# Electronic Supplementary Material (ESI) for Dalton Transactions.
# This journal is © The Royal Society of Chemistry 2024

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
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data_p60302_sq
_database_code_depnum_ccdc_archive 'CCDC 2306455'
loop_
_audit_author_name
_audit_author_address
'Christopher Anson'
;Karlsruhe Institute of Technology (KIT)
Germany
;
_audit_update_record             
;
2023-11-08 deposited with the CCDC.	2023-12-19 downloaded from the CCDC.
;
_audit_creation_date             2023-11-06
_audit_creation_method           
;
Olex2 1.5
(compiled 2023.08.24 svn.re1ec1418 for OlexSys, GUI svn.r6817)
;
_shelx_SHELXL_version_number     2019/3
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         
'C120 H252 Dy12 Fe8 N32 O96, 8(C2 H3 N), 6(C H4 O)'
_chemical_formula_sum            'C142 H300 Dy12 Fe8 N40 O102'
_chemical_formula_weight         6597.00
_chemical_melting_point          ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0043 0.0021 '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 5.3962 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Fe Fe 0.3563 1.0498 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0082 0.0043 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0142 0.0079 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_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.
;
_space_group_crystal_system      tetragonal
_space_group_IT_number           142
_space_group_name_H-M_alt        'I 41/a c d'
_space_group_name_Hall           '-I 4bd 2c'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, -y, z+1/2'
'-y+1/4, x+3/4, z+1/4'
'y+1/4, -x+1/4, z+3/4'
'-x+1/2, y, -z'
'x, -y, -z+1/2'
'y+1/4, x+3/4, -z+3/4'
'-y+1/4, -x+1/4, -z+1/4'
'x+1/2, y+1/2, z+1/2'
'-x+1, -y+1/2, z+1'
'-y+3/4, x+5/4, z+3/4'
'y+3/4, -x+3/4, z+5/4'
'-x+1, y+1/2, -z+1/2'
'x+1/2, -y+1/2, -z+1'
'y+3/4, x+5/4, -z+5/4'
'-y+3/4, -x+3/4, -z+3/4'
'-x, -y, -z'
'x-1/2, y, -z-1/2'
'y-1/4, -x-3/4, -z-1/4'
'-y-1/4, x-1/4, -z-3/4'
'x-1/2, -y, z'
'-x, y, z-1/2'
'-y-1/4, -x-3/4, z-3/4'
'y-1/4, x-1/4, z-1/4'
'-x+1/2, -y+1/2, -z+1/2'
'x, y+1/2, -z'
'y+1/4, -x-1/4, -z+1/4'
'-y+1/4, x+1/4, -z-1/4'
'x, -y+1/2, z+1/2'
'-x+1/2, y+1/2, z'
'-y+1/4, -x-1/4, z-1/4'
'y+1/4, x+1/4, z+1/4'

_cell_length_a                   37.7905(13)
_cell_length_b                   37.7905(13)
_cell_length_c                   61.582(2)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_volume                     87947(7)
_cell_formula_units_Z            16
_cell_measurement_reflns_used    9236
_cell_measurement_temperature    150(2)
_cell_measurement_theta_max      31.502
_cell_measurement_theta_min      2.678
_shelx_estimated_absorpt_T_max   0.786
_shelx_estimated_absorpt_T_min   0.666
_exptl_absorpt_coefficient_mu    6.326
_exptl_absorpt_correction_T_max  0.7463
_exptl_absorpt_correction_T_min  0.6221
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'Apex2 (Bruker AXS Inc., 2005)'
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            'pale yellow'
_exptl_crystal_density_diffrn    1.993
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       block
_exptl_crystal_F_000             51968
_exptl_crystal_size_max          0.07
_exptl_crystal_size_mid          0.05
_exptl_crystal_size_min          0.04
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0369
_diffrn_reflns_av_unetI/netI     0.0257
_diffrn_reflns_Laue_measured_fraction_full 0.984
_diffrn_reflns_Laue_measured_fraction_max 0.980
_diffrn_reflns_limit_h_max       29
_diffrn_reflns_limit_h_min       -47
_diffrn_reflns_limit_k_max       47
_diffrn_reflns_limit_k_min       -43
_diffrn_reflns_limit_l_max       74
_diffrn_reflns_limit_l_min       -33
_diffrn_reflns_number            139306
_diffrn_reflns_point_group_measured_fraction_full 0.984
_diffrn_reflns_point_group_measured_fraction_max 0.980
_diffrn_reflns_theta_full        28.663
_diffrn_reflns_theta_max         30.395
_diffrn_reflns_theta_min         1.756
_diffrn_ambient_temperature      150(2)
_diffrn_detector_area_resol_mean 8.333
_diffrn_measured_fraction_theta_full 0.984
_diffrn_measured_fraction_theta_max 0.980
_diffrn_measurement_device_type  'Bruker SMART Apex'
_diffrn_measurement_method       'CCD area detector, ω-scans'
_diffrn_radiation_type           synchrotron
_diffrn_source                   synchrotron
_diffrn_radiation_monochromator  silicon
_diffrn_radiation_wavelength     0.79942
_reflns_number_gt                18273
_reflns_number_total             22903
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 Structure factors included contributions from the .fab file.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'Apex2 (Bruker AXS Inc., 2005)'
_computing_data_collection       'Apex2 (Bruker AXS Inc., 2005)'
_computing_data_reduction        'Apex2 (Bruker AXS Inc., 2005)'
_computing_molecular_graphics    'Diamond 2.1 (Crystal Impact, 1998)'
_computing_publication_material  'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL 2019/3 (Sheldrick, 2015)'
_computing_structure_solution    'SHELXT (Sheldrick, 2015)'
_refine_diff_density_max         4.352
_refine_diff_density_min         -2.649
_refine_diff_density_rms         0.227
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.576
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1298
_refine_ls_number_reflns         22903
_refine_ls_number_restraints     43
_refine_ls_R_factor_all          0.0766
_refine_ls_R_factor_gt           0.0575
_refine_ls_restrained_S_all      1.576
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0970P)²+87.4253P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1763
_refine_ls_wR_factor_ref         0.1996
_refine_special_details          
;One ligand had the three methylene groups adjacent to the N disordered 
by rotation about the Dy-N bond. The disordered C atoms were modelled
as pairs of 50% occupancy isotropic atoms, with geometrical similarity
restraints.
O-H distances were restrained to 0.88(4) Ang.
Four MeCN and two MeOH lattice solvents molecules per cluster could be
refined anisotropically. The remaining lattice solvent was badly
disordered and could not be modelled satisfactorily. The contributions
of these molecules to the structure factors was calculated using
SQUEEZE (Spek, A.L., Acta Cryst., 2015, C71, 9-18), as implemented in 
PLATON (Spek, A.L., Acta Cryst., 2009, D65, 148-155). This solvent 
was arbitrarily assigned as an equal mixture of MeCN and MeOH, and
amounted to a further 4 MeCN and 4 MeOH per cluster molecule. The
The formula at the top of the cif includes these solvent molecules.,SQUEEZE
;
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H,H) groups, H12 of O12, H9 of O9, H18 of O18, H24 of O24, H27 of O27,
   H3 of O3, All C(H,H,H,H) groups
 At 1.5 times of:
  All C(H,H,H) groups, H81 of O81
2. Restrained distances
 O3-H3 = O9-H9 = O18-H18 = O24-H24
 0.96 with sigma of 0.04
 O12-H12 = O27-H27
 0.88 with sigma of 0.04
 H3-O30_$1 = H9-O6 = H18-O15 = H24-O21
 1.6 with sigma of 0.04
 H12-O43_$2 = H27-O44
 2.08 with sigma of 0.04
 H81C-O34
 2.68 with sigma of 0.04
 N6-C31A \\sim N6-C31B \\sim N6-C33A \\sim N6-C33B \\sim N6-C35A \\sim N6-C35B
 with sigma of 0.02
 C31A-C32 \\sim C31B-C32 \\sim C33A-C34 \\sim C33B-C34 \\sim C35A-C36 \\sim
C35B-C36
 with sigma of 0.02
3. Others
 Fixed Sof: C31A(0.5) H31A(0.5) H31B(0.5) C31B(0.5) H31C(0.5) H31D(0.5)
 H32A(0.5) H32B(0.5) H32C(0.5) H32D(0.5) C33A(0.5) H33A(0.5) H33B(0.5)
 C33B(0.5) H33C(0.5) H33D(0.5) H34A(0.5) H34B(0.5) H34C(0.5) H34D(0.5)
 C35A(0.5) H35A(0.5) H35B(0.5) C35B(0.5) H35C(0.5) H35D(0.5) H36A(0.5)
 H36B(0.5) H36C(0.5) H36D(0.5)
4.a Secondary CH2 refined with riding coordinates:
 C1(H1A,H1B), C2(H2A,H2B), C3(H3A,H3B), C4(H4A,H4B), C5(H5A,H5B), C6(H6A,H6B),
 C7(H7A,H7B), C8(H8A,H8B), C9(H9A,H9B), C10(H10A,H10B), C11(H11A,H11B),
 C12(H12A,H12B), C13(H13A,H13B), C14(H14A,H14B), C15(H15A,H15B), C16(H16A,H16B),
  C17(H17A,H17B), C18(H18A,H18B), C19(H19A,H19B), C20(H20A,H20B), C21(H21A,
 H21B), C22(H22A,H22B), C23(H23A,H23B), C24(H24A,H24B), C25(H25A,H25B),
 C26(H26A,H26B), C27(H27A,H27B), C28(H28A,H28B), C29(H29A,H29B), C30(H30A,H30B),
  C31A(H31A,H31B), C31B(H31C,H31D), C32(H32A,H32B), C32(H32C,H32D), C33A(H33A,
 H33B), C33B(H33C,H33D), C34(H34A,H34B), C34(H34C,H34D), C35A(H35A,H35B),
 C35B(H35C,H35D), C36(H36A,H36B), C36(H36C,H36D), C37(H37A,H37B), C38(H38A,
 H38B), C39(H39A,H39B), C40(H40A,H40B), C41(H41A,H41B), C42(H42A,H42B),
 C43(H43A,H43B), C44(H44A,H44B), C45(H45A,H45B), C46(H46A,H46B), C47(H47A,H47B),
  C48(H48A,H48B), C49(H49A,H49B), C50(H50A,H50B), C51(H51A,H51B), C52(H52A,
 H52B), C53(H53A,H53B), C54(H54A,H54B), C55(H55A,H55B), C56(H56A,H56B),
 C57(H57A,H57B), C58(H58A,H58B), C59(H59A,H59B), C60(H60A,H60B)
4.b Idealised Me refined as rotating group:
 C72(H72A,H72B,H72C), C74(H74A,H74B,H74C), C81(H81A,H81B,H81C)
4.c Idealised tetrahedral OH refined as rotating group:
 O81(H81)
;
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     'intrinsic phasing'
_atom_sites_solution_secondary   difmap
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Dy1 Dy 0.51734(2) 0.38309(2) 0.33653(2) 0.04470(13) Uani 1 1 d . . . . .
Dy2 Dy 0.54253(2) 0.54233(2) 0.36977(2) 0.03593(11) Uani 1 1 d . . . . .
Dy3 Dy 0.47226(2) 0.55666(2) 0.41175(2) 0.03256(11) Uani 1 1 d . . . . .
Dy4 Dy 0.34494(2) 0.46238(2) 0.44246(2) 0.03303(11) Uani 1 1 d . . . . .
Dy5 Dy 0.37140(2) 0.37710(2) 0.53002(2) 0.03210(11) Uani 1 1 d . . . . .
Dy6 Dy 0.37651(2) 0.28421(2) 0.50914(2) 0.04298(13) Uani 1 1 d . . . . .
Fe1 Fe 0.54247(3) 0.47059(4) 0.33614(2) 0.0413(3) Uani 1 1 d . . . . .
Fe2 Fe 0.39787(3) 0.50325(3) 0.40603(2) 0.0325(2) Uani 1 1 d . . . . .
Fe3 Fe 0.37189(3) 0.44838(3) 0.49564(2) 0.0334(3) Uani 1 1 d . . . . .
Fe4 Fe 0.40269(3) 0.27708(4) 0.45580(2) 0.0408(3) Uani 1 1 d . . . . .
N1 N 0.5774(3) 0.3555(3) 0.32562(15) 0.064(3) Uani 1 1 d . . . . .
