 1 1 d . .
H13G H -0.771707 0.157994 0.215837 0.060 Uiso 1 1 calc GR .
H13H H -0.674579 0.173225 0.211597 0.060 Uiso 1 1 calc GR .
H13I H -0.731769 0.189849 0.166305 0.060 Uiso 1 1 calc GR .
C30 C 0.2359(6) 0.4500(5) 0.1460(5) 0.048(2) Uani 1 1 d . .
H30 H 0.276490 0.499592 0.155716 0.057 Uiso 1 1 calc R .
C37 C -0.7726(7) 0.6754(5) 0.2106(4) 0.052(3) Uani 1 1 d . .
H37 H -0.811506 0.663752 0.236206 0.063 Uiso 1 1 calc R .
C89 C 0.2116(6) 0.8620(5) 0.3089(5) 0.059(3) Uani 1 1 d . .
H89 H 0.261917 0.887714 0.297667 0.071 Uiso 1 1 calc R .
C88 C 0.1374(7) 0.8681(6) 0.2916(6) 0.064(3) Uani 1 1 d . .
H88 H 0.135885 0.897258 0.267947 0.077 Uiso 1 1 calc R .
C15 C -0.0311(6) 0.2392(6) 0.2827(4) 0.053(3) Uani 1 1 d . .
H15 H -0.047310 0.276919 0.309913 0.064 Uiso 1 1 calc R .
C118 C -0.5795(5) 0.3803(4) 0.6108(4) 0.0309(19) Uani 1 1 d . .
H118 H -0.606176 0.415621 0.622058 0.037 Uiso 1 1 calc R .
C85 C 0.2696(6) -0.0046(6) 0.1903(4) 0.052(3) Uani 1 1 d . .
H85A H 0.277701 -0.032439 0.215224 0.078 Uiso 1 1 calc GR .
H85B H 0.215009 0.000832 0.192949 0.078 Uiso 1 1 calc GR .
H85C H 0.315387 0.045640 0.205904 0.078 Uiso 1 1 calc GR .
C68 C 0.0307(6) 0.3040(5) -0.0526(4) 0.043(2) Uani 1 1 d . .
C72 C -0.1658(6) 0.3076(5) 0.1004(5) 0.046(2) Uani 1 1 d . .
C139 C -0.8319(7) 0.1297(8) 0.4097(6) 0.094(5) Uani 1 1 d . .
H13J H -0.834685 0.170682 0.445882 0.141 Uiso 1 1 calc GR .
H13K H -0.859783 0.081157 0.413523 0.141 Uiso 1 1 calc GR .
H13L H -0.860781 0.128806 0.372059 0.141 Uiso 1 1 calc GR .
C103 C -0.4338(7) 0.1291(6) 0.6885(5) 0.056(3) Uani 1 1 d . .
H103 H -0.424798 0.181318 0.703771 0.067 Uiso 1 1 calc R .
C76 C 0.3941(7) 0.1317(7) -0.0477(6) 0.071(3) Uani 1 1 d . U
H76A H 0.357674 0.088202 -0.084771 0.106 Uiso 1 1 calc GR .
H76B H 0.447899 0.157240 -0.057669 0.106 Uiso 1 1 calc GR .
H76C H 0.365764 0.167139 -0.032935 0.106 Uiso 1 1 calc GR .
C82 C 0.2628(6) -0.0005(5) 0.0844(4) 0.040(2) Uani 1 1 d . .
C105 C -0.4446(8) 0.0192(6) 0.7072(6) 0.070(3) Uani 1 1 d . .
H105 H -0.441503 -0.004173 0.735435 0.084 Uiso 1 1 calc R .
C34 C -0.6639(9) 0.7068(6) 0.1334(5) 0.072(4) Uani 1 1 d . .
H34 H -0.626439 0.716215 0.106360 0.087 Uiso 1 1 calc R .
C86 C 0.1920(7) -0.1223(5) 0.0963(5) 0.061(3) Uani 1 1 d . .
H86A H 0.192185 -0.150565 0.053045 0.091 Uiso 1 1 calc GR .
H86B H 0.140772 -0.110856 0.098455 0.091 Uiso 1 1 calc GR .
H86C H 0.192816 -0.152754 0.120474 0.091 Uiso 1 1 calc GR .
C1 C -0.0616(8) 0.0746(8) 0.4428(6) 0.082(4) Uani 1 1 d . .
H1 H -0.047175 0.120087 0.435855 0.099 Uiso 1 1 calc R .
C5 C -0.0951(9) -0.0570(7) 0.4031(8) 0.104(6) Uani 1 1 d . .
H5 H -0.099830 -0.102058 0.369980 0.125 Uiso 1 1 calc R .
C2 C -0.0803(10) 0.0728(9) 0.4998(6) 0.102(5) Uani 1 1 d . .
H2 H -0.073821 0.118727 0.532599 0.122 Uiso 1 1 calc R .
C3 C -0.1074(12) 0.0071(10) 0.5098(7) 0.117(6) Uani 1 1 d . .
H3 H -0.116850 0.006840 0.549171 0.140 Uiso 1 1 calc R .
C4 C -0.1213(12) -0.0631(10) 0.4565(9) 0.127(7) Uani 1 1 d . .
H4 H -0.147415 -0.111164 0.458539 0.153 Uiso 1 1 calc R .
C48 C -0.7541(5) 0.6446(5) 0.5142(4) 0.037(2) Uani 1 1 d . .
H48 H -0.764511 0.659522 0.555100 0.044 Uiso 1 1 calc R .
C140 C -0.6947(7) 0.1494(5) 0.4669(5) 0.066(3) Uani 1 1 d . .
H14A H -0.636118 0.154352 0.464573 0.098 Uiso 1 1 calc GR .
H14B H -0.724554 0.104032 0.474758 0.098 Uiso 1 1 calc GR .
H14C H -0.694741 0.194195 0.500723 0.098 Uiso 1 1 calc GR .
C74 C -0.2511(7) 0.2424(7) 0.0718(6) 0.074(4) Uani 1 1 d . .
H74A H -0.248280 0.197112 0.076067 0.111 Uiso 1 1 calc GR .
H74B H -0.265747 0.232290 0.027817 0.111 Uiso 1 1 calc GR .
H74C H -0.294517 0.255728 0.093071 0.111 Uiso 1 1 calc GR .
C67 C 0.0081(7) 0.3710(6) -0.0541(6) 0.069(4) Uani 1 1 d . .
H67A H 0.036437 0.389949 -0.083542 0.103 Uiso 1 1 calc GR .
H67B H 0.026857 0.411738 -0.012735 0.103 Uiso 1 1 calc GR .
H67C H -0.053417 0.353679 -0.067013 0.103 Uiso 1 1 calc GR .
C35 C -0.7373(10) 0.7200(6) 0.1308(5) 0.075(4) Uani 1 1 d . .
H35 H -0.750459 0.740239 0.102438 0.090 Uiso 1 1 calc R .
C36 C -0.7906(9) 0.7044(7) 0.1687(6) 0.078(4) Uani 1 1 d . .
H36 H -0.841392 0.713400 0.166529 0.094 Uiso 1 1 calc R .
C20 C 0.6604(9) 0.6404(7) 0.1039(7) 0.085(4) Uani 1 1 d . U
H20 H 0.719415 0.653605 0.116124 0.102 Uiso 1 1 calc R .
C75 C -0.1670(9) 0.3758(7) 0.0869(7) 0.096(5) Uani 1 1 d . .
H75A H -0.209351 0.392998 0.106522 0.145 Uiso 1 1 calc GR .
H75B H -0.181415 0.360968 0.042026 0.145 Uiso 1 1 calc GR .
H75C H -0.110959 0.417047 0.103433 0.145 Uiso 1 1 calc GR .