C1 C 0.5831(3) 0.3656(4) 0.30258(18) 0.072(4) Uani 1 1 d . . . . .
H1A H 0.604029 0.352986 0.296805 0.087 Uiso 1 1 calc R U . . .
H1B H 0.587640 0.391331 0.301605 0.087 Uiso 1 1 calc R U . . .
C2 C 0.5509(3) 0.3563(3) 0.28919(18) 0.060(3) Uani 1 1 d . . . . .
H2A H 0.553045 0.366729 0.274512 0.072 Uiso 1 1 calc R U . . .
H2B H 0.549131 0.330253 0.287616 0.072 Uiso 1 1 calc R U . . .
O1 O 0.51939(16) 0.36970(17) 0.29973(10) 0.0446(15) Uani 1 1 d . . . . .
C3 C 0.6042(3) 0.3727(4) 0.3393(2) 0.083(5) Uani 1 1 d . . . . .
H3A H 0.628107 0.366670 0.333816 0.099 Uiso 1 1 calc R U . . .
H3B H 0.602292 0.363552 0.354355 0.099 Uiso 1 1 calc R U . . .
C4 C 0.5998(3) 0.4120(4) 0.3395(2) 0.075(4) Uani 1 1 d . . . . .
H4A H 0.610432 0.421789 0.352894 0.090 Uiso 1 1 calc R U . . .
H4B H 0.612513 0.422291 0.326919 0.090 Uiso 1 1 calc R U . . .
O2 O 0.56332(17) 0.42182(18) 0.33845(12) 0.0522(17) Uani 1 1 d . . . . .
C5 C 0.5776(4) 0.3170(4) 0.3280(2) 0.092(5) Uani 1 1 d . . . . .
H5A H 0.572055 0.305879 0.313890 0.111 Uiso 1 1 calc R U . . .
H5B H 0.601540 0.309173 0.332469 0.111 Uiso 1 1 calc R U . . .
C6 C 0.5521(4) 0.3056(3) 0.3440(2) 0.077(4) Uani 1 1 d . . . . .
H6A H 0.560802 0.312278 0.358643 0.092 Uiso 1 1 calc R U . . .
H6B H 0.550368 0.279468 0.343568 0.092 Uiso 1 1 calc R U . . .
O3 O 0.5168(3) 0.3205(2) 0.34099(12) 0.071(2) Uani 1 1 d D . . . .
H3 H 0.508(3) 0.312(3) 0.3270(11) 0.085 Uiso 1 1 d D U . . .
N2 N 0.5299(3) 0.4829(3) 0.30157(13) 0.059(2) Uani 1 1 d . . . . .
C7 C 0.4998(4) 0.4605(3) 0.29539(18) 0.073(4) Uani 1 1 d . . . . .
H7A H 0.508627 0.438126 0.289020 0.088 Uiso 1 1 calc R U . . .
H7B H 0.485437 0.472762 0.284236 0.088 Uiso 1 1 calc R U . . .
C8 C 0.4773(3) 0.4525(3) 0.31453(19) 0.061(3) Uani 1 1 d . . . . .
H8A H 0.464168 0.473938 0.318998 0.073 Uiso 1 1 calc R U . . .
H8B H 0.459975 0.433818 0.310830 0.073 Uiso 1 1 calc R U . . .
O4 O 0.49944(16) 0.44086(16) 0.33177(10) 0.0443(14) Uani 1 1 d . . . . .
C9 C 0.5235(3) 0.5221(3) 0.29998(18) 0.063(3) Uani 1 1 d . . . . .
H9A H 0.509219 0.527370 0.286909 0.075 Uiso 1 1 calc R U . . .
H9B H 0.546393 0.534653 0.298684 0.075 Uiso 1 1 calc R U . . .
C10 C 0.5040(3) 0.5345(3) 0.32029(16) 0.051(2) Uani 1 1 d . . . . .
H10A H 0.505220 0.560625 0.321363 0.062 Uiso 1 1 calc R U . . .
H10B H 0.478775 0.527557 0.319426 0.062 Uiso 1 1 calc R U . . .
O5 O 0.51979(17) 0.51900(17) 0.33884(9) 0.0420(14) Uani 1 1 d . . . . .
C11 C 0.5638(4) 0.4745(5) 0.2903(2) 0.089(5) Uani 1 1 d . . . . .
H11A H 0.563482 0.484481 0.275399 0.107 Uiso 1 1 calc R U . . .
H11B H 0.566736 0.448540 0.289127 0.107 Uiso 1 1 calc R U . . .
C12 C 0.5953(4) 0.4907(5) 0.3034(2) 0.083(4) Uani 1 1 d . . . . .
H12A H 0.617310 0.477703 0.299906 0.100 Uiso 1 1 calc R U . . .
H12B H 0.598584 0.515734 0.299166 0.100 Uiso 1 1 calc R U . . .
O6 O 0.58889(19) 0.4887(2) 0.32532(12) 0.0616(19) Uani 1 1 d D . . . .
N3 N 0.59717(19) 0.5207(2) 0.39146(13) 0.0485(19) Uani 1 1 d . . . . .
C13 C 0.6013(2) 0.4822(3) 0.38940(17) 0.051(2) Uani 1 1 d . . . . .
H13A H 0.610687 0.472599 0.403181 0.061 Uiso 1 1 calc R U . . .
H13B H 0.618620 0.477047 0.377795 0.061 Uiso 1 1 calc R U . . .
C14 C 0.5659(2) 0.4637(3) 0.38402(15) 0.047(2) Uani 1 1 d . . . . .
H14A H 0.570593 0.438988 0.379515 0.057 Uiso 1 1 calc R U . . .
H14B H 0.550793 0.463127 0.397134 0.057 Uiso 1 1 calc R U . . .
O7 O 0.54798(15) 0.48194(16) 0.36701(9) 0.0396(13) Uani 1 1 d . . . . .
C15 C 0.5907(2) 0.5331(3) 0.41409(15) 0.049(2) Uani 1 1 d . . . . .
H15A H 0.593741 0.559048 0.414816 0.059 Uiso 1 1 calc R U . . .
H15B H 0.608156 0.522067 0.423975 0.059 Uiso 1 1 calc R U . . .
C16 C 0.5533(2) 0.5233(3) 0.42145(15) 0.044(2) Uani 1 1 d . . . . .
H16A H 0.551669 0.497400 0.423459 0.053 Uiso 1 1 calc R U . . .
H16B H 0.548307 0.534751 0.435596 0.053 Uiso 1 1 calc R U . . .
O8 O 0.52754(14) 0.53451(15) 0.40583(9) 0.0339(12) Uani 1 1 d . . . . .
C17 C 0.6282(2) 0.5402(3) 0.38273(18) 0.058(3) Uani 1 1 d . . . . .
H17A H 0.650068 0.530744 0.389457 0.069 Uiso 1 1 calc R U . . .
H17B H 0.626262 0.565495 0.386802 0.069 Uiso 1 1 calc R U . . .
C18 C 0.6313(3) 0.5373(3) 0.3577(2) 0.060(3) Uani 1 1 d . . . . .
H18A H 0.647832 0.555488 0.352123 0.073 Uiso 1 1 calc R U . . .
H18B H 0.640736 0.513694 0.353660 0.073 Uiso 1 1 calc R U . . .
O9 O 0.59722(18) 0.5421(2) 0.34827(11) 0.0544(17) Uani 1 1 d D . . . .
H9 H 0.593(3) 0.5273(15) 0.3356(11) 0.065 Uiso 1 1 d D U . . .
N4 N 0.4472(2) 0.6167(2) 0.39909(15) 0.049(2) Uani 1 1 d . . . . .
C19 C 0.4562(2) 0.6207(3) 0.37497(17) 0.048(2) Uani 1 1 d . . . . .
H19A H 0.476943 0.636567 0.373485 0.058 Uiso 1 1 calc R U . . .
H19B H 0.436030 0.632014 0.367444 0.058 Uiso 1 1 calc R U . . .
C20 C 0.4642(2) 0.5868(3) 0.36436(15) 0.047(2) Uani 1 1 d . . . . .
H20A H 0.441786 0.573737 0.361980 0.056 Uiso 1 1 calc R U . . .
H20B H 0.474873 0.591462 0.349968 0.056 Uiso 1 1 calc R U . . .
O10 O 0.48785(15) 0.56503(16) 0.37683(9) 0.0385(13) Uani 1 1 d . . . . .
C21 C 0.4078(2) 0.6141(3) 0.4016(2) 0.057(3) Uani 1 1 d . . . . .
H21A H 0.401751 0.615473 0.417217 0.068 Uiso 1 1 calc R U . . .
H21B H 0.396595 0.634542 0.394251 0.068 Uiso 1 1 calc R U . . .
C22 C 0.3928(2) 0.5809(3) 0.39249(17) 0.049(2) Uani 1 1 d . . . . .
H22A H 0.368164 0.577723 0.397508 0.058 Uiso 1 1 calc R U . . .
H22B H 0.392808 0.582007 0.376424 0.058 Uiso 1 1 calc R U . . .
O11 O 0.41413(15) 0.55227(15) 0.39966(10) 0.0382(13) Uani 1 1 d . . . . .
C23 C 0.4608(3) 0.6456(3) 0.41232(19) 0.052(2) Uani 1 1 d . . . . .
H23A H 0.449331 0.644935 0.426778 0.063 Uiso 1 1 calc R U . . .
H23B H 0.454814 0.668435 0.405392 0.063 Uiso 1 1 calc R U . . .
C24 C 0.5008(3) 0.6429(2) 0.41508(18) 0.049(2) Uani 1 1 d . . . . .
H24A H 0.512784 0.646721 0.400979 0.059 Uiso 1 1 calc R U . . .
H24B H 0.509260 0.661046 0.425453 0.059 Uiso 1 1 calc R U . . .
O12 O 0.50840(16) 0.60855(16) 0.42307(11) 0.0433(14) Uani 1 1 d D . . . .
H12 H 0.5320(11) 0.614(3) 0.4239(13) 0.052 Uiso 1 1 d D U . . .
N5 N 0.4128(2) 0.4746(2) 0.37642(12) 0.0432(17) Uani 1 1 d . . . . .
C25 C 0.4523(2) 0.4770(3) 0.37498(16) 0.047(2) Uani 1 1 d . . . . .
H25A H 0.459498 0.499974 0.368696 0.056 Uiso 1 1 calc R U . . .
H25B H 0.461723 0.457766 0.365679 0.056 Uiso 1 1 calc R U . . .
C26 C 0.4664(2) 0.4733(2) 0.39822(16) 0.043(2) Uani 1 1 d . . . . .
H26A H 0.460863 0.449411 0.403881 0.051 Uiso 1 1 calc R U . . .
H26B H 0.492458 0.476220 0.398249 0.051 Uiso 1 1 calc R U . . .
O13 O 0.45082(14) 0.49914(14) 0.41159(9) 0.0335(12) Uani 1 1 d . . . . .
C27 C 0.4002(3) 0.4378(3) 0.37803(16) 0.057(3) Uani 1 1 d . . . . .
H27A H 0.385521 0.432505 0.365126 0.068 Uiso 1 1 calc R U . . .
H27B H 0.420940 0.421815 0.377675 0.068 Uiso 1 1 calc R U . . .
C28 C 0.3797(5) 0.4302(3) 0.39737(19) 0.086(5) Uani 1 1 d . . . . .
H28A H 0.354351 0.430022 0.393341 0.103 Uiso 1 1 calc R U . . .
H28B H 0.385843 0.406040 0.402344 0.103 Uiso 1 1 calc R U . . .
O14 O 0.38409(15) 0.45311(15) 0.41461(8) 0.0340(12) Uani 1 1 d . . . . .
C29 C 0.3941(3) 0.4942(3) 0.35873(15) 0.052(2) Uani 1 1 d . . . . .
H29A H 0.395358 0.480704 0.344972 0.063 Uiso 1 1 calc R U . . .
H29B H 0.405273 0.517602 0.356421 0.063 Uiso 1 1 calc R U . . .
C30 C 0.3554(3) 0.4988(4) 0.36575(17) 0.067(3) Uani 1 1 d . . . . .
H30A H 0.343971 0.517152 0.356671 0.080 Uiso 1 1 calc R U . . .
H30B H 0.342470 0.476299 0.363653 0.080 Uiso 1 1 calc R U . . .
O15 O 0.35384(16) 0.50914(18) 0.38837(9) 0.0456(15) Uani 1 1 d D . . . .