C138 C -0.7423(10) 0.0756(6) 0.3529(6) 0.099(5) Uani 1 1 d . U
H13M H -0.776038 0.071168 0.315625 0.148 Uiso 1 1 calc GR .
H13N H -0.768418 0.030026 0.361367 0.148 Uiso 1 1 calc GR .
H13O H -0.684702 0.081293 0.346588 0.148 Uiso 1 1 calc GR .
C17 C 0.4935(10) 0.5997(7) 0.0785(7) 0.093(4) Uani 1 1 d . U
H17 H 0.434150 0.584026 0.065482 0.112 Uiso 1 1 calc R .
C21 C 0.6029(8) 0.5719(7) 0.1008(7) 0.092(4) Uani 1 1 d . U
H21 H 0.624053 0.534033 0.099531 0.110 Uiso 1 1 calc R .
C19 C 0.6356(9) 0.6834(9) 0.0910(7) 0.101(5) Uani 1 1 d . U
H19 H 0.675837 0.729046 0.091244 0.121 Uiso 1 1 calc R .
C18 C 0.5480(11) 0.6672(9) 0.0756(8) 0.116(5) Uani 1 1 d . U
H18 H 0.527588 0.699615 0.064073 0.139 Uiso 1 1 calc R .
C78 C 0.4629(10) 0.1875(10) 0.0589(8) 0.145(6) Uani 1 1 d . U
H78A H 0.423408 0.211198 0.075212 0.218 Uiso 1 1 calc GR .
H78B H 0.505613 0.220862 0.044682 0.218 Uiso 1 1 calc GR .
H78C H 0.490847 0.178793 0.091644 0.218 Uiso 1 1 calc GR .
C77 C 0.4702(10) 0.0755(11) 0.0017(9) 0.136(5) Uani 1 1 d . U
H77A H 0.475909 0.067603 0.040332 0.204 Uiso 1 1 calc GR .
H77B H 0.524663 0.110361 -0.000543 0.204 Uiso 1 1 calc GR .
H77C H 0.452906 0.026915 -0.033615 0.204 Uiso 1 1 calc GR .
C129 C -0.3757(8) 0.1865(5) 0.2065(4) 0.058(3) Uani 1 1 d . .
H12J H -0.316496 0.216628 0.208457 0.087 Uiso 1 1 calc GR .
H12K H -0.412896 0.194215 0.178332 0.087 Uiso 1 1 calc GR .
H12L H -0.384546 0.132725 0.191292 0.087 Uiso 1 1 calc GR .
C50 C 0.3166(7) 0.0250(6) -0.4283(5) 0.059(3) Uani 1 1 d . .
H50 H 0.335345 0.073485 -0.430350 0.070 Uiso 1 1 calc R .
C128 C -0.4898(6) 0.1688(5) 0.2667(6) 0.065(3) Uani 1 1 d . .
H12M H -0.503188 0.114182 0.249654 0.097 Uiso 1 1 calc GR .
H12N H -0.523559 0.180927 0.239734 0.097 Uiso 1 1 calc GR .
H12O H -0.502973 0.184173 0.308185 0.097 Uiso 1 1 calc GR .
C119 C -0.3724(10) 0.4004(8) 0.1713(5) 0.092(5) Uani 1 1 d . .
H11A H -0.363083 0.430866 0.146119 0.138 Uiso 1 1 calc GR .
H11B H -0.426354 0.356751 0.152938 0.138 Uiso 1 1 calc GR .
H11C H -0.326125 0.382706 0.172805 0.138 Uiso 1 1 calc GR .
N0AA N 0.1750(14) 0.4194(12) -0.1550(10) 0.182(8) Uani 1 1 d . U
C0AA C 0.1093(16) 0.4040(13) -0.1885(11) 0.144(8) Uani 1 1 d . U
C1AA C 0.0376(13) 0.4086(10) -0.2158(8) 0.143(7) Uani 1 1 d . U
H1AA H -0.010738 0.388497 -0.197880 0.215 Uiso 1 1 calc GR .
H1AB H 0.024820 0.378961 -0.260519 0.215 Uiso 1 1 calc GR .
H1AC H 0.048427 0.461650 -0.208098 0.215 Uiso 1 1 calc GR .
H8 H -0.004(4) 0.074(3) -0.041(2) 0.000(16) Uiso 1 1 d D .
O16 O -0.4795(3) 0.4783(2) 0.4407(2) 0.0208(11) Uani 1 1 d . .
H16 H -0.497781 0.486037 0.403102 0.025 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'
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
Dy4 Dy3 Dy4 62.131(11) 2_466 .
O13 Dy3 Dy4 108.73(13) . .
O13 Dy3 Dy4 168.72(13) . 2_466
O13 Dy3 O12 73.37(17) . .
O13 Dy3 O10 143.00(17) . .
O13 Dy3 O9 144.54(16) . 2_466
O13 Dy3 O11 82.48(17) . .
O13 Dy3 N10 80.91(19) . .
O13 Dy3 N8 83.19(18) . 2_466
O13 Dy3 O16 126.83(17) . .
O12 Dy3 Dy4 100.49(13) . .
O12 Dy3 Dy4 100.96(12) . 2_466
O12 Dy3 O10 81.50(17) . .
O12 Dy3 O9 141.93(16) . 2_466
O12 Dy3 O11 116.38(17) . .
O12 Dy3 N10 73.35(18) . .
O12 Dy3 N8 147.26(19) . 2_466
O10 Dy3 Dy4 42.08(11) . 2_466
O10 Dy3 Dy4 102.13(11) . .
O10 Dy3 O11 133.76(16) . .
O10 Dy3 N10 65.92(18) . .
O10 Dy3 N8 106.01(19) . 2_466
O9 Dy3 Dy4 68.97(12) 2_466 .
O9 Dy3 Dy4 41.24(11) 2_466 2_466
O9 Dy3 O10 66.26(17) 2_466 .
O9 Dy3 O11 77.11(17) 2_466 .
O9 Dy3 N10 108.53(19) 2_466 .
O9 Dy3 N8 65.55(17) 2_466 2_466
O11 Dy3 Dy4 35.86(11) . .
O11 Dy3 Dy4 91.69(11) . 2_466
O11 Dy3 N10 157.18(17) . .
O11 Dy3 N8 81.84(18) . 2_466
N10 Dy3 Dy4 107.14(14) . 2_466
N10 Dy3 Dy4 166.95(13) . .
N8 Dy3 Dy4 105.63(14) 2_466 2_466
N8 Dy3 Dy4 108.62(14) 2_466 .
N8 Dy3 N10 80.76(19) 2_466 .
O16 Dy3 Dy4 41.89(12) . 2_466
O16 Dy3 Dy4 34.31(11) . .
O16 Dy3 O12 79.41(17) . .
O16 Dy3 O10 72.48(16) . .
O16 Dy3 O9 72.18(16) . 2_466
O16 Dy3 O11 70.06(15) . .
O16 Dy3 N10 132.73(17) . .
O16 Dy3 N8 133.33(18) . 2_466
Dy3 Dy4 Dy3 117.869(11) 2_466 .
Dy3 Dy4 Dy4 62.321(11) 2_466 2_466
Dy4 Dy4 Dy3 55.549(10) 2_466 .
O10 Dy4 Dy3 41.19(11) 2_466 2_466
O10 Dy4 Dy3 154.06(12) 2_466 .
O10 Dy4 Dy4 101.47(11) 2_466 2_466
O10 Dy4 N12 78.94(17) 2_466 .
O10 Dy4 O16 69.78(16) 2_466 2_466
O9 Dy4 Dy3 110.21(12) . .
O9 Dy4 Dy3 41.00(12) . 2_466
O9 Dy4 Dy4 69.03(12) . 2_466
O9 Dy4 O10 65.42(16) . 2_466
O9 Dy4 N12 136.05(18) . .