N6 N 0.30539(19) 0.5166(2) 0.44852(12) 0.050(2) Uani 1 1 d D . . . .
C31A C 0.3304(4) 0.5471(5) 0.4545(3) 0.059(5) Uiso 0.5 1 d D . P A 1
H31A H 0.317886 0.569934 0.452727 0.070 Uiso 0.5 1 calc R U P A 1
H31B H 0.337648 0.544831 0.469851 0.070 Uiso 0.5 1 calc R U P A 1
C31B C 0.3230(4) 0.5481(4) 0.4377(3) 0.044(4) Uiso 0.5 1 d D . P A 2
H31C H 0.317549 0.548062 0.422027 0.052 Uiso 0.5 1 calc R U P A 2
H31D H 0.313722 0.570279 0.444078 0.052 Uiso 0.5 1 calc R U P A 2
C32 C 0.3611(3) 0.5466(3) 0.44081(18) 0.055(3) Uani 1 1 d D . . . .
H32A H 0.355338 0.559745 0.427386 0.066 Uiso 0.5 1 calc R U P A 1
H32B H 0.380045 0.559900 0.448333 0.066 Uiso 0.5 1 calc R U P A 1
H32C H 0.372440 0.565459 0.432116 0.066 Uiso 0.5 1 calc R U P A 2
H32D H 0.366688 0.550970 0.456287 0.066 Uiso 0.5 1 calc R U P A 2
O16 O 0.37543(14) 0.51315(16) 0.43455(9) 0.0366(13) Uani 1 1 d . . . . .
C33A C 0.2843(4) 0.5091(5) 0.4688(2) 0.046(4) Uiso 0.5 1 d D . P A 1
H33A H 0.274686 0.531711 0.474477 0.055 Uiso 0.5 1 calc R U P A 1
H33B H 0.263922 0.493837 0.464982 0.055 Uiso 0.5 1 calc R U P A 1
C33B C 0.2982(5) 0.5228(4) 0.4722(2) 0.045(4) Uiso 0.5 1 d D . P A 2
H33C H 0.313430 0.542422 0.477279 0.053 Uiso 0.5 1 calc R U P A 2
H33D H 0.273296 0.530282 0.473892 0.053 Uiso 0.5 1 calc R U P A 2
C34 C 0.3045(3) 0.4921(3) 0.48574(18) 0.058(3) Uani 1 1 d D . . . .
H34A H 0.312733 0.510475 0.496027 0.070 Uiso 0.5 1 calc R U P A 1
H34B H 0.288600 0.475976 0.493825 0.070 Uiso 0.5 1 calc R U P A 1
H34C H 0.308459 0.499909 0.500889 0.070 Uiso 0.5 1 calc R U P A 2
H34D H 0.283266 0.476740 0.485548 0.070 Uiso 0.5 1 calc R U P A 2
O17 O 0.33397(16) 0.47271(17) 0.47854(9) 0.0411(14) Uani 1 1 d . . . . .
C35A C 0.2824(7) 0.5266(5) 0.4293(3) 0.077(7) Uiso 0.5 1 d D . P A 1
H35A H 0.259092 0.534825 0.434531 0.092 Uiso 0.5 1 calc R U P A 1
H35B H 0.293664 0.546378 0.421269 0.092 Uiso 0.5 1 calc R U P A 1
C35B C 0.2718(4) 0.5073(5) 0.4363(2) 0.043(4) Uiso 0.5 1 d D . P A 2
H35C H 0.259657 0.487880 0.444110 0.052 Uiso 0.5 1 calc R U P A 2
H35D H 0.255914 0.528063 0.436374 0.052 Uiso 0.5 1 calc R U P A 2
C36 C 0.2774(3) 0.4966(3) 0.41447(17) 0.062(3) Uani 1 1 d D . . . .
H36A H 0.258640 0.481040 0.420346 0.074 Uiso 0.5 1 calc R U P A 1
H36B H 0.269276 0.505601 0.400218 0.074 Uiso 0.5 1 calc R U P A 1
H36C H 0.278591 0.517974 0.405187 0.074 Uiso 0.5 1 calc R U P A 2
H36D H 0.256864 0.482401 0.409631 0.074 Uiso 0.5 1 calc R U P A 2
O18 O 0.30934(17) 0.4761(2) 0.41140(10) 0.0488(16) Uani 1 1 d D . . . .
H18 H 0.3189(17) 0.492(2) 0.4005(14) 0.059 Uiso 1 1 d D U . . .
N7 N 0.42108(19) 0.48157(19) 0.49656(12) 0.0398(16) Uani 1 1 d . . . . .
C37 C 0.4341(2) 0.4843(2) 0.47350(15) 0.043(2) Uani 1 1 d . . . . .
H37A H 0.459959 0.488363 0.473398 0.051 Uiso 1 1 calc R U . . .
H37B H 0.422505 0.504507 0.466159 0.051 Uiso 1 1 calc R U . . .
C38 C 0.4255(2) 0.4499(2) 0.46143(14) 0.0358(18) Uani 1 1 d . . . . .
H38A H 0.429907 0.452853 0.445686 0.043 Uiso 1 1 calc R U . . .
H38B H 0.440599 0.430431 0.466850 0.043 Uiso 1 1 calc R U . . .
O19 O 0.38918(14) 0.44182(15) 0.46510(9) 0.0335(12) Uani 1 1 d . . . . .
C39 C 0.4473(3) 0.4641(3) 0.51139(18) 0.055(3) Uani 1 1 d . . . . .
H39A H 0.444794 0.474189 0.526141 0.066 Uiso 1 1 calc R U . . .
H39B H 0.471522 0.469399 0.506219 0.066 Uiso 1 1 calc R U . . .
C40 C 0.4427(2) 0.4248(3) 0.51264(17) 0.048(2) Uani 1 1 d . . . . .
H40A H 0.455538 0.413463 0.500461 0.058 Uiso 1 1 calc R U . . .
H40B H 0.453044 0.415946 0.526392 0.058 Uiso 1 1 calc R U . . .
O20 O 0.40615(15) 0.41539(15) 0.51166(9) 0.0365(12) Uani 1 1 d . . . . .
C41 C 0.4085(3) 0.5149(3) 0.50543(16) 0.053(2) Uani 1 1 d . . . . .
H41A H 0.395081 0.527975 0.494194 0.064 Uiso 1 1 calc R U . . .
H41B H 0.428930 0.529660 0.509866 0.064 Uiso 1 1 calc R U . . .
C42 C 0.3852(4) 0.5081(3) 0.52470(18) 0.067(3) Uani 1 1 d . . . . .
H42A H 0.400118 0.503669 0.537616 0.080 Uiso 1 1 calc R U . . .
H42B H 0.370665 0.529378 0.527610 0.080 Uiso 1 1 calc R U . . .
O21 O 0.36274(18) 0.47900(18) 0.52141(10) 0.0493(16) Uani 1 1 d D . . . .
N8 N 0.30506(18) 0.3826(2) 0.54003(11) 0.0390(16) Uani 1 1 d . . . . .
C43 C 0.2860(2) 0.4025(3) 0.52272(14) 0.044(2) Uani 1 1 d . . . . .
H43A H 0.283408 0.427446 0.527353 0.053 Uiso 1 1 calc R U . . .
H43B H 0.262004 0.392435 0.521025 0.053 Uiso 1 1 calc R U . . .
C44 C 0.3049(2) 0.4016(3) 0.50058(14) 0.041(2) Uani 1 1 d . . . . .
H44A H 0.301189 0.378254 0.493627 0.049 Uiso 1 1 calc R U . . .
H44B H 0.294894 0.419997 0.490949 0.049 Uiso 1 1 calc R U . . .
O22 O 0.34218(14) 0.40770(16) 0.50353(9) 0.0353(12) Uani 1 1 d . . . . .
C45 C 0.2914(3) 0.3461(3) 0.54251(18) 0.050(2) Uani 1 1 d . . . . .
H45A H 0.265230 0.346667 0.543283 0.060 Uiso 1 1 calc R U . . .
H45B H 0.300417 0.335789 0.556200 0.060 Uiso 1 1 calc R U . . .
C46 C 0.3030(3) 0.3232(3) 0.52328(17) 0.051(2) Uani 1 1 d . . . . .
H46A H 0.297754 0.298000 0.526352 0.062 Uiso 1 1 calc R U . . .
H46B H 0.289872 0.330194 0.510069 0.062 Uiso 1 1 calc R U . . .
O23 O 0.34003(16) 0.32759(16) 0.51983(10) 0.0410(13) Uani 1 1 d . . . . .
C47 C 0.3029(2) 0.4021(3) 0.56082(14) 0.044(2) Uani 1 1 d . . . . .
H47A H 0.277835 0.407700 0.563929 0.053 Uiso 1 1 calc R U . . .
H47B H 0.311756 0.386748 0.572665 0.053 Uiso 1 1 calc R U . . .
C48 C 0.3238(3) 0.4357(3) 0.56060(16) 0.047(2) Uani 1 1 d . . . . .
H48A H 0.310436 0.454223 0.552733 0.057 Uiso 1 1 calc R U . . .
H48B H 0.327565 0.443963 0.575691 0.057 Uiso 1 1 calc R U . . .
O24 O 0.35765(16) 0.43044(17) 0.55021(9) 0.0389(13) Uani 1 1 d D . . . .
H24 H 0.357(3) 0.4447(18) 0.5371(10) 0.047 Uiso 1 1 d D U . . .
N9 N 0.4310(2) 0.2618(2) 0.53014(12) 0.0486(19) Uani 1 1 d . . . . .
C49 C 0.4515(2) 0.2936(3) 0.53675(16) 0.048(2) Uani 1 1 d . . . . .
H49A H 0.477053 0.287659 0.536476 0.057 Uiso 1 1 calc R U . . .
H49B H 0.445240 0.299695 0.551899 0.057 Uiso 1 1 calc R U . . .
C50 C 0.4453(2) 0.3259(2) 0.52241(15) 0.042(2) Uani 1 1 d . . . . .
H50A H 0.457014 0.346863 0.528865 0.051 Uiso 1 1 calc R U . . .
H50B H 0.455615 0.321831 0.507841 0.051 Uiso 1 1 calc R U . . .
O25 O 0.40837(15) 0.33220(17) 0.52052(10) 0.0407(13) Uani 1 1 d . . . . .
C51 C 0.4483(3) 0.2375(3) 0.51520(16) 0.054(2) Uani 1 1 d . . . . .
H51A H 0.434092 0.215497 0.514156 0.065 Uiso 1 1 calc R U . . .
H51B H 0.471855 0.231115 0.520997 0.065 Uiso 1 1 calc R U . . .
C52 C 0.4525(3) 0.2531(3) 0.49300(17) 0.055(3) Uani 1 1 d . . . . .
H52A H 0.471214 0.271372 0.493295 0.066 Uiso 1 1 calc R U . . .
H52B H 0.459821 0.234352 0.482685 0.066 Uiso 1 1 calc R U . . .
O26 O 0.42081(17) 0.26809(19) 0.48607(11) 0.0523(17) Uani 1 1 d . . . . .
C53 C 0.4203(3) 0.2412(3) 0.54932(17) 0.058(3) Uani 1 1 d . . . . .
H53A H 0.441280 0.236520 0.558461 0.070 Uiso 1 1 calc R U . . .
H53B H 0.410499 0.218200 0.544568 0.070 Uiso 1 1 calc R U . . .
C54 C 0.3931(3) 0.2604(3) 0.56246(18) 0.058(3) Uani 1 1 d . . . . .
H54A H 0.382560 0.243964 0.573181 0.070 Uiso 1 1 calc R U . . .
H54B H 0.404534 0.279974 0.570519 0.070 Uiso 1 1 calc R U . . .
O27 O 0.3657(2) 0.2744(2) 0.54870(12) 0.0576(18) Uani 1 1 d D . . . .
H27 H 0.360(3) 0.2937(14) 0.5578(16) 0.069 Uiso 1 1 d D U . . .
N10 N 0.42163(19) 0.3312(2) 0.44932(12) 0.0463(18) Uani 1 1 d . . . . .
C55 C 0.4025(3) 0.3544(3) 0.46466(17) 0.054(2) Uani 1 1 d . . . . .
H55A H 0.401099 0.378632 0.458639 0.065 Uiso 1 1 calc R U . . .
H55B H 0.415624 0.355533 0.478572 0.065 Uiso 1 1 calc R U . . .