O9 Dy4 O16 69.99(16) . 2_466
O11 Dy4 Dy3 36.22(10) . .
O11 Dy4 Dy3 142.09(12) . 2_466
O11 Dy4 Dy4 85.86(11) . 2_466
O11 Dy4 O10 145.01(16) . 2_466
O11 Dy4 O9 146.07(16) . .
O11 Dy4 N12 66.27(17) . .
O11 Dy4 O16 102.63(16) . 2_466
O14 Dy4 Dy3 85.59(13) . .
O14 Dy4 Dy3 122.53(12) . 2_466
O14 Dy4 Dy4 115.12(12) . 2_466
O14 Dy4 O10 117.77(18) . 2_466
O14 Dy4 O9 82.51(17) . .
O14 Dy4 O11 88.36(17) . .
O14 Dy4 N12 139.09(17) . .
O14 Dy4 O16 145.32(16) . 2_466
O14 Dy4 O16 81.16(17) . .
N12 Dy4 Dy3 95.10(13) . 2_466
N12 Dy4 Dy3 90.58(13) . .
N12 Dy4 Dy4 95.34(14) . 2_466
O15 Dy4 Dy3 114.17(14) . .
O15 Dy4 Dy3 126.46(14) . 2_466
O15 Dy4 Dy4 164.71(14) . 2_466
O15 Dy4 O10 85.40(17) . 2_466
O15 Dy4 O9 126.14(18) . .
O15 Dy4 O11 80.88(18) . .
O15 Dy4 O14 72.28(18) . .
O15 Dy4 N12 72.38(19) . .
O15 Dy4 O16 140.79(17) . .
O15 Dy4 O16 141.47(17) . 2_466
O16 Dy4 Dy3 33.73(11) . .
O16 Dy4 Dy3 84.60(11) 2_466 .
O16 Dy4 Dy3 39.47(11) 2_466 2_466
O16 Dy4 Dy3 92.05(11) . 2_466
O16 Dy4 Dy4 35.47(11) 2_466 2_466
O16 Dy4 Dy4 36.89(12) . 2_466
O16 Dy4 O10 133.17(15) . 2_466
O16 Dy4 O9 76.48(16) . .
O16 Dy4 O11 69.84(15) . .
O16 Dy4 N12 115.75(18) . .
O16 Dy4 N12 74.21(17) 2_466 .
O16 Dy4 O16 72.36(18) . 2_466
Dy2 Dy1 Dy1 54.829(10) 2 2
Dy2 Dy1 Dy1 62.585(11) . 2
Dy2 Dy1 Dy2 117.414(11) . 2
O3 Dy1 Dy1 85.43(11) . 2
O3 Dy1 Dy2 36.52(11) . 2
O3 Dy1 Dy2 141.83(12) . .
O3 Dy1 O2 144.39(16) . .
O3 Dy1 O8 102.09(16) . .
O3 Dy1 N6 66.26(17) . .
O2 Dy1 Dy1 101.57(11) . 2
O2 Dy1 Dy2 153.31(11) . 2
O2 Dy1 Dy2 41.20(11) . .
O2 Dy1 O8 70.01(16) . .
O2 Dy1 N6 78.31(18) . .
O6 Dy1 Dy1 116.62(13) . 2
O6 Dy1 Dy2 125.37(13) . .
O6 Dy1 Dy2 85.12(13) . 2
O6 Dy1 O3 86.32(17) . .
O6 Dy1 O2 119.55(18) . .
O6 Dy1 O1 85.23(17) . .
O6 Dy1 O8 82.47(17) . 2
O6 Dy1 O8 147.40(17) . .
O6 Dy1 N6 136.55(18) . .
O1 Dy1 Dy1 69.25(13) . 2
O1 Dy1 Dy2 109.77(12) . 2
O1 Dy1 Dy2 41.24(12) . .
O1 Dy1 O3 145.92(16) . .
O1 Dy1 O2 65.99(16) . .
O1 Dy1 O8 70.10(17) . .
O1 Dy1 N6 135.97(18) . .
O7 Dy1 Dy1 165.30(16) . 2
O7 Dy1 Dy2 115.96(14) . 2
O7 Dy1 Dy2 125.10(14) . .
O7 Dy1 O3 82.27(19) . .
O7 Dy1 O2 84.07(17) . .
O7 Dy1 O6 70.68(19) . .
O7 Dy1 O1 125.2(2) . .
O7 Dy1 O8 141.22(18) . .
O7 Dy1 O8 142.23(18) . 2
O7 Dy1 N6 72.7(2) . .
O8 Dy1 Dy1 35.10(11) . 2
O8 Dy1 Dy1 36.43(12) 2 2
O8 Dy1 Dy2 33.23(12) 2 2
O8 Dy1 Dy2 91.98(12) 2 .
O8 Dy1 Dy2 83.68(11) . 2
O8 Dy1 Dy2 39.75(11) . .
O8 Dy1 O3 69.64(16) 2 .
O8 Dy1 O2 133.16(16) 2 .
O8 Dy1 O1 76.53(17) 2 .
O8 Dy1 O8 71.53(18) 2 .
O8 Dy1 N6 115.22(18) 2 .
O8 Dy1 N6 74.13(18) . .
N6 Dy1 Dy1 95.00(14) . 2
N6 Dy1 Dy2 90.60(13) . 2
N6 Dy1 Dy2 94.77(13) . .
Dy1 Dy2 Dy1 62.585(11) . 2
O3 Dy2 Dy1 91.89(11) 2 .
O3 Dy2 Dy1 35.61(11) 2 2
O3 Dy2 N4 156.70(18) 2 .
O3 Dy2 N2 80.04(18) 2 .
O2 Dy2 Dy1 102.15(10) . 2
O2 Dy2 Dy1 41.81(10) . .
O2 Dy2 O3 133.69(15) . 2
O2 Dy2 O1 66.08(16) . .
O2 Dy2 N4 66.06(17) . .
O2 Dy2 N2 108.13(19) . .
O1 Dy2 Dy1 69.10(12) . 2
O1 Dy2 Dy1 40.74(12) . .
O1 Dy2 O3 77.44(16) . 2
O1 Dy2 N4 107.45(18) . .
O1 Dy2 N2 66.14(19) . .
O5 Dy2 Dy1 109.62(13) . 2
O5 Dy2 Dy1 170.22(13) . .
O5 Dy2 O3 83.20(16) . 2
O5 Dy2 O2 142.41(16) . .
O5 Dy2 O1 144.55(17) . .
O5 Dy2 O4 73.66(18) . .
O5 Dy2 N4 80.29(19) . .
O5 Dy2 N2 81.5(2) . .
O4 Dy2 Dy1 101.47(12) . .
O4 Dy2 Dy1 102.03(13) . 2
O4 Dy2 O3 117.68(17) . 2
O4 Dy2 O2 80.65(17) . .
O4 Dy2 O1 141.78(17) . .
O4 Dy2 N4 73.02(19) . .
O4 Dy2 N2 146.7(2) . .
O8 Dy2 Dy1 42.33(12) . .
O8 Dy2 Dy1 33.98(12) . 2
O8 Dy2 O3 69.48(16) . 2
O8 Dy2 O2 72.62(16) . .
O8 Dy2 O1 71.82(17) . .
O8 Dy2 O5 127.90(18) . .
O8 Dy2 O4 80.97(17) . .
O8 Dy2 N4 133.82(19) . .
O8 Dy2 N2 132.25(19) . .
N4 Dy2 Dy1 106.69(14) . .
N4 Dy2 Dy1 167.58(14) . 2
N2 Dy2 Dy1 106.02(15) . .
N2 Dy2 Dy1 107.03(14) . 2
N2 Dy2 N4 81.4(2) . .
C125 O13 Dy3 137.4(5) . .
Dy1 O3 Dy2 107.87(18) . 2
C59 O3 Dy1 116.4(4) . .
C59 O3 Dy2 128.6(4) . 2
Dy2 O2 Dy1 97.00(15) . .
C27 O2 Dy1 141.2(4) . .
C27 O2 Dy2 121.7(4) . .
C123 O12 Dy3 134.1(5) . .
C82 O6 Dy1 135.6(5) . .
Dy3 O10 Dy4 96.73(16) . 2_466
C97 O10 Dy3 121.4(4) . .
C97 O10 Dy4 141.8(4) . 2_466
Dy3 O9 Dy4 97.75(17) 2_466 .
C43 O9 Dy3 119.7(4) . 2_466
C43 O9 Dy4 142.0(5) . .
Dy4 O11 Dy3 107.92(16) . .
C113 O11 Dy3 126.7(4) . .
C113 O11 Dy4 117.4(4) . .
C134 O14 Dy4 135.4(5) . .
Dy1 O1 Dy2 98.02(17) . .
C11 O1 Dy1 142.2(5) . .
C11 O1 Dy2 119.1(4) . .
C71 O5 Dy2 135.6(5) . .
C69 O4 Dy2 133.4(5) . .
C98 N10 Dy3 115.0(5) . .
C102 N10 Dy3 126.2(5) . .
C102 N10 C98 118.0(7) . .
C80 O7 Dy1 138.0(6) . .
C44 N8 Dy3 114.2(4) . 2_466
C48 N8 Dy3 126.5(5) . 2_466
C48 N8 C44 117.9(6) . .
C114 N12 Dy4 113.6(4) . .
C118 N12 Dy4 126.8(5) . .
C118 N12 C114 118.5(6) . .
Dy1 O8 Dy1 108.47(18) 2 .
Dy2 O8 Dy1 97.92(18) . .
Dy2 O8 Dy1 112.8(2) . 2
N8 C44 C43 116.1(6) . .
N8 C44 C45 122.5(6) . .
C45 C44 C43 121.4(7) . .
C39 N7 C40 120.2(7) . .
O3 C59 C60 119.5(6) . .
O3 C59 C58 123.1(6) . .
C58 C59 C60 117.3(7) . .
C136 O15 Dy4 135.3(5) . .
C109 N11 C110 123.5(8) . .
C55 N5 C56 120.7(7) . .
O11 C113 C114 119.2(6) . .
O11 C113 C112 123.7(7) . .
C112 C113 C114 117.0(6) . .
C125 C126 C127 109.1(7) . .
C125 C126 C129 113.9(7) . .
C125 C126 C128 105.9(7) . .
C129 C126 C127 108.9(7) . .
C128 C126 C127 109.6(7) . .
C128 C126 C129 109.4(8) . .
C136 C135 C134 125.2(7) . .
O9 C43 C44 118.7(6) . .
O9 C43 C42 123.9(7) . .
C42 C43 C44 117.3(7) . .
C117 C116 C115 121.4(7) . .
C28 N4 Dy2 115.0(5) . .
C32 N4 Dy2 128.1(5) . .
C32 N4 C28 115.7(7) . .
C98 C99 C100 117.2(7) . .
C98 C99 C94 120.2(7) . .
C94 C99 C100 122.5(7) . .
C93 N9 C94 117.7(8) . .
C23 N3 C24 125.3(9) . .
O1 C11 C12 118.4(7) . .
O1 C11 C10 123.8(7) . .
C10 C11 C12 117.8(7) . .
C62 C61 C56 122.5(7) . .
C62 C61 C60 117.9(7) . .
C60 C61 C56 119.6(7) . .
C12 N2 Dy2 113.9(5) . .
C2AA N2 Dy2 126.1(6) . .
C2AA N2 C12 117.8(7) . .
N12 C114 C113 116.7(6) . .
N12 C114 C115 121.6(7) . .
C115 C114 C113 121.8(6) . .
N4 C28 C27 117.2(6) . .
N4 C28 C29 123.8(7) . .
C29 C28 C27 119.0(7) . .
C100 C101 C102 119.8(7) . .
C131 C133 C134 106.0(7) . .
C131 C133 C132 110.0(7) . .
C130 C133 C131 110.1(7) . .
C130 C133 C134 109.0(6) . .
C130 C133 C132 108.4(7) . .
C132 C133 C134 113.3(6) . .
O2 C27 C28 118.3(6) . .
O2 C27 C26 122.5(7) . .
C26 C27 C28 119.2(6) . .
C17 C22 C23 116.3(10) . .
C21 C22 C23 126.5(11) . .
C21 C22 C17 111.8(12) . .
C28 C29 C24 120.2(7) . .
C30 C29 C28 116.8(8) . .
C30 C29 C24 123.0(7) . .
C24 C25 C26 122.2(8) . .
C43 C42 C41 121.6(7) . .
O14 C134 C135 124.3(7) . .
O14 C134 C133 115.5(6) . .
C135 C134 C133 120.0(7) . .
C116 C117 C118 117.4(7) . .
C30 C31 C32 118.1(8) . .
C63 C62 C61 119.1(7) . .
N11 C110 C115 115.1(7) . .
C111 C110 N11 126.1(7) . .
C111 C110 C115 118.8(7) . .
N2 C12 C11 116.7(7) . .
N2 C12 C13 122.6(8) . .
C13 C12 C11 120.7(8) . .
C44 C45 C40 119.7(7) . .
C44 C45 C46 116.6(7) . .
C46 C45 C40 123.6(7) . .
C113 C112 C111 120.9(7) . .
C45 C40 N7 118.3(7) . .
C41 C40 N7 122.9(7) . .
C41 C40 C45 118.8(7) . .
N5 C56 C61 117.6(7) . .
C57 C56 N5 125.0(7) . .
C57 C56 C61 117.4(7) . .
C110 C111 C112 122.1(7) . .
C105 C106 C107 119.2(9) . .
C120 C122 C123 105.9(7) . .
C121 C122 C120 108.7(8) . .
C121 C122 C123 111.1(7) . .
C121 C122 C119 108.1(8) . .
C119 C122 C120 110.5(9) . .
C119 C122 C123 112.6(7) . .
C27 C26 C25 120.7(7) . .
N10 C98 C99 122.5(7) . .
N10 C98 C97 117.6(7) . .
C99 C98 C97 119.8(7) . .
C13 C8 C9 117.8(8) . .
C13 C8 N1 116.2(10) . .
C9 C8 N1 125.9(9) . .
C11 C10 C9 120.5(9) . .
N7 C39 C38 123.0(8) . .
N5 C55 C54 121.3(8) . .
C107 C108 C109 120.9(9) . .
C107 C108 C103 119.0(8) . .
C103 C108 C109 120.1(8) . .
C47 C46 C45 120.6(7) . .
N3 C23 C22 129.5(10) . .
C101 C100 C99 119.4(7) . .
C56 C57 C58 123.2(7) . .
C136 C137 C139 106.1(7) . .
C136 C137 C140 112.2(7) . .
C140 C137 C139 108.2(9) . .
C138 C137 C136 112.4(8) . .
C138 C137 C139 104.9(10) . .
C138 C137 C140 112.5(9) . .
C54 C49 C50 118.8(10) . .
C49 C54 C55 122.7(8) . .
C49 C54 C53 119.6(9) . .
C53 C54 C55 117.6(9) . .
C61 C60 C59 121.6(7) . .
N6 C60 C59 116.4(6) . .
N6 C60 C61 122.0(6) . .
O15 C136 C135 122.2(7) . .
O15 C136 C137 115.0(7) . .
C135 C136 C137 122.8(7) . .
C108 C107 C106 121.5(10) . .
C33 C38 C39 120.3(9) . .
C33 C38 C37 117.9(9) . .