C56 C 0.3652(3) 0.3402(2) 0.46871(16) 0.046(2) Uani 1 1 d . . . . .
H56A H 0.353895 0.353380 0.480743 0.055 Uiso 1 1 calc R U . . .
H56B H 0.350514 0.343205 0.455517 0.055 Uiso 1 1 calc R U . . .
O28 O 0.36767(16) 0.30301(16) 0.47423(9) 0.0392(13) Uani 1 1 d . . . . .
C57 C 0.4134(3) 0.3399(3) 0.42655(16) 0.054(2) Uani 1 1 d . . . . .
H57A H 0.433758 0.333116 0.417303 0.065 Uiso 1 1 calc R U . . .
H57B H 0.410177 0.365835 0.425212 0.065 Uiso 1 1 calc R U . . .
C58 C 0.3808(3) 0.3216(3) 0.41849(18) 0.056(3) Uani 1 1 d . . . . .
H58A H 0.359576 0.334891 0.423186 0.068 Uiso 1 1 calc R U . . .
H58B H 0.381027 0.320981 0.402415 0.068 Uiso 1 1 calc R U . . .
O29 O 0.37920(16) 0.28688(17) 0.42662(10) 0.0455(15) Uani 1 1 d . . . . .
C59 C 0.4602(3) 0.3272(3) 0.45309(18) 0.059(3) Uani 1 1 d . . . . .
H59A H 0.464823 0.325852 0.468891 0.070 Uiso 1 1 calc R U . . .
H59B H 0.472761 0.348168 0.447309 0.070 Uiso 1 1 calc R U . . .
C60 C 0.4743(3) 0.2936(4) 0.44197(19) 0.066(3) Uani 1 1 d . . . . .
H60A H 0.479197 0.298657 0.426478 0.080 Uiso 1 1 calc R U . . .
H60B H 0.496799 0.286336 0.448920 0.080 Uiso 1 1 calc R U . . .
O30 O 0.44969(17) 0.2661(2) 0.44356(11) 0.0551(18) Uani 1 1 d . . . . .
N11 N 0.5066(3) 0.3809(2) 0.38348(15) 0.058(2) Uani 1 1 d . . . . .
O31 O 0.5370(2) 0.3745(2) 0.37539(12) 0.061(2) Uani 1 1 d . . . . .
O32 O 0.4823(2) 0.3876(2) 0.37021(12) 0.065(2) Uani 1 1 d . . . . .
O33 O 0.5022(3) 0.3817(2) 0.40310(13) 0.079(3) Uani 1 1 d . . . . .
N12 N 0.5524(2) 0.6173(2) 0.36435(18) 0.061(2) Uani 1 1 d . . . . .
O34 O 0.5420(2) 0.5985(2) 0.34862(12) 0.0578(18) Uani 1 1 d D . . . .
O35 O 0.56475(19) 0.6014(2) 0.38085(13) 0.0566(18) Uani 1 1 d . . . . .
O36 O 0.5496(2) 0.6496(2) 0.36396(18) 0.083(3) Uani 1 1 d . . . . .
N13 N 0.4669(2) 0.5637(2) 0.45888(13) 0.0443(18) Uani 1 1 d . . . . .
O37 O 0.44389(17) 0.57726(17) 0.44597(11) 0.0471(15) Uani 1 1 d . . . . .
O38 O 0.49023(16) 0.54442(16) 0.44982(10) 0.0415(14) Uani 1 1 d . . . . .
O39 O 0.4662(2) 0.5685(2) 0.47825(11) 0.0559(18) Uani 1 1 d . . . . .
N14 N 0.3029(2) 0.3988(2) 0.44136(12) 0.0435(18) Uani 1 1 d . . . . .
O40 O 0.28915(17) 0.4278(2) 0.44814(11) 0.0508(16) Uani 1 1 d . . . . .
O41 O 0.33411(17) 0.40017(17) 0.43394(11) 0.0481(15) Uani 1 1 d . . . . .
O42 O 0.2863(2) 0.3714(2) 0.44165(13) 0.070(2) Uani 1 1 d . . . . .
N15 N 0.4027(2) 0.3572(2) 0.57124(12) 0.0439(17) Uani 1 1 d . . . . .
O43 O 0.41866(15) 0.37981(16) 0.55956(9) 0.0393(13) Uani 1 1 d . . . . .
O44 O 0.37149(15) 0.34804(17) 0.56596(10) 0.0423(14) Uani 1 1 d D . . . .
O45 O 0.4177(2) 0.3421(2) 0.58607(13) 0.077(3) Uani 1 1 d . . . . .
N16 N 0.3355(3) 0.2194(2) 0.50824(13) 0.052(2) Uani 1 1 d . . . . .
O46 O 0.3678(2) 0.2187(2) 0.51206(14) 0.062(2) Uani 1 1 d . . . . .
O47 O 0.3207(2) 0.2494(2) 0.50527(11) 0.0571(17) Uani 1 1 d . . . . .
O48 O 0.3180(2) 0.1915(2) 0.50650(14) 0.073(2) Uani 1 1 d . . . . .
N71 N 0.5838(3) 0.4264(3) 0.4422(2) 0.093(4) Uani 1 1 d . . . . .
C71 C 0.5542(3) 0.4271(3) 0.4450(2) 0.061(3) Uani 1 1 d . . . . .
C72 C 0.5156(4) 0.4272(5) 0.4491(3) 0.096(5) Uani 1 1 d . . . . .
H72A H 0.510697 0.415044 0.462849 0.145 Uiso 1 1 calc R U . . .
H72B H 0.503510 0.414917 0.437240 0.145 Uiso 1 1 calc R U . . .
H72C H 0.507147 0.451655 0.449971 0.145 Uiso 1 1 calc R U . . .
N72 N 0.5291(5) 0.3501(5) 0.4875(4) 0.154(8) Uani 1 1 d . . . . .
C73 C 0.5536(6) 0.3576(5) 0.4963(3) 0.113(7) Uani 1 1 d . . . . .
C74 C 0.5889(5) 0.3726(5) 0.5051(4) 0.135(8) Uani 1 1 d . . . . .
H74A H 0.608514 0.363957 0.496085 0.202 Uiso 1 1 calc R U . . .
H74B H 0.592343 0.364890 0.520096 0.202 Uiso 1 1 calc R U . . .
H74C H 0.588278 0.398530 0.504510 0.202 Uiso 1 1 calc R U . . .
O81 O 0.6167(3) 0.5866(4) 0.3153(2) 0.124(4) Uani 1 1 d . . . . .
H81 H 0.605923 0.572053 0.323214 0.185 Uiso 1 1 calc R U . . .
C81 C 0.5935(6) 0.6051(6) 0.3040(3) 0.125(7) Uani 1 1 d . . . . .
H81A H 0.577328 0.589002 0.296470 0.188 Uiso 1 1 calc R U . . .
H81B H 0.606020 0.619716 0.293295 0.188 Uiso 1 1 calc R U . . .
H81C H 0.580015 0.620444 0.313800 0.188 Uiso 1 1 calc DR U . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Dy1 Fe1 3.4404(15) . ?
Dy1 Fe4 3.3827(13) 16 ?
Dy1 N1 2.585(9) . ?
Dy1 O1 2.323(6) . ?
Dy1 O2 2.275(7) . ?
Dy1 O3 2.380(8) . ?
Dy1 O4 2.304(6) . ?
Dy1 O29 2.252(6) 16 ?
Dy1 O31 2.527(7) . ?
Dy1 O32 2.466(8) . ?
Dy2 Dy3 3.7454(5) . ?
Dy2 Fe1 3.4119(13) . ?
Dy2 O5 2.268(6) . ?
Dy2 N3 2.591(8) . ?
Dy2 O7 2.298(6) . ?
Dy2 O8 2.310(6) . ?
Dy2 O9 2.454(7) . ?
Dy2 O10 2.279(6) . ?
Dy2 O34 2.490(7) . ?
Dy2 O35 2.480(7) . ?
Dy3 Fe2 3.4786(12) . ?
Dy3 O8 2.280(5) . ?
Dy3 N4 2.580(7) . ?
Dy3 O10 2.252(6) . ?
Dy3 O11 2.325(6) . ?
Dy3 O12 2.489(6) . ?
Dy3 O13 2.320(5) . ?
Dy3 O37 2.489(6) . ?
Dy3 O38 2.484(6) . ?
Dy4 Fe2 3.3796(12) . ?
Dy4 Fe3 3.4700(12) . ?
Dy4 O14 2.292(6) . ?
Dy4 N6 2.565(8) . ?
Dy4 O16 2.290(6) . ?
Dy4 O17 2.293(6) . ?
Dy4 O18 2.395(6) . ?
Dy4 O19 2.312(5) . ?
Dy4 O40 2.505(6) . ?
Dy4 O41 2.443(6) . ?
Dy5 Dy6 3.7432(6) . ?
Dy5 Fe3 3.4263(12) . ?
Dy5 O20 2.258(6) . ?
Dy5 N8 2.590(7) . ?
Dy5 O22 2.284(6) . ?
Dy5 O23 2.302(6) . ?
Dy5 O24 2.425(6) . ?
Dy5 O25 2.274(6) . ?
Dy5 O43 2.551(6) . ?
Dy5 O44 2.471(6) . ?
Dy6 Fe4 3.4410(14) . ?
Dy6 O23 2.241(6) . ?
Dy6 N9 2.575(8) . ?
Dy6 O25 2.287(6) . ?
Dy6 O26 2.279(7) . ?
Dy6 O27 2.498(8) . ?
Dy6 O28 2.289(6) . ?
Dy6 O46 2.505(8) . ?
Dy6 O47 2.499(8) . ?
Fe1 O2 2.009(7) . ?
Fe1 N2 2.230(8) . ?
Fe1 O4 1.995(6) . ?
Fe1 O5 2.027(6) . ?
Fe1 O6 1.997(7) . ?
Fe1 O7 1.960(6) . ?
Fe2 O11 1.991(6) . ?
Fe2 N5 2.195(7) . ?
Fe2 O13 2.036(5) . ?
Fe2 O14 2.035(6) . ?
Fe2 O15 2.000(6) . ?
Fe2 O16 1.987(6) . ?
Fe3 O17 2.002(6) . ?
Fe3 N7 2.243(7) . ?
Fe3 O19 2.006(6) . ?
Fe3 O20 2.050(6) . ?
Fe3 O21 1.994(7) . ?
Fe3 O22 1.965(6) . ?
Fe4 O1 1.979(7) 16 ?
Fe4 O26 2.014(7) . ?
Fe4 N10 2.204(9) . ?
Fe4 O28 2.000(6) . ?
Fe4 O29 2.038(6) . ?
Fe4 O30 1.973(6) . ?
N1 C1 1.485(16) . ?
N1 C3 1.472(15) . ?
N1 C5 1.461(17) . ?
C1 H1A 0.9900 . ?
C1 H1B 0.9900 . ?
C1 C2 1.512(15) . ?
C2 H2A 0.9900 . ?
C2 H2B 0.9900 . ?
C2 O1 1.447(12) . ?
C3 H3A 0.9900 . ?
C3 H3B 0.9900 . ?
C3 C4 1.496(18) . ?
C4 H4A 0.9900 . ?
C4 H4B 0.9900 . ?
C4 O2 1.430(13) . ?
C5 H5A 0.9900 . ?
C5 H5B 0.9900 . ?
C5 C6 1.44(2) . ?
C6 H6A 0.9900 . ?
C6 H6B 0.9900 . ?
C6 O3 1.460(15) . ?
O3 H3 0.98(3) . ?
N2 C7 1.468(15) . ?
N2 C9 1.502(15) . ?
N2 C11 1.494(16) . ?
C7 H7A 0.9900 . ?
C7 H7B 0.9900 . ?
C7 C8 1.484(18) . ?
C8 H8A 0.9900 . ?
C8 H8B 0.9900 . ?
C8 O4 1.421(11) . ?
C9 H9A 0.9900 . ?
C9 H9B 0.9900 . ?
C9 C10 1.527(15) . ?
C10 H10A 0.9900 . ?
C10 H10B 0.9900 . ?
C10 O5 1.416(10) . ?
C11 H11A 0.9900 . ?
C11 H11B 0.9900 . ?
C11 C12 1.56(2) . ?
C12 H12A 0.9900 . ?
C12 H12B 0.9900 . ?
C12 O6 1.374(15) . ?
N3 C13 1.467(13) . ?
N3 C15 1.490(12) . ?
N3 C17 1.487(13) . ?