C37 C38 C39 121.9(8) . .
C12 C13 C14 115.3(9) . .
C8 C13 C12 120.9(8) . .
C8 C13 C14 123.7(8) . .
C46 C47 C48 119.9(8) . .
C51 C52 C53 119.5(10) . .
O10 C97 C98 118.5(6) . .
C96 C97 O10 121.5(7) . .
C96 C97 C98 120.0(7) . .
C84 C83 C82 114.2(8) . .
C85 C83 C84 109.2(7) . .
C85 C83 C82 108.7(7) . .
C85 C83 C86 109.0(8) . .
C86 C83 C84 108.9(8) . .
C86 C83 C82 106.8(7) . .
C82 C81 C80 124.2(8) . .
C123 C124 C125 124.5(7) . .
C116 C115 C114 117.1(7) . .
C116 C115 C110 123.8(7) . .
C114 C115 C110 119.2(7) . .
C62 C63 C64 120.0(7) . .
N13 C142 C141 179.3(16) . .
N6 C64 C63 123.0(7) . .
C60 N6 Dy1 112.9(4) . .
C64 N6 Dy1 127.3(5) . .
C64 N6 C60 118.0(6) . .
C92 C87 C88 120.9(10) . .
C97 C96 C95 119.4(8) . .
N9 C94 C99 117.4(7) . .
C95 C94 C99 118.1(7) . .
C95 C94 N9 124.4(8) . .
O7 C80 C81 121.5(8) . .
O7 C80 C79 119.8(8) . .
C81 C80 C79 118.5(8) . .
O4 C69 C70 123.7(7) . .
O4 C69 C68 117.0(7) . .
C70 C69 C68 119.3(7) . .
O13 C125 C126 117.3(7) . .
O13 C125 C124 123.3(7) . .
C124 C125 C126 119.3(7) . .
C52 C53 C54 120.8(10) . .
C40 C41 C42 121.1(7) . .
N3 C24 C29 117.8(8) . .
C25 C24 N3 122.9(9) . .
C25 C24 C29 118.7(7) . .
C94 C95 C96 122.4(8) . .
N10 C102 C101 122.9(7) . .
C8 C9 C10 122.1(8) . .
C57 C58 C59 120.6(7) . .
N2 C2AA C15 123.9(9) . .
C71 C70 C69 125.3(7) . .
O5 C71 C70 123.7(7) . .
O5 C71 C72 116.2(7) . .
C70 C71 C72 120.2(8) . .
N11 C109 C108 123.2(9) . .
C38 C33 C34 122.5(11) . .
N9 C93 C92 121.7(8) . .
C87 C92 C93 120.5(9) . .
C91 C92 C87 119.6(8) . .
C91 C92 C93 119.8(8) . .
C50 C51 C52 119.5(10) . .
N4 C32 C31 125.2(8) . .
C89 C90 C91 118.9(10) . .
C80 C79 C78 101.5(11) . .
C76 C79 C80 112.3(9) . .
C76 C79 C78 100.7(11) . .
C77 C79 C80 117.2(10) . .
C77 C79 C76 122.5(12) . .
C77 C79 C78 96.6(13) . .
C92 C91 C90 120.6(9) . .
N1 C7 C6 116.8(13) . .
C15 C14 C13 121.1(9) . .
C7 N1 C8 122.7(12) . .
O12 C123 C122 114.7(7) . .
O12 C123 C124 124.5(7) . .
C124 C123 C122 120.8(7) . .
C1 C6 C7 122.6(12) . .
C5 C6 C7 117.3(12) . .
C5 C6 C1 119.6(12) . .
C105 C104 C103 120.1(11) . .
C31 C30 C29 120.3(8) . .
C38 C37 C36 120.5(10) . .
C90 C89 C88 120.6(9) . .
C87 C88 C89 119.4(10) . .
C14 C15 C2AA 119.2(9) . .
N12 C118 C117 124.0(7) . .
C65 C68 C69 109.0(7) . .
C65 C68 C66 108.3(8) . .
C65 C68 C67 109.9(8) . .
C69 C68 C67 114.0(8) . .
C66 C68 C69 107.4(7) . .
C66 C68 C67 108.2(8) . .
C73 C72 C71 110.0(8) . .
C73 C72 C75 109.5(9) . .
C71 C72 C75 113.0(8) . .
C74 C72 C73 108.5(9) . .
C74 C72 C71 106.2(8) . .
C74 C72 C75 109.5(10) . .
C108 C103 C104 119.6(9) . .
O6 C82 C83 115.0(8) . .
O6 C82 C81 125.0(8) . .
C81 C82 C83 120.0(8) . .
C106 C105 C104 120.5(9) . .
C35 C34 C33 118.1(11) . .
C2 C1 C6 118.2(13) . .
C6 C5 C4 124.3(14) . .
C3 C2 C1 122.4(14) . .
C2 C3 C4 116.6(13) . .
C5 C4 C3 118.1(14) . .
N8 C48 C47 122.3(8) . .
C36 C35 C34 119.9(10) . .
C35 C36 C37 121.1(11) . .
C19 C20 C21 120.0(16) . .
C22 C17 C18 122.7(14) . .
C22 C21 C20 125.4(14) . .
C20 C19 C18 121.5(16) . .
C17 C18 C19 115.1(15) . .
C51 C50 C49 121.9(10) . .
N0AA C0AA C1AA 163(3) . .
Dy3 O16 Dy4 98.64(18) . 2_466
Dy3 O16 Dy4 111.96(17) . .
Dy4 O16 Dy4 107.64(18) . 2_466
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Dy3 Dy4 3.8717(5) .
Dy3 Dy4 3.6052(5) 2_466
Dy3 O13 2.299(5) .
Dy3 O12 2.338(5) .
Dy3 O10 2.391(5) .
Dy3 O9 2.387(5) 2_466
Dy3 O11 2.404(4) .
Dy3 N10 2.567(6) .
Dy3 N8 2.549(6) 2_466
Dy3 O16 2.318(5) .
Dy4 Dy4 3.8649(7) 2_466
Dy4 O10 2.433(5) 2_466
Dy4 O9 2.399(5) .
Dy4 O11 2.384(5) .
Dy4 O14 2.325(5) .
Dy4 N12 2.544(6) .
Dy4 O15 2.304(5) .
Dy4 O16 2.435(5) 2_466
Dy4 O16 2.353(5) .
Dy1 Dy1 3.8988(7) 2
Dy1 Dy2 3.8988(5) 2
Dy1 Dy2 3.5903(5) .
Dy1 O3 2.385(5) .
Dy1 O2 2.411(4) .
Dy1 O6 2.324(5) .
Dy1 O1 2.366(5) .
Dy1 O7 2.320(5) .
Dy1 O8 2.441(5) .
Dy1 O8 2.363(5) 2
Dy1 N6 2.529(6) .
Dy2 O3 2.438(5) 2
Dy2 O2 2.382(5) .
Dy2 O1 2.390(5) .
Dy2 O5 2.319(5) .
Dy2 O4 2.339(5) .
Dy2 O8 2.318(5) .
Dy2 N4 2.566(6) .
Dy2 N2 2.527(7) .
O13 C125 1.263(9) .
O3 C59 1.322(8) .
O2 C27 1.349(8) .
O12 C123 1.263(9) .
O6 C82 1.267(10) .
O10 C97 1.359(9) .
O9 C43 1.322(8) .
O11 C113 1.340(8) .
O14 C134 1.265(9) .
O1 C11 1.331(9) .
O5 C71 1.290(9) .
O4 C69 1.269(9) .
N10 C98 1.380(9) .
N10 C102 1.339(9) .
O7 C80 1.254(10) .
N8 C44 1.374(9) .
N8 C48 1.324(9) .
N12 C114 1.365(9) .
N12 C118 1.312(9) .