C13 H13A 0.9900 . ?
C13 H13B 0.9900 . ?
C13 C14 1.543(13) . ?
C14 H14A 0.9900 . ?
C14 H14B 0.9900 . ?
C14 O7 1.426(10) . ?
C15 H15A 0.9900 . ?
C15 H15B 0.9900 . ?
C15 C16 1.528(13) . ?
C16 H16A 0.9900 . ?
C16 H16B 0.9900 . ?
C16 O8 1.433(10) . ?
C17 H17A 0.9900 . ?
C17 H17B 0.9900 . ?
C17 C18 1.552(16) . ?
C18 H18A 0.9900 . ?
C18 H18B 0.9900 . ?
C18 O9 1.425(12) . ?
O9 H9 0.97(4) . ?
N4 C19 1.531(13) . ?
N4 C21 1.502(11) . ?
N4 C23 1.454(13) . ?
C19 H19A 0.9900 . ?
C19 H19B 0.9900 . ?
C19 C20 1.470(14) . ?
C20 H20A 0.9900 . ?
C20 H20B 0.9900 . ?
C20 O10 1.438(10) . ?
C21 H21A 0.9900 . ?
C21 H21B 0.9900 . ?
C21 C22 1.484(15) . ?
C22 H22A 0.9900 . ?
C22 H22B 0.9900 . ?
C22 O11 1.419(10) . ?
C23 H23A 0.9900 . ?
C23 H23B 0.9900 . ?
C23 C24 1.526(13) . ?
C24 H24A 0.9900 . ?
C24 H24B 0.9900 . ?
C24 O12 1.417(11) . ?
O12 H12 0.91(3) . ?
N5 C25 1.497(12) . ?
N5 C27 1.473(12) . ?
N5 C29 1.495(12) . ?
C25 H25A 0.9900 . ?
C25 H25B 0.9900 . ?
C25 C26 1.534(13) . ?
C26 H26A 0.9900 . ?
C26 H26B 0.9900 . ?
C26 O13 1.407(10) . ?
C27 H27A 0.9900 . ?
C27 H27B 0.9900 . ?
C27 C28 1.450(14) . ?
C28 H28A 0.9900 . ?
C28 H28B 0.9900 . ?
C28 O14 1.380(12) . ?
C29 H29A 0.9900 . ?
C29 H29B 0.9900 . ?
C29 C30 1.534(16) . ?
C30 H30A 0.9900 . ?
C30 H30B 0.9900 . ?
C30 O15 1.448(13) . ?
N6 C31A 1.533(14) . ?
N6 C31B 1.516(13) . ?
N6 C33A 1.510(13) . ?
N6 C33B 1.498(13) . ?
N6 C35A 1.517(15) . ?
N6 C35B 1.517(13) . ?
C31A H31A 0.9900 . ?
C31A H31B 0.9900 . ?
C31A C32 1.434(15) . ?
C31B H31C 0.9900 . ?
C31B H31D 0.9900 . ?
C31B C32 1.452(14) . ?
C32 H32A 0.9900 . ?
C32 H32B 0.9900 . ?
C32 H32C 0.9900 . ?
C32 H32D 0.9900 . ?
C32 O16 1.426(11) . ?
C33A H33A 0.9900 . ?
C33A H33B 0.9900 . ?
C33A C34 1.443(14) . ?
C33B H33C 0.9900 . ?
C33B H33D 0.9900 . ?
C33B C34 1.448(14) . ?
C34 H34A 0.9900 . ?
C34 H34B 0.9900 . ?
C34 H34C 0.9900 . ?
C34 H34D 0.9900 . ?
C34 O17 1.406(11) . ?
C35A H35A 0.9900 . ?
C35A H35B 0.9900 . ?
C35A C36 1.466(16) . ?
C35B H35C 0.9900 . ?
C35B H35D 0.9900 . ?
C35B C36 1.418(14) . ?
C36 H36A 0.9900 . ?
C36 H36B 0.9900 . ?
C36 H36C 0.9900 . ?
C36 H36D 0.9900 . ?
C36 O18 1.448(12) . ?
O18 H18 0.98(4) . ?
N7 C37 1.506(12) . ?
N7 C39 1.501(12) . ?
N7 C41 1.453(12) . ?
C37 H37A 0.9900 . ?
C37 H37B 0.9900 . ?
C37 C38 1.532(12) . ?
C38 H38A 0.9900 . ?
C38 H38B 0.9900 . ?
C38 O19 1.423(9) . ?
C39 H39A 0.9900 . ?
C39 H39B 0.9900 . ?
C39 C40 1.497(14) . ?
C40 H40A 0.9900 . ?
C40 H40B 0.9900 . ?
C40 O20 1.429(10) . ?
C41 H41A 0.9900 . ?
C41 H41B 0.9900 . ?
C41 C42 1.501(15) . ?
C42 H42A 0.9900 . ?
C42 H42B 0.9900 . ?
C42 O21 1.403(13) . ?
N8 C43 1.491(12) . ?
N8 C45 1.478(12) . ?
N8 C47 1.480(11) . ?
C43 H43A 0.9900 . ?
C43 H43B 0.9900 . ?
C43 C44 1.539(12) . ?
C44 H44A 0.9900 . ?
C44 H44B 0.9900 . ?
C44 O22 1.438(9) . ?
C45 H45A 0.9900 . ?
C45 H45B 0.9900 . ?
C45 C46 1.533(14) . ?
C46 H46A 0.9900 . ?
C46 H46B 0.9900 . ?
C46 O23 1.424(11) . ?
C47 H47A 0.9900 . ?
C47 H47B 0.9900 . ?
C47 C48 1.496(14) . ?
C48 H48A 0.9900 . ?
C48 H48B 0.9900 . ?
C48 O24 1.443(11) . ?
O24 H24 0.97(3) . ?
N9 C49 1.486(13) . ?
N9 C51 1.455(13) . ?
N9 C53 1.471(13) . ?
C49 H49A 0.9900 . ?
C49 H49B 0.9900 . ?
C49 C50 1.526(13) . ?
C50 H50A 0.9900 . ?
C50 H50B 0.9900 . ?
C50 O25 1.421(10) . ?
C51 H51A 0.9900 . ?
C51 H51B 0.9900 . ?
C51 C52 1.497(15) . ?
C52 H52A 0.9900 . ?
C52 H52B 0.9900 . ?
C52 O26 1.392(11) . ?
C53 H53A 0.9900 . ?
C53 H53B 0.9900 . ?
C53 C54 1.494(16) . ?
C54 H54A 0.9900 . ?
C54 H54B 0.9900 . ?
C54 O27 1.440(13) . ?
O27 H27 0.94(4) . ?
N10 C55 1.477(13) . ?
N10 C57 1.473(12) . ?
N10 C59 1.483(12) . ?
C55 H55A 0.9900 . ?
C55 H55B 0.9900 . ?
C55 C56 1.531(14) . ?
C56 H56A 0.9900 . ?
C56 H56B 0.9900 . ?
C56 O28 1.448(11) . ?
C57 H57A 0.9900 . ?
C57 H57B 0.9900 . ?
C57 C58 1.500(14) . ?
C58 H58A 0.9900 . ?
C58 H58B 0.9900 . ?
C58 O29 1.405(12) . ?
C59 H59A 0.9900 . ?
C59 H59B 0.9900 . ?
C59 C60 1.539(17) . ?
C60 H60A 0.9900 . ?
C60 H60B 0.9900 . ?
C60 O30 1.398(14) . ?
N11 O31 1.277(12) . ?
N11 O32 1.253(11) . ?
N11 O33 1.220(12) . ?
N12 O34 1.264(12) . ?
N12 O35 1.271(12) . ?
N12 O36 1.227(12) . ?
N13 O37 1.285(10) . ?
N13 O38 1.273(10) . ?
N13 O39 1.206(10) . ?
N14 O40 1.282(11) . ?
N14 O41 1.267(10) . ?
N14 O42 1.211(10) . ?
N15 O43 1.268(9) . ?
N15 O44 1.272(10) . ?
N15 O45 1.219(10) . ?
N16 O46 1.243(12) . ?
N16 O47 1.276(11) . ?
N16 O48 1.250(11) . ?
N71 C71 1.134(16) . ?
C71 C72 1.478(18) . ?
C72 H72A 0.9800 . ?
C72 H72B 0.9800 . ?
C72 H72C 0.9800 . ?
N72 C73 1.11(2) . ?
C73 C74 1.55(3) . ?
C74 H74A 0.9800 . ?
C74 H74B 0.9800 . ?
C74 H74C 0.9800 . ?
O81 H81 0.8400 . ?
O81 C81 1.32(2) . ?
C81 H81A 0.9800 . ?
C81 H81B 0.9800 . ?
C81 H81C 0.9800 . ?

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
_geom_angle_publ_flag
Fe4 Dy1 Fe1 121.04(3) 16 . ?
N1 Dy1 Fe1 98.3(2) . . ?
N1 Dy1 Fe4 94.23(19) . 16 ?
N1 Dy1 N11 111.6(3) . . ?
O1 Dy1 Fe1 101.14(17) . . ?
O1 Dy1 Fe4 34.69(17) . 16 ?
O1 Dy1 N1 68.2(2) . . ?
O1 Dy1 O3 84.1(2) . . ?
O1 Dy1 N11 164.6(3) . . ?
O1 Dy1 O31 152.4(2) . . ?
O1 Dy1 O32 148.6(3) . . ?
O2 Dy1 Fe1 34.02(16) . . ?
O2 Dy1 Fe4 132.56(19) . 16 ?
O2 Dy1 N1 66.6(3) . . ?
O2 Dy1 O1 99.5(2) . . ?
O2 Dy1 O3 129.8(3) . . ?
O2 Dy1 O4 67.7(2) . . ?
O2 Dy1 N11 94.2(3) . . ?
O2 Dy1 O31 78.9(3) . . ?
O2 Dy1 O32 108.7(3) . . ?
O3 Dy1 Fe1 163.3(2) . . ?
O3 Dy1 Fe4 71.80(18) . 16 ?
O3 Dy1 N1 68.7(3) . . ?
O3 Dy1 N11 81.7(3) . . ?
O3 Dy1 O31 76.5(2) . . ?
O3 Dy1 O32 88.1(3) . . ?
O4 Dy1 Fe1 33.85(15) . . ?
O4 Dy1 Fe4 97.76(15) . 16 ?
O4 Dy1 N1 127.4(3) . . ?
O4 Dy1 O1 95.3(2) . . ?
O4 Dy1 O3 162.4(3) . . ?
O4 Dy1 N11 96.4(2) . . ?
O4 Dy1 O31 109.1(2) . . ?
O4 Dy1 O32 83.3(2) . . ?
O29 Dy1 Fe1 116.55(16) 16 . ?
O29 Dy1 Fe4 35.78(16) 16 16 ?
O29 Dy1 N1 128.4(3) 16 . ?
O29 Dy1 O1 68.6(2) 16 . ?
O29 Dy1 O2 147.8(2) 16 . ?
O29 Dy1 O3 80.1(3) 16 . ?
O29 Dy1 O4 83.3(2) 16 . ?
O29 Dy1 N11 102.9(3) 16 . ?
O29 Dy1 O31 125.6(3) 16 . ?
O29 Dy1 O32 80.1(3) 16 . ?
N11 Dy1 Fe1 94.18(19) . . ?
N11 Dy1 Fe4 133.0(2) . 16 ?
O31 Dy1 Fe1 92.77(19) . . ?
O31 Dy1 Fe4 145.6(2) . 16 ?
O31 Dy1 N1 86.3(3) . . ?
O31 Dy1 N11 25.8(2) . . ?
O32 Dy1 Fe1 95.0(2) . . ?
O32 Dy1 Fe4 114.2(2) . 16 ?
O32 Dy1 N1 135.8(3) . . ?
O32 Dy1 N11 25.1(2) . . ?
O32 Dy1 O31 51.0(3) . . ?
Fe1 Dy2 Dy3 122.24(3) . . ?
O5 Dy2 Dy3 111.54(16) . . ?
O5 Dy2 Fe1 35.01(16) . . ?
O5 Dy2 N3 127.7(2) . . ?
O5 Dy2 O7 65.5(2) . . ?
O5 Dy2 O8 131.6(2) . . ?
O5 Dy2 O9 82.2(2) . . ?
O5 Dy2 O10 87.9(2) . . ?
O5 Dy2 N12 109.5(3) . . ?
O5 Dy2 O34 83.6(2) . . ?
O5 Dy2 O35 135.2(2) . . ?
N3 Dy2 Dy3 104.77(18) . . ?
N3 Dy2 Fe1 93.61(18) . . ?
N3 Dy2 N12 105.5(3) . . ?
O7 Dy2 Dy3 104.96(15) . . ?
O7 Dy2 Fe1 33.48(15) . . ?
O7 Dy2 N3 69.7(2) . . ?
O7 Dy2 O8 88.1(2) . . ?
O7 Dy2 O9 83.2(2) . . ?
O7 Dy2 N12 163.3(2) . . ?
O7 Dy2 O34 143.9(2) . . ?
O7 Dy2 O35 152.1(2) . . ?
O8 Dy2 Dy3 35.06(13) . . ?
O8 Dy2 Fe1 118.79(14) . . ?
O8 Dy2 N3 70.1(2) . . ?
O8 Dy2 O9 136.4(2) . . ?
O8 Dy2 N12 105.6(3) . . ?
O8 Dy2 O34 127.6(2) . . ?
O8 Dy2 O35 86.2(2) . . ?
O9 Dy2 Dy3 165.88(17) . . ?
O9 Dy2 Fe1 70.77(18) . . ?
O9 Dy2 N3 66.8(3) . . ?
O9 Dy2 N12 80.3(3) . . ?
O9 Dy2 O34 74.2(3) . . ?
O9 Dy2 O35 82.3(2) . . ?
O10 Dy2 Dy3 34.01(14) . . ?
O10 Dy2 Fe1 114.47(16) . . ?
O10 Dy2 N3 138.0(2) . . ?
O10 Dy2 O7 118.0(2) . . ?
O10 Dy2 O8 69.06(19) . . ?
O10 Dy2 O9 150.2(2) . . ?
O10 Dy2 N12 76.6(2) . . ?
O10 Dy2 O34 76.8(2) . . ?
O10 Dy2 O35 85.2(2) . . ?
N12 Dy2 Dy3 91.7(2) . . ?
N12 Dy2 Fe1 135.4(2) . . ?
O34 Dy2 Dy3 103.42(17) . . ?
O34 Dy2 Fe1 111.06(18) . . ?
O34 Dy2 N3 123.0(3) . . ?
O34 Dy2 N12 26.0(3) . . ?
O35 Dy2 Dy3 85.42(17) . . ?
O35 Dy2 Fe1 151.91(18) . . ?
O35 Dy2 N3 82.6(3) . . ?
O35 Dy2 N12 26.1(2) . . ?
O35 Dy2 O34 51.7(2) . . ?
Fe2 Dy3 Dy2 114.78(2) . . ?
O8 Dy3 Dy2 35.59(14) . . ?
O8 Dy3 Fe2 120.74(14) . . ?
O8 Dy3 N4 127.6(2) . . ?
O8 Dy3 O11 142.0(2) . . ?
O8 Dy3 O12 80.3(2) . . ?
O8 Dy3 O13 88.58(19) . . ?
O8 Dy3 N13 104.8(2) . . ?
O8 Dy3 O37 130.2(2) . . ?
O8 Dy3 O38 80.33(19) . . ?
N4 Dy3 Dy2 100.29(18) . . ?
N4 Dy3 Fe2 100.58(18) . . ?
N4 Dy3 N13 101.2(3) . . ?
O10 Dy3 Dy2 34.49(14) . . ?
O10 Dy3 Fe2 101.32(15) . . ?
O10 Dy3 O8 70.1(2) . . ?
O10 Dy3 N4 71.6(2) . . ?
O10 Dy3 O11 87.2(2) . . ?
O10 Dy3 O12 90.7(2) . . ?
O10 Dy3 O13 102.7(2) . . ?
O10 Dy3 N13 162.5(2) . . ?
O10 Dy3 O37 151.3(2) . . ?
O10 Dy3 O38 148.8(2) . . ?
O11 Dy3 Dy2 116.02(15) . . ?
O11 Dy3 Fe2 33.15(14) . . ?
O11 Dy3 N4 67.6(2) . . ?
O11 Dy3 O12 131.6(2) . . ?
O11 Dy3 N13 105.0(2) . . ?
O11 Dy3 O37 83.5(2) . . ?
O11 Dy3 O38 123.2(2) . . ?
O12 Dy3 Dy2 85.30(15) . . ?
O12 Dy3 Fe2 158.26(15) . . ?
O12 Dy3 N4 66.0(2) . . ?
O12 Dy3 N13 71.8(2) . . ?
O13 Dy3 Dy2 96.27(13) . . ?
O13 Dy3 Fe2 34.28(13) . . ?
O13 Dy3 N4 134.0(2) . . ?
O13 Dy3 O11 66.54(19) . . ?
O13 Dy3 O12 158.6(2) . . ?
O13 Dy3 N13 93.8(2) . . ?
O13 Dy3 O37 98.4(2) . . ?
O13 Dy3 O38 85.7(2) . . ?
N13 Dy3 Dy2 138.40(15) . . ?
N13 Dy3 Fe2 95.63(15) . . ?
O37 Dy3 Dy2 159.21(15) . . ?
O37 Dy3 Fe2 85.37(15) . . ?
O37 Dy3 N4 79.8(2) . . ?
O37 Dy3 O12 75.7(2) . . ?
O37 Dy3 N13 25.9(2) . . ?
O37 Dy3 O38 51.5(2) . . ?
O38 Dy3 Dy2 115.50(14) . . ?
O38 Dy3 Fe2 102.04(14) . . ?
O38 Dy3 N4 123.3(2) . . ?
O38 Dy3 O12 74.5(2) . . ?
O38 Dy3 N13 25.6(2) . . ?
Fe2 Dy4 Fe3 121.50(3) . . ?
O14 Dy4 Fe2 35.99(14) . . ?
O14 Dy4 Fe3 119.57(14) . . ?
O14 Dy4 N6 127.4(2) . . ?
O14 Dy4 O18 78.3(2) . . ?
O14 Dy4 O19 86.17(19) . . ?
O14 Dy4 N14 102.2(2) . . ?
O14 Dy4 O40 124.6(2) . . ?
O14 Dy4 O41 78.5(2) . . ?
N6 Dy4 Fe2 94.37(17) . . ?
N6 Dy4 Fe3 98.95(17) . . ?
N6 Dy4 N14 110.4(2) . . ?
O16 Dy4 Fe2 34.74(15) . . ?
O16 Dy4 Fe3 100.41(15) . . ?
O16 Dy4 O14 69.2(2) . . ?
O16 Dy4 N6 69.8(2) . . ?
O16 Dy4 O18 86.1(2) . . ?
O16 Dy4 O19 92.64(19) . . ?
O16 Dy4 N14 166.2(2) . . ?
O16 Dy4 O40 152.9(2) . . ?
O16 Dy4 O41 147.6(2) . . ?
O17 Dy4 Fe2 132.25(16) . . ?
O17 Dy4 Fe3 33.37(15) . . ?
O17 Dy4 O14 150.2(2) . . ?
O17 Dy4 N6 67.5(2) . . ?
O17 Dy4 O16 98.9(2) . . ?
O17 Dy4 O18 129.4(2) . . ?
O17 Dy4 O19 66.7(2) . . ?
O17 Dy4 N14 93.7(2) . . ?
O17 Dy4 O40 78.5(2) . . ?
O17 Dy4 O41 110.0(2) . . ?
O18 Dy4 Fe2 72.74(16) . . ?
O18 Dy4 Fe3 162.08(16) . . ?
O18 Dy4 N6 67.4(2) . . ?
O18 Dy4 N14 81.5(2) . . ?
O18 Dy4 O40 75.6(2) . . ?
O18 Dy4 O41 86.7(2) . . ?
O19 Dy4 Fe2 97.24(13) . . ?
O19 Dy4 Fe3 33.61(14) . . ?
O19 Dy4 N6 127.0(2) . . ?
O19 Dy4 O18 163.9(2) . . ?
O19 Dy4 N14 97.6(2) . . ?
O19 Dy4 O40 110.4(2) . . ?
O19 Dy4 O41 85.8(2) . . ?
N14 Dy4 Fe2 133.78(16) . . ?
N14 Dy4 Fe3 93.27(14) . . ?
O40 Dy4 Fe2 146.03(15) . . ?
O40 Dy4 Fe3 92.04(15) . . ?
O40 Dy4 N6 84.6(2) . . ?
O40 Dy4 N14 26.4(2) . . ?
O41 Dy4 Fe2 113.35(16) . . ?
O41 Dy4 Fe3 96.03(16) . . ?
O41 Dy4 N6 134.7(2) . . ?
O41 Dy4 N14 25.9(2) . . ?
O41 Dy4 O40 52.2(2) . . ?
Fe3 Dy5 Dy6 121.65(2) . . ?
O20 Dy5 Dy6 113.52(15) . . ?
O20 Dy5 Fe3 35.26(14) . . ?
O20 Dy5 N8 129.1(2) . . ?
O20 Dy5 O22 66.36(19) . . ?
O20 Dy5 O23 133.2(2) . . ?
O20 Dy5 O24 81.3(2) . . ?
O20 Dy5 O25 89.5(2) . . ?
O20 Dy5 N15 111.5(2) . . ?
O20 Dy5 O43 85.65(19) . . ?
O20 Dy5 O44 137.1(2) . . ?
N8 Dy5 Dy6 101.91(17) . . ?
N8 Dy5 Fe3 95.15(17) . . ?
N8 Dy5 N15 101.9(2) . . ?
O22 Dy5 Dy6 104.74(15) . . ?
O22 Dy5 Fe3 33.20(14) . . ?
O22 Dy5 N8 70.2(2) . . ?
O22 Dy5 O23 88.2(2) . . ?
O22 Dy5 O24 80.9(2) . . ?
O22 Dy5 O25 119.4(2) . . ?
O22 Dy5 N15 162.5(2) . . ?
O22 Dy5 O43 145.82(19) . . ?
O22 Dy5 O44 149.93(19) . . ?
O23 Dy5 Dy6 33.98(15) . . ?
O23 Dy5 Fe3 118.25(15) . . ?
O23 Dy5 N8 68.4(2) . . ?
O23 Dy5 O24 134.8(2) . . ?
O23 Dy5 N15 103.8(2) . . ?
O23 Dy5 O43 126.0(2) . . ?
O23 Dy5 O44 83.3(2) . . ?
O24 Dy5 Dy6 165.19(14) . . ?
O24 Dy5 Fe3 70.40(14) . . ?
O24 Dy5 N8 66.7(2) . . ?
O24 Dy5 N15 81.6(2) . . ?
O24 Dy5 O43 75.6(2) . . ?
O24 Dy5 O44 84.9(2) . . ?
O25 Dy5 Dy6 34.95(15) . . ?
O25 Dy5 Fe3 115.10(16) . . ?
O25 Dy5 N8 135.7(2) . . ?
O25 Dy5 O23 68.9(2) . . ?
O25 Dy5 O24 152.1(2) . . ?
O25 Dy5 N15 77.4(2) . . ?
O25 Dy5 O43 77.5(2) . . ?
O25 Dy5 O44 84.2(2) . . ?
N15 Dy5 Dy6 92.12(16) . . ?
N15 Dy5 Fe3 137.93(16) . . ?
O43 Dy5 Dy6 104.26(14) . . ?
O43 Dy5 Fe3 113.91(13) . . ?
O43 Dy5 N8 120.3(2) . . ?
O43 Dy5 N15 25.9(2) . . ?
O44 Dy5 Dy6 83.73(16) . . ?
O44 Dy5 Fe3 154.55(16) . . ?
O44 Dy5 N8 79.8(2) . . ?
O44 Dy5 N15 25.9(2) . . ?
O44 Dy5 O43 51.55(19) . . ?
Fe4 Dy6 Dy5 114.59(3) . . ?
O23 Dy6 Dy5 35.04(15) . . ?
O23 Dy6 Fe4 120.97(16) . . ?
O23 Dy6 N9 125.8(2) . . ?
O23 Dy6 O25 69.7(2) . . ?
O23 Dy6 O26 146.2(2) . . ?
O23 Dy6 O27 73.8(2) . . ?
O23 Dy6 O28 87.7(2) . . ?
O23 Dy6 N16 107.1(2) . . ?
O23 Dy6 O46 128.4(2) . . ?
O23 Dy6 O47 83.9(2) . . ?
N9 Dy6 Dy5 100.20(19) . . ?