C44 C43 1.434(10) .
C44 C45 1.404(10) .
N7 C40 1.422(9) .
N7 C39 1.264(10) .
C59 C60 1.422(10) .
C59 C58 1.399(10) .
O15 C136 1.314(10) .
N11 C110 1.415(9) .
N11 C109 1.246(10) .
N5 C56 1.415(10) .
N5 C55 1.288(11) .
C131 C133 1.529(11) .
C113 C114 1.424(10) .
C113 C112 1.385(10) .
C126 C127 1.532(11) .
C126 C125 1.510(10) .
C126 C129 1.519(12) .
C126 C128 1.518(12) .
C135 C134 1.391(10) .
C135 C136 1.377(10) .
C43 C42 1.380(10) .
C116 C117 1.360(11) .
C116 C115 1.395(11) .
N4 C28 1.368(10) .
N4 C32 1.315(10) .
C65 C68 1.533(13) .
C99 C98 1.406(11) .
C99 C100 1.434(10) .
C99 C94 1.421(11) .
N9 C94 1.417(10) .
N9 C93 1.275(10) .
N3 C23 1.212(12) .
N3 C24 1.407(11) .
C11 C12 1.439(11) .
C11 C10 1.374(11) .
C61 C62 1.409(10) .
C61 C56 1.425(11) .
C61 C60 1.415(10) .
N2 C12 1.368(10) .
N2 C2AA 1.327(10) .
C114 C115 1.411(9) .
C28 C27 1.436(10) .
C28 C29 1.409(11) .
C101 C100 1.364(11) .
C101 C102 1.400(11) .
C133 C134 1.550(11) .
C133 C130 1.517(11) .
C133 C132 1.534(11) .
C27 C26 1.369(10) .
C22 C23 1.448(12) .
C22 C17 1.380(16) .
C22 C21 1.297(15) .
C29 C24 1.425(12) .
C29 C30 1.401(12) .
C25 C26 1.401(11) .
C25 C24 1.354(12) .
C141 C142 1.524(19) .
C42 C41 1.407(10) .
C117 C118 1.399(10) .
C31 C32 1.407(12) .
C31 C30 1.353(13) .
C62 C63 1.358(11) .
C110 C111 1.362(11) .
C110 C115 1.417(10) .
C12 C13 1.405(11) .
C45 C40 1.408(11) .
C45 C46 1.407(11) .
C112 C111 1.417(10) .
C40 C41 1.393(10) .
C56 C57 1.388(11) .
C106 C107 1.374(13) .
C106 C105 1.347(15) .
C122 C120 1.555(13) .
C122 C123 1.563(10) .
C122 C121 1.497(12) .
C122 C119 1.522(13) .
C98 C97 1.413(11) .
C8 C13 1.382(13) .
C8 C9 1.402(13) .
C8 N1 1.409(11) .
C10 C9 1.409(11) .
C39 C38 1.469(11) .
C55 C54 1.457(11) .
C108 C107 1.361(12) .
C108 C109 1.465(11) .
C108 C103 1.366(13) .
C46 C47 1.331(11) .
C57 C58 1.392(11) .
C137 C136 1.511(10) .
C137 C139 1.533(14) .
C137 C140 1.517(12) .
C137 C138 1.482(14) .
C49 C54 1.382(12) .
C49 C50 1.393(13) .
C54 C53 1.396(13) .
C60 N6 1.369(9) .
C38 C33 1.357(13) .
C38 C37 1.368(13) .
C13 C14 1.445(13) .
C73 C72 1.518(14) .
C47 C48 1.404(11) .
C52 C53 1.386(13) .
C52 C51 1.386(14) .
C97 C96 1.350(10) .
C83 C84 1.539(11) .
C83 C85 1.530(13) .
C83 C82 1.566(11) .
C83 C86 1.532(12) .
C81 C80 1.415(12) .
C81 C82 1.357(12) .
C124 C125 1.403(10) .
C124 C123 1.401(10) .
C63 C64 1.399(11) .
C142 N13 1.215(17) .
C64 N6 1.327(9) .
C87 C92 1.364(12) .
C87 C88 1.365(13) .
C96 C95 1.440(11) .
C94 C95 1.348(12) .
C80 C79 1.568(13) .
C69 C70 1.416(11) .
C69 C68 1.537(11) .
C2AA C15 1.378(13) .
C70 C71 1.394(12) .
C71 C72 1.524(11) .
C33 C34 1.393(13) .
C93 C92 1.481(11) .
C92 C91 1.357(12) .
C51 C50 1.370(15) .
C90 C91 1.388(12) .
C90 C89 1.368(14) .
C79 C76 1.452(14) .
C79 C78 1.65(2) .
C79 C77 1.368(16) .
C66 C68 1.537(12) .
C7 N1 1.224(14) .
C7 C6 1.517(13) .
C14 C15 1.324(14) .
C6 C1 1.436(16) .
C6 C5 1.290(15) .
C104 C103 1.383(12) .
C104 C105 1.365(14) .
C37 C36 1.380(13) .
C89 C88 1.370(14) .
C68 C67 1.552(12) .
C72 C74 1.517(14) .
C72 C75 1.536(13) .
C34 C35 1.374(17) .
C1 C2 1.405(16) .
C5 C4 1.388(18) .
C2 C3 1.368(18) .
C3 C4 1.47(2) .
C35 C36 1.350(17) .
C20 C21 1.383(16) .
C20 C19 1.209(17) .
C17 C18 1.404(18) .
C19 C18 1.42(2) .
N0AA C0AA 1.21(3) .
C0AA C1AA 1.40(3) .
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
Dy3 O13 C125 C126 -169.3(5) .
Dy3 O13 C125 C124 6.8(12) .
Dy3 O12 C123 C122 -158.4(5) .
Dy3 O12 C123 C124 19.1(13) .
Dy3 O10 C97 C98 -11.4(10) .
Dy3 O10 C97 C96 167.2(7) .
Dy3 O9 C43 C44 -21.9(8) 2_466
Dy3 O9 C43 C42 161.3(6) 2_466
Dy3 O11 C113 C114 118.9(6) .
Dy3 O11 C113 C112 -59.2(9) .
Dy3 N10 C98 C99 -171.8(6) .
Dy3 N10 C98 C97 8.3(9) .
Dy3 N10 C102 C101 171.4(6) .
Dy3 N8 C44 C43 15.1(8) 2_466
Dy3 N8 C44 C45 -164.4(6) 2_466
Dy3 N8 C48 C47 165.6(6) 2_466
Dy4 O10 C97 C98 166.4(5) 2_466
Dy4 O10 C97 C96 -15.1(14) 2_466
Dy4 O9 C43 C44 168.2(5) .
Dy4 O9 C43 C42 -8.6(12) .
Dy4 O11 C113 C114 -26.1(8) .
Dy4 O11 C113 C112 155.9(6) .
Dy4 O14 C134 C135 8.7(12) .
Dy4 O14 C134 C133 -176.6(5) .
Dy4 N12 C114 C113 13.3(8) .
Dy4 N12 C114 C115 -166.0(5) .
Dy4 N12 C118 C117 166.4(6) .
Dy4 O15 C136 C135 -19.0(12) .
Dy4 O15 C136 C137 163.3(6) .
Dy1 O3 C59 C60 -28.7(8) .
Dy1 O3 C59 C58 154.7(6) .
Dy1 O2 C27 C28 -164.2(5) .
Dy1 O2 C27 C26 17.1(12) .
Dy1 O6 C82 C83 -164.4(5) .
Dy1 O6 C82 C81 17.8(14) .
Dy1 O1 C11 C12 173.0(5) .
Dy1 O1 C11 C10 -6.9(13) .
Dy1 O7 C80 C81 -20.5(15) .
Dy1 O7 C80 C79 163.9(8) .
Dy2 O3 C59 C60 118.0(6) 2
Dy2 O3 C59 C58 -58.6(9) 2
Dy2 O2 C27 C28 9.6(9) .
Dy2 O2 C27 C26 -169.0(6) .
Dy2 O1 C11 C12 -19.3(9) .
Dy2 O1 C11 C10 160.8(6) .
Dy2 O5 C71 C70 1.4(13) .
Dy2 O5 C71 C72 -178.3(6) .
Dy2 O4 C69 C70 -24.9(12) .
Dy2 O4 C69 C68 157.3(6) .
Dy2 N4 C28 C27 -10.7(8) .
Dy2 N4 C28 C29 169.2(6) .
Dy2 N4 C32 C31 -166.3(7) .
Dy2 N2 C12 C11 18.0(8) .
Dy2 N2 C12 C13 -162.4(6) .
Dy2 N2 C2AA C15 161.9(7) .
O3 C59 C60 C61 -172.2(7) .
O3 C59 C60 N6 7.7(10) .
O3 C59 C58 C57 173.1(7) .
O2 C27 C26 C25 177.3(7) .
O10 C97 C96 C95 -178.9(9) .
O9 C43 C42 C41 179.6(7) .
O11 C113 C114 N12 7.3(10) .
O11 C113 C114 C115 -173.4(6) .
O11 C113 C112 C111 175.5(7) .
O1 C11 C12 N2 -0.5(10) .
O1 C11 C12 C13 179.9(7) .
O1 C11 C10 C9 -177.3(7) .
O5 C71 C72 C73 43.8(11) .
O5 C71 C72 C74 -73.4(10) .
O5 C71 C72 C75 166.6(9) .
O4 C69 C70 C71 2.9(14) .
O4 C69 C68 C65 56.7(10) .
O4 C69 C68 C66 -60.4(10) .
O4 C69 C68 C67 179.7(8) .
N10 C98 C97 O10 1.2(11) .
N10 C98 C97 C96 -177.4(8) .
O7 C80 C79 C76 -20.2(17) .
O7 C80 C79 C78 86.5(12) .
O7 C80 C79 C77 -169.9(14) .
N8 C44 C43 O9 3.0(10) .
N8 C44 C43 C42 180.0(7) .
N8 C44 C45 C40 176.7(7) .
N8 C44 C45 C46 -3.0(11) .
N12 C114 C115 C116 -3.4(11) .
N12 C114 C115 C110 176.0(7) .
C44 N8 C48 C47 0.3(12) .
C44 C43 C42 C41 2.8(11) .
C44 C45 C40 N7 -179.0(7) .
C44 C45 C40 C41 3.7(12) .
C44 C45 C46 C47 0.5(13) .
N7 C40 C41 C42 -178.6(7) .
N7 C39 C38 C33 -177.8(9) .
N7 C39 C38 C37 2.2(13) .
C59 C60 N6 Dy1 15.3(8) .
C59 C60 N6 C64 -178.8(7) .
N11 C110 C111 C112 -174.8(8) .
N11 C110 C115 C116 -3.4(12) .
N11 C110 C115 C114 177.3(7) .
N5 C56 C57 C58 -177.7(8) .
N5 C55 C54 C49 -9.8(14) .
N5 C55 C54 C53 174.3(9) .
C131 C133 C134 O14 -67.3(8) .
C131 C133 C134 C135 107.7(8) .
C113 C114 C115 C116 177.3(7) .
C113 C114 C115 C110 -3.3(11) .
C113 C112 C111 C110 -1.2(13) .
C43 C44 C45 C40 -2.9(11) .
C43 C44 C45 C46 177.4(7) .
C43 C42 C41 C40 -2.0(12) .
C116 C117 C118 N12 -0.4(14) .
N4 C28 C27 O2 1.7(10) .
N4 C28 C27 C26 -179.6(7) .
N4 C28 C29 C24 179.6(8) .
N4 C28 C29 C30 -0.1(12) .
C99 C98 C97 O10 -178.7(7) .
C99 C98 C97 C96 2.7(13) .
C99 C94 C95 C96 -0.1(16) .
N9 C94 C95 C96 -176.3(9) .
N9 C93 C92 C87 171.4(9) .
N9 C93 C92 C91 -11.4(14) .
C11 C12 C13 C8 -4.0(12) .
C11 C12 C13 C14 177.5(7) .
C11 C10 C9 C8 -1.6(13) .
C61 C62 C63 C64 1.3(14) .
C61 C56 C57 C58 4.0(13) .
C61 C60 N6 Dy1 -164.8(6) .
C61 C60 N6 C64 1.1(11) .
N2 C12 C13 C8 176.4(8) .
N2 C12 C13 C14 -2.1(12) .
N2 C2AA C15 C14 -1.0(15) .
C114 N12 C118 C117 -1.0(12) .
C114 C113 C112 C111 -2.6(11) .
C28 N4 C32 C31 0.8(13) .
C28 C27 C26 C25 -1.3(12) .
C28 C29 C24 N3 172.2(9) .
C28 C29 C24 C25 1.3(14) .
C28 C29 C30 C31 -1.1(14) .
C27 C28 C29 C24 -0.5(12) .
C27 C28 C29 C30 179.8(8) .
C22 C17 C18 C19 5(2) .
C29 C28 C27 O2 -178.2(7) .
C29 C28 C27 C26 0.5(11) .
C134 C135 C136 O15 -5.2(13) .
C134 C135 C136 C137 172.4(8) .
C117 C116 C115 C114 1.9(13) .
C117 C116 C115 C110 -177.5(8) .
C62 C61 C56 N5 -1.0(12) .
C62 C61 C56 C57 177.4(8) .
C62 C61 C60 C59 178.4(7) .
C62 C61 C60 N6 -1.5(11) .
C62 C63 C64 N6 -1.7(14) .
C110 N11 C109 C108 -178.4(8) .
C12 C11 C10 C9 2.8(12) .
C12 N2 C2AA C15 -0.2(13) .
C12 C13 C14 C15 0.8(13) .
C45 C44 C43 O9 -177.4(7) .
C45 C44 C43 C42 -0.4(11) .
C45 C40 C41 C42 -1.4(12) .
C45 C46 C47 C48 2.3(14) .
C112 C113 C114 N12 -174.6(7) .
C112 C113 C114 C115 4.8(11) .
C40 N7 C39 C38 177.2(7) .
C40 C45 C46 C47 -179.2(8) .
C56 N5 C55 C54 -179.5(8) .
C56 C61 C62 C63 179.9(8) .
C56 C61 C60 C59 -1.3(12) .
C56 C61 C60 N6 178.8(7) .
C56 C57 C58 C59 -0.7(13) .
C111 C110 C115 C116 178.8(8) .
C111 C110 C115 C114 -0.6(12) .
C26 C25 C24 N3 -172.6(9) .
C26 C25 C24 C29 -2.2(15) .
C98 N10 C102 C101 2.5(11) .
C98 C99 C100 C101 1.5(12) .
C98 C99 C94 N9 178.9(8) .
C98 C99 C94 C95 2.5(14) .
C98 C97 C96 C95 -0.4(15) .
C8 C13 C14 C15 -177.7(9) .
C10 C11 C12 N2 179.4(7) .
C10 C11 C12 C13 -0.1(11) .
C39 N7 C40 C45 143.8(8) .
C39 N7 C40 C41 -39.0(11) .
C39 C38 C33 C34 -179.7(9) .
C39 C38 C37 C36 178.4(10) .
C127 C126 C125 O13 -40.3(10) .
C127 C126 C125 C124 143.5(7) .
C55 N5 C56 C61 -148.1(8) .
C55 N5 C56 C57 33.6(13) .
C55 C54 C53 C52 176.7(9) .
C46 C45 C40 N7 0.7(12) .