N9 Dy6 Fe4 102.92(18) . . ?
N9 Dy6 N16 99.2(3) . . ?
O25 Dy6 Dy5 34.74(15) . . ?
O25 Dy6 Fe4 101.72(15) . . ?
O25 Dy6 N9 71.7(2) . . ?
O25 Dy6 O27 84.5(2) . . ?
O25 Dy6 O28 96.8(2) . . ?
O25 Dy6 N16 163.2(2) . . ?
O25 Dy6 O46 146.3(2) . . ?
O25 Dy6 O47 153.1(2) . . ?
O26 Dy6 Dy5 120.19(19) . . ?
O26 Dy6 Fe4 34.17(17) . . ?
O26 Dy6 N9 68.8(2) . . ?
O26 Dy6 O25 90.9(2) . . ?
O26 Dy6 O27 133.5(2) . . ?
O26 Dy6 O28 66.7(2) . . ?
O26 Dy6 N16 98.9(3) . . ?
O26 Dy6 O46 83.0(3) . . ?
O26 Dy6 O47 114.8(2) . . ?
O27 Dy6 Dy5 78.20(19) . . ?
O27 Dy6 Fe4 165.12(18) . . ?
O27 Dy6 N9 65.9(2) . . ?
O27 Dy6 N16 78.8(2) . . ?
O28 Dy6 Dy5 91.38(15) . . ?
O28 Dy6 Fe4 33.86(14) . . ?
O28 Dy6 N9 133.7(2) . . ?
O28 Dy6 O27 159.8(2) . . ?
O28 Dy6 N16 99.5(2) . . ?
O28 Dy6 O46 110.8(2) . . ?
O28 Dy6 O47 87.2(2) . . ?
N16 Dy6 Dy5 140.45(18) . . ?
N16 Dy6 Fe4 93.97(16) . . ?
O46 Dy6 Dy5 153.60(19) . . ?
O46 Dy6 Fe4 91.66(19) . . ?
O46 Dy6 N9 75.2(3) . . ?
O46 Dy6 O27 76.2(3) . . ?
O46 Dy6 N16 25.3(2) . . ?
O46 Dy6 O47 51.3(2) . . ?
O47 Dy6 Dy5 118.89(17) . . ?
O47 Dy6 Fe4 96.35(17) . . ?
O47 Dy6 N9 123.4(3) . . ?
O47 Dy6 O27 82.9(2) . . ?
O47 Dy6 N16 26.0(2) . . ?
Dy2 Fe1 Dy1 139.43(4) . . ?
O2 Fe1 Dy1 39.30(19) . . ?
O2 Fe1 Dy2 133.3(2) . . ?
O2 Fe1 N2 110.0(3) . . ?
O2 Fe1 O5 171.0(3) . . ?
O2 Fe1 O6 89.6(3) . . ?
N2 Fe1 Dy1 98.5(3) . . ?
N2 Fe1 Dy2 114.5(3) . . ?
O4 Fe1 Dy1 40.05(18) . . ?
O4 Fe1 Dy2 122.00(19) . . ?
O4 Fe1 O2 79.2(3) . . ?
O4 Fe1 N2 79.3(3) . . ?
O4 Fe1 O5 100.1(3) . . ?
O4 Fe1 O6 149.8(3) . . ?
O5 Fe1 Dy1 138.60(19) . . ?
O5 Fe1 Dy2 39.94(16) . . ?
O5 Fe1 N2 78.5(3) . . ?
O6 Fe1 Dy1 125.0(2) . . ?
O6 Fe1 Dy2 86.0(2) . . ?
O6 Fe1 N2 78.4(3) . . ?
O6 Fe1 O5 95.2(3) . . ?
O7 Fe1 Dy1 103.45(19) . . ?
O7 Fe1 Dy2 40.29(18) . . ?
O7 Fe1 O2 95.2(3) . . ?
O7 Fe1 N2 154.5(3) . . ?
O7 Fe1 O4 109.9(3) . . ?
O7 Fe1 O5 76.6(2) . . ?
O7 Fe1 O6 98.9(3) . . ?
Dy4 Fe2 Dy3 132.55(4) . . ?
O11 Fe2 Dy3 39.70(16) . . ?
O11 Fe2 Dy4 137.61(19) . . ?
O11 Fe2 N5 102.5(3) . . ?
O11 Fe2 O13 78.5(2) . . ?
O11 Fe2 O14 175.3(2) . . ?
O11 Fe2 O15 92.6(2) . . ?
O11 Fe2 O16 97.5(3) . . ?
N5 Fe2 Dy3 99.3(2) . . ?
N5 Fe2 Dy4 118.6(2) . . ?
O13 Fe2 Dy3 39.92(16) . . ?
O13 Fe2 Dy4 115.79(16) . . ?
O13 Fe2 N5 81.3(3) . . ?
O14 Fe2 Dy3 136.13(17) . . ?
O14 Fe2 Dy4 41.45(16) . . ?
O14 Fe2 N5 79.8(3) . . ?
O14 Fe2 O13 97.9(2) . . ?
O15 Fe2 Dy3 131.52(19) . . ?
O15 Fe2 Dy4 85.37(17) . . ?
O15 Fe2 N5 79.5(3) . . ?
O15 Fe2 O13 156.6(2) . . ?
O15 Fe2 O14 91.8(2) . . ?
O16 Fe2 Dy3 98.40(17) . . ?
O16 Fe2 Dy4 41.08(17) . . ?
O16 Fe2 N5 159.7(3) . . ?
O16 Fe2 O13 106.6(2) . . ?
O16 Fe2 O14 80.6(2) . . ?
O16 Fe2 O15 96.0(2) . . ?
Dy5 Fe3 Dy4 134.54(4) . . ?
O17 Fe3 Dy4 39.05(16) . . ?
O17 Fe3 Dy5 133.02(19) . . ?
O17 Fe3 N7 110.5(3) . . ?
O17 Fe3 O19 78.3(2) . . ?
O17 Fe3 O20 169.9(3) . . ?
N7 Fe3 Dy4 100.48(18) . . ?
N7 Fe3 Dy5 115.37(18) . . ?
O19 Fe3 Dy4 39.64(16) . . ?
O19 Fe3 Dy5 118.93(17) . . ?
O19 Fe3 N7 79.8(2) . . ?
O19 Fe3 O20 99.8(2) . . ?
O20 Fe3 Dy4 137.06(17) . . ?
O20 Fe3 Dy5 39.47(16) . . ?
O20 Fe3 N7 78.7(2) . . ?
O21 Fe3 Dy4 127.7(2) . . ?
O21 Fe3 Dy5 87.9(2) . . ?
O21 Fe3 O17 91.6(3) . . ?
O21 Fe3 N7 78.4(3) . . ?
O21 Fe3 O19 150.9(3) . . ?
O21 Fe3 O20 94.5(3) . . ?
O22 Fe3 Dy4 100.66(16) . . ?
O22 Fe3 Dy5 39.55(16) . . ?
O22 Fe3 O17 94.6(2) . . ?
O22 Fe3 N7 154.8(2) . . ?
O22 Fe3 O19 108.7(2) . . ?
O22 Fe3 O20 76.5(2) . . ?
O22 Fe3 O21 99.1(3) . . ?
Dy1 Fe4 Dy6 131.27(4) 16 . ?
O1 Fe4 Dy1 41.92(19) 16 16 ?
O1 Fe4 Dy6 96.4(2) 16 . ?
O1 Fe4 O26 98.9(3) 16 . ?
O1 Fe4 N10 158.7(3) 16 . ?
O1 Fe4 O28 104.5(3) 16 . ?
O1 Fe4 O29 79.8(3) 16 . ?
O26 Fe4 Dy1 139.9(2) . 16 ?
O26 Fe4 Dy6 39.45(19) . . ?
O26 Fe4 N10 102.4(3) . . ?
O26 Fe4 O29 174.0(3) . . ?
N10 Fe4 Dy1 116.8(2) . 16 ?
N10 Fe4 Dy6 101.2(2) . . ?
O28 Fe4 Dy1 114.58(18) . 16 ?
O28 Fe4 Dy6 39.62(17) . . ?
O28 Fe4 O26 77.5(3) . . ?
O28 Fe4 N10 82.1(3) . . ?
O28 Fe4 O29 97.1(3) . . ?
O29 Fe4 Dy1 40.24(18) . 16 ?
O29 Fe4 Dy6 134.61(19) . . ?
O29 Fe4 N10 79.2(3) . . ?
O30 Fe4 Dy1 87.8(2) . 16 ?
O30 Fe4 Dy6 129.8(2) . . ?
O30 Fe4 O1 97.6(3) . 16 ?
O30 Fe4 O26 90.7(3) . . ?
O30 Fe4 N10 80.4(3) . . ?
O30 Fe4 O28 156.2(3) . . ?
O30 Fe4 O29 95.3(3) . . ?
C1 N1 Dy1 105.8(6) . . ?
C3 N1 Dy1 106.2(6) . . ?
C3 N1 C1 109.5(11) . . ?
C5 N1 Dy1 112.4(9) . . ?
C5 N1 C1 110.6(10) . . ?
C5 N1 C3 112.1(9) . . ?
N1 C1 H1A 109.6 . . ?
N1 C1 H1B 109.6 . . ?
N1 C1 C2 110.1(11) . . ?
H1A C1 H1B 108.2 . . ?
C2 C1 H1A 109.6 . . ?
C2 C1 H1B 109.6 . . ?
C1 C2 H2A 109.8 . . ?
C1 C2 H2B 109.8 . . ?
H2A C2 H2B 108.2 . . ?
O1 C2 C1 109.6(8) . . ?
O1 C2 H2A 109.8 . . ?
O1 C2 H2B 109.8 . . ?
Fe4 O1 Dy1 103.4(3) 16 . ?
C2 O1 Dy1 122.8(5) . . ?
C2 O1 Fe4 120.1(6) . 16 ?
N1 C3 H3A 109.3 . . ?
N1 C3 H3B 109.3 . . ?
N1 C3 C4 111.4(9) . . ?
H3A C3 H3B 108.0 . . ?
C4 C3 H3A 109.3 . . ?
C4 C3 H3B 109.3 . . ?
C3 C4 H4A 109.3 . . ?
C3 C4 H4B 109.3 . . ?
H4A C4 H4B 108.0 . . ?
O2 C4 C3 111.4(11) . . ?
O2 C4 H4A 109.3 . . ?
O2 C4 H4B 109.3 . . ?
Fe1 O2 Dy1 106.7(3) . . ?
C4 O2 Dy1 124.9(7) . . ?
C4 O2 Fe1 128.3(8) . . ?
N1 C5 H5A 109.4 . . ?
N1 C5 H5B 109.4 . . ?
H5A C5 H5B 108.0 . . ?
C6 C5 N1 111.2(10) . . ?
C6 C5 H5A 109.4 . . ?
C6 C5 H5B 109.4 . . ?
C5 C6 H6A 108.8 . . ?
C5 C6 H6B 108.8 . . ?
C5 C6 O3 113.9(10) . . ?
H6A C6 H6B 107.7 . . ?
O3 C6 H6A 108.8 . . ?
O3 C6 H6B 108.8 . . ?
Dy1 O3 H3 103(8) . . ?
C6 O3 Dy1 113.0(8) . . ?
C6 O3 H3 107(7) . . ?
C7 N2 Fe1 107.0(7) . . ?
C7 N2 C9 115.3(9) . . ?
C7 N2 C11 115.0(11) . . ?
C9 N2 Fe1 107.6(6) . . ?
C11 N2 Fe1 102.5(7) . . ?
C11 N2 C9 108.4(11) . . ?
N2 C7 H7A 109.5 . . ?
N2 C7 H7B 109.5 . . ?
N2 C7 C8 110.7(9) . . ?
H7A C7 H7B 108.1 . . ?
C8 C7 H7A 109.5 . . ?
C8 C7 H7B 109.5 . . ?
C7 C8 H8A 109.9 . . ?
C7 C8 H8B 109.9 . . ?
H8A C8 H8B 108.3 . . ?
O4 C8 C7 108.7(9) . . ?
O4 C8 H8A 109.9 . . ?
O4 C8 H8B 109.9 . . ?
Fe1 O4 Dy1 106.1(3) . . ?
C8 O4 Dy1 124.1(6) . . ?
C8 O4 Fe1 113.9(6) . . ?
N2 C9 H9A 109.9 . . ?
N2 C9 H9B 109.9 . . ?