C46 C45 C40 C41 -176.6(8) .
C46 C47 C48 N8 -2.8(14) .
C23 N3 C24 C29 164.4(11) .
C23 N3 C24 C25 -25.1(18) .
C23 C22 C17 C18 -172.1(13) .
C23 C22 C21 C20 175.6(13) .
C100 C99 C98 N10 -0.3(12) .
C100 C99 C98 C97 179.6(8) .
C100 C99 C94 N9 -4.7(13) .
C100 C99 C94 C95 178.9(9) .
C100 C101 C102 N10 -1.3(12) .
C49 C54 C53 C52 0.6(15) .
C54 C49 C50 C51 -1.6(16) .
C60 C59 C58 C57 -3.6(11) .
C60 C61 C62 C63 0.3(13) .
C60 C61 C56 N5 178.7(7) .
C60 C61 C56 C57 -2.9(12) .
C136 C135 C134 O14 10.1(13) .
C136 C135 C134 C133 -164.4(8) .
C107 C106 C105 C104 2(2) .
C107 C108 C109 N11 175.2(10) .
C107 C108 C103 C104 1.2(17) .
C38 C33 C34 C35 1.4(17) .
C38 C37 C36 C35 1.3(18) .
C13 C8 C9 C10 -2.5(13) .
C13 C8 N1 C7 157.5(10) .
C13 C14 C15 C2AA 0.7(15) .
C52 C51 C50 C49 -0.6(17) .
C97 C96 C95 C94 -0.9(17) .
C130 C133 C134 O14 51.2(9) .
C130 C133 C134 C135 -133.9(8) .
C81 C80 C79 C76 164.0(11) .
C81 C80 C79 C78 -89.2(12) .
C81 C80 C79 C77 14.4(19) .
C115 C116 C117 C118 -0.1(14) .
C115 C110 C111 C112 2.8(12) .
C63 C64 N6 Dy1 164.1(6) .
C63 C64 N6 C60 0.5(12) .
C87 C92 C91 C90 -0.4(16) .
C94 C99 C98 N10 176.3(8) .
C94 C99 C98 C97 -3.8(12) .
C94 C99 C100 C101 -175.0(8) .
C94 N9 C93 C92 177.4(8) .
C80 C81 C82 O6 -1.4(16) .
C80 C81 C82 C83 -179.1(9) .
C69 C70 C71 O5 8.8(14) .
C69 C70 C71 C72 -171.5(8) .
C125 C124 C123 O12 -1.0(14) .
C125 C124 C123 C122 176.3(7) .
C53 C52 C51 C50 2.7(17) .
C24 N3 C23 C22 -178.1(11) .
C24 C29 C30 C31 179.1(10) .
C24 C25 C26 C27 2.3(14) .
C102 N10 C98 C99 -1.6(11) .
C102 N10 C98 C97 178.4(7) .
C102 C101 C100 C99 -0.8(12) .
C9 C8 C13 C12 5.2(13) .
C9 C8 C13 C14 -176.4(8) .
C9 C8 N1 C7 -24.5(16) .
C58 C59 C60 C61 4.5(11) .
C58 C59 C60 N6 -175.5(7) .
C2AA N2 C12 C11 -177.8(7) .
C2AA N2 C12 C13 1.8(11) .
C120 C122 C123 O12 64.5(10) .
C120 C122 C123 C124 -113.1(9) .
C70 C69 C68 C65 -121.2(8) .
C70 C69 C68 C66 121.7(8) .
C70 C69 C68 C67 1.8(12) .
C70 C71 C72 C73 -135.9(9) .
C70 C71 C72 C74 106.9(10) .
C70 C71 C72 C75 -13.1(14) .
C109 N11 C110 C111 -36.6(13) .
C109 N11 C110 C115 145.8(9) .
C109 C108 C107 C106 -174.3(11) .
C109 C108 C103 C104 178.5(10) .
C33 C38 C37 C36 -1.6(15) .
C33 C34 C35 C36 -1.7(18) .
C93 N9 C94 C99 144.6(9) .
C93 N9 C94 C95 -39.3(14) .
C93 C92 C91 C90 -177.6(9) .
C92 C87 C88 C89 -2.1(18) .
C51 C52 C53 C54 -2.8(16) .
C32 N4 C28 C27 -179.6(7) .
C32 N4 C28 C29 0.3(11) .
C32 C31 C30 C29 2.1(15) .
C90 C89 C88 C87 0.9(18) .
C91 C90 C89 C88 0.5(18) .
C7 C6 C1 C2 -179.6(12) .
C7 C6 C5 C4 -175.6(15) .
N1 C8 C13 C12 -176.6(8) .
N1 C8 C13 C14 1.7(13) .
N1 C8 C9 C10 179.5(9) .
N1 C7 C6 C1 4.3(18) .
N1 C7 C6 C5 175.8(13) .
C123 C124 C125 O13 -11.6(13) .
C123 C124 C125 C126 164.3(8) .
C6 C7 N1 C8 176.3(9) .
C6 C1 C2 C3 -5(2) .
C6 C5 C4 C3 -5(3) .
C121 C122 C123 O12 -53.3(10) .
C121 C122 C123 C124 129.2(8) .
C84 C83 C82 O6 173.5(8) .
C84 C83 C82 C81 -8.6(12) .
C132 C133 C134 O14 171.9(7) .
C132 C133 C134 C135 -13.1(11) .
C30 C29 C24 N3 -8.0(14) .
C30 C29 C24 C25 -178.9(9) .
C30 C31 C32 N4 -2.1(15) .
C37 C38 C33 C34 0.2(15) .
C89 C90 C91 C92 -0.8(17) .
C88 C87 C92 C93 179.1(10) .
C88 C87 C92 C91 1.8(16) .
C118 N12 C114 C113 -177.7(7) .
C118 N12 C114 C115 3.0(11) .
C85 C83 C82 O6 -64.3(10) .
C85 C83 C82 C81 113.6(9) .
C68 C69 C70 C71 -179.4(9) .
C139 C137 C136 O15 82.4(10) .
C139 C137 C136 C135 -95.3(10) .
C103 C108 C107 C106 3.1(18) .
C103 C108 C109 N11 -2.1(14) .
C103 C104 C105 C106 2(2) .
C82 C81 C80 O7 2.2(16) .
C82 C81 C80 C79 177.8(10) .
C105 C106 C107 C108 -5(2) .
C105 C104 C103 C108 -3.7(19) .
C34 C35 C36 C37 0(2) .
C86 C83 C82 O6 53.1(10) .
C86 C83 C82 C81 -129.0(9) .
C1 C6 C5 C4 -4(2) .
C1 C2 C3 C4 -4(3) .
C5 C6 C1 C2 9(2) .
C2 C3 C4 C5 9(3) .
C48 N8 C44 C43 -177.8(7) .
C48 N8 C44 C45 2.6(11) .
C140 C137 C136 O15 -35.6(11) .
C140 C137 C136 C135 146.7(9) .
C20 C19 C18 C17 2(3) .
C138 C137 C136 O15 -163.6(9) .
C138 C137 C136 C135 18.7(13) .
C17 C22 C23 N3 -36(2) .
C17 C22 C21 C20 23(2) .
C21 C22 C23 N3 171.9(14) .
C21 C22 C17 C18 -16(2) .
C21 C20 C19 C18 3(3) .
C19 C20 C21 C22 -18(3) .
C129 C126 C125 O13 -162.1(8) .
C129 C126 C125 C124 21.7(11) .
C50 C49 C54 C55 -174.3(9) .
C50 C49 C54 C53 1.5(15) .
C128 C126 C125 O13 77.6(9) .
C128 C126 C125 C124 -98.6(9) .
C119 C122 C123 O12 -174.6(9) .
C119 C122 C123 C124 7.8(12) .