N2 C9 C10 109.1(9) . . ?
H9A C9 H9B 108.3 . . ?
C10 C9 H9A 109.9 . . ?
C10 C9 H9B 109.9 . . ?
C9 C10 H10A 109.8 . . ?
C9 C10 H10B 109.8 . . ?
H10A C10 H10B 108.3 . . ?
O5 C10 C9 109.2(8) . . ?
O5 C10 H10A 109.8 . . ?
O5 C10 H10B 109.8 . . ?
Fe1 O5 Dy2 105.1(2) . . ?
C10 O5 Dy2 132.5(6) . . ?
C10 O5 Fe1 119.1(5) . . ?
N2 C11 H11A 109.8 . . ?
N2 C11 H11B 109.8 . . ?
N2 C11 C12 109.2(10) . . ?
H11A C11 H11B 108.3 . . ?
C12 C11 H11A 109.8 . . ?
C12 C11 H11B 109.8 . . ?
C11 C12 H12A 109.5 . . ?
C11 C12 H12B 109.5 . . ?
H12A C12 H12B 108.1 . . ?
O6 C12 C11 110.7(10) . . ?
O6 C12 H12A 109.5 . . ?
O6 C12 H12B 109.5 . . ?
C12 O6 Fe1 120.1(7) . . ?
C13 N3 Dy2 110.6(5) . . ?
C13 N3 C15 114.1(9) . . ?
C13 N3 C17 112.2(8) . . ?
C15 N3 Dy2 104.6(5) . . ?
C15 N3 C17 108.2(8) . . ?
C17 N3 Dy2 106.7(6) . . ?
N3 C13 H13A 109.2 . . ?
N3 C13 H13B 109.2 . . ?
N3 C13 C14 112.2(8) . . ?
H13A C13 H13B 107.9 . . ?
C14 C13 H13A 109.2 . . ?
C14 C13 H13B 109.2 . . ?
C13 C14 H14A 109.6 . . ?
C13 C14 H14B 109.6 . . ?
H14A C14 H14B 108.1 . . ?
O7 C14 C13 110.5(8) . . ?
O7 C14 H14A 109.6 . . ?
O7 C14 H14B 109.6 . . ?
Fe1 O7 Dy2 106.2(3) . . ?
C14 O7 Dy2 117.9(5) . . ?
C14 O7 Fe1 131.1(6) . . ?
N3 C15 H15A 109.5 . . ?
N3 C15 H15B 109.5 . . ?
N3 C15 C16 110.8(7) . . ?
H15A C15 H15B 108.1 . . ?
C16 C15 H15A 109.5 . . ?
C16 C15 H15B 109.5 . . ?
C15 C16 H16A 109.4 . . ?
C15 C16 H16B 109.4 . . ?
H16A C16 H16B 108.0 . . ?
O8 C16 C15 111.0(8) . . ?
O8 C16 H16A 109.4 . . ?
O8 C16 H16B 109.4 . . ?
Dy3 O8 Dy2 109.4(2) . . ?
C16 O8 Dy2 121.1(5) . . ?
C16 O8 Dy3 128.6(5) . . ?
N3 C17 H17A 109.1 . . ?
N3 C17 H17B 109.1 . . ?
N3 C17 C18 112.5(8) . . ?
H17A C17 H17B 107.8 . . ?
C18 C17 H17A 109.1 . . ?
C18 C17 H17B 109.1 . . ?
C17 C18 H18A 109.9 . . ?
C17 C18 H18B 109.9 . . ?
H18A C18 H18B 108.3 . . ?
O9 C18 C17 109.0(8) . . ?
O9 C18 H18A 109.9 . . ?
O9 C18 H18B 109.9 . . ?
Dy2 O9 H9 107(7) . . ?
C18 O9 Dy2 122.9(6) . . ?
C18 O9 H9 114(7) . . ?
C19 N4 Dy3 107.3(5) . . ?
C19 N4 C21 109.1(8) . . ?
C21 N4 Dy3 105.9(5) . . ?
C23 N4 Dy3 111.1(6) . . ?
C23 N4 C19 113.1(7) . . ?
C23 N4 C21 110.0(8) . . ?
N4 C19 H19A 109.0 . . ?
N4 C19 H19B 109.0 . . ?
N4 C19 C20 113.0(7) . . ?
H19A C19 H19B 107.8 . . ?
C20 C19 H19A 109.0 . . ?
C20 C19 H19B 109.0 . . ?
C19 C20 H20A 109.0 . . ?
C19 C20 H20B 109.0 . . ?
H20A C20 H20B 107.8 . . ?
O10 C20 C19 112.8(8) . . ?
O10 C20 H20A 109.0 . . ?
O10 C20 H20B 109.0 . . ?
Dy3 O10 Dy2 111.5(2) . . ?
C20 O10 Dy2 132.7(5) . . ?
C20 O10 Dy3 115.3(5) . . ?
N4 C21 H21A 108.9 . . ?
N4 C21 H21B 108.9 . . ?
H21A C21 H21B 107.7 . . ?
C22 C21 N4 113.2(8) . . ?
C22 C21 H21A 108.9 . . ?
C22 C21 H21B 108.9 . . ?
C21 C22 H22A 110.1 . . ?
C21 C22 H22B 110.1 . . ?
H22A C22 H22B 108.4 . . ?
O11 C22 C21 108.1(7) . . ?
O11 C22 H22A 110.1 . . ?
O11 C22 H22B 110.1 . . ?
Fe2 O11 Dy3 107.1(2) . . ?
C22 O11 Dy3 125.5(5) . . ?
C22 O11 Fe2 126.6(5) . . ?
N4 C23 H23A 109.4 . . ?
N4 C23 H23B 109.4 . . ?
N4 C23 C24 111.3(8) . . ?
H23A C23 H23B 108.0 . . ?
C24 C23 H23A 109.4 . . ?
C24 C23 H23B 109.4 . . ?
C23 C24 H24A 110.2 . . ?
C23 C24 H24B 110.2 . . ?
H24A C24 H24B 108.5 . . ?
O12 C24 C23 107.4(7) . . ?
O12 C24 H24A 110.2 . . ?
O12 C24 H24B 110.2 . . ?
Dy3 O12 H12 136(7) . . ?
C24 O12 Dy3 120.9(5) . . ?
C24 O12 H12 91(6) . . ?
C25 N5 Fe2 106.1(5) . . ?
C25 N5 C27 112.5(8) . . ?
C27 N5 Fe2 109.0(5) . . ?
C29 N5 Fe2 103.8(6) . . ?
C29 N5 C25 113.5(7) . . ?
C29 N5 C27 111.3(8) . . ?
N5 C25 H25A 110.4 . . ?
N5 C25 H25B 110.4 . . ?
N5 C25 C26 106.6(7) . . ?
H25A C25 H25B 108.6 . . ?
C26 C25 H25A 110.4 . . ?
C26 C25 H25B 110.4 . . ?
C25 C26 H26A 109.7 . . ?
C25 C26 H26B 109.7 . . ?
H26A C26 H26B 108.2 . . ?
O13 C26 C25 109.7(7) . . ?
O13 C26 H26A 109.7 . . ?
O13 C26 H26B 109.7 . . ?
Fe2 O13 Dy3 105.8(2) . . ?
C26 O13 Dy3 120.4(5) . . ?
C26 O13 Fe2 111.5(5) . . ?
N5 C27 H27A 108.6 . . ?
N5 C27 H27B 108.6 . . ?
H27A C27 H27B 107.6 . . ?
C28 C27 N5 114.6(8) . . ?
C28 C27 H27A 108.6 . . ?
C28 C27 H27B 108.6 . . ?
C27 C28 H28A 108.2 . . ?
C27 C28 H28B 108.2 . . ?
H28A C28 H28B 107.4 . . ?
O14 C28 C27 116.3(10) . . ?
O14 C28 H28A 108.2 . . ?
O14 C28 H28B 108.2 . . ?
Fe2 O14 Dy4 102.6(2) . . ?
C28 O14 Dy4 126.4(7) . . ?
C28 O14 Fe2 114.6(6) . . ?
N5 C29 H29A 110.2 . . ?
N5 C29 H29B 110.2 . . ?
N5 C29 C30 107.6(8) . . ?
H29A C29 H29B 108.5 . . ?
C30 C29 H29A 110.2 . . ?
C30 C29 H29B 110.2 . . ?
C29 C30 H30A 109.7 . . ?
C29 C30 H30B 109.7 . . ?
H30A C30 H30B 108.2 . . ?
O15 C30 C29 109.9(8) . . ?
O15 C30 H30A 109.7 . . ?
O15 C30 H30B 109.7 . . ?
C30 O15 Fe2 117.3(6) . . ?
C31A N6 Dy4 106.0(8) . . ?
C31B N6 Dy4 107.9(7) . . ?
C31B N6 C35B 109.5(10) . . ?
C33A N6 Dy4 106.2(8) . . ?
C33A N6 C31A 105.6(11) . . ?
C33B N6 Dy4 111.7(7) . . ?
C33B N6 C31B 112.5(11) . . ?
C33B N6 C35B 111.6(11) . . ?
C35A N6 Dy4 114.7(9) . . ?
C35A N6 C31A 110.7(13) . . ?
C35A N6 C33A 113.0(14) . . ?
C35B N6 Dy4 103.2(8) . . ?
N6 C31A H31A 109.6 . . ?
N6 C31A H31B 109.6 . . ?
H31A C31A H31B 108.1 . . ?
C32 C31A N6 110.4(12) . . ?
C32 C31A H31A 109.6 . . ?
C32 C31A H31B 109.6 . . ?
N6 C31B H31C 109.6 . . ?
N6 C31B H31D 109.6 . . ?
H31C C31B H31D 108.1 . . ?
C32 C31B N6 110.4(11) . . ?
C32 C31B H31C 109.6 . . ?
C32 C31B H31D 109.6 . . ?
C31A C32 H32A 107.7 . . ?
C31A C32 H32B 107.7 . . ?
C31B C32 H32C 109.2 . . ?
C31B C32 H32D 109.2 . . ?
H32A C32 H32B 107.1 . . ?
H32C C32 H32D 107.9 . . ?
O16 C32 C31A 118.5(11) . . ?
O16 C32 C31B 112.0(11) . . ?
O16 C32 H32A 107.7 . . ?
O16 C32 H32B 107.7 . . ?
O16 C32 H32C 109.2 . . ?
O16 C32 H32D 109.2 . . ?
Fe2 O16 Dy4 104.2(3) . . ?
C32 O16 Dy4 119.6(5) . . ?
C32 O16 Fe2 124.6(6) . . ?
N6 C33A H33A 108.8 . . ?
N6 C33A H33B 108.8 . . ?
H33A C33A H33B 107.7 . . ?
C34 C33A N6 113.6(11) . . ?
C34 C33A H33A 108.8 . . ?
C34 C33A H33B 108.8 . . ?
N6 C33B H33C 108.7 . . ?
N6 C33B H33D 108.7 . . ?
H33C C33B H33D 107.6 . . ?
C34 C33B N6 114.1(11) . . ?
C34 C33B H33C 108.7 . . ?
C34 C33B H33D 108.7 . . ?
C33A C34 H34A 108.5 . . ?
C33A C34 H34B 108.5 . . ?
C33B C34 H34C 109.4 . . ?
C33B C34 H34D 109.4 . . ?
H34A C34 H34B 107.5 . . ?
H34C C34 H34D 108.0 . . ?
O17 C34 C33A 115.1(10) . . ?
O17 C34 C33B 111.4(10) . . ?
O17 C34 H34A 108.5 . . ?
O17 C34 H34B 108.5 . . ?
O17 C34 H34C 109.4 . . ?
O17 C34 H34D 109.4 . . ?
Fe3 O17 Dy4 107.6(3) . . ?
C34 O17 Dy4 122.5(6) . . ?
C34 O17 Fe3 129.9(6) . . ?
N6 C35A H35A 109.3 . . ?
N6 C35A H35B 109.3 . . ?
H35A C35A H35B 108.0 . . ?
C36 C35A N6 111.6(13) . . ?
C36 C35A H35A 109.3 . . ?
C36 C35A H35B 109.3 . . ?
N6 C35B H35C 108.7 . . ?
N6 C35B H35D 108.7 . . ?
H35C C35B H35D 107.6 . . ?
C36 C35B N6 114.4(11) . . ?
C36 C35B H35C 108.7 . . ?
C36 C35B H35D 108.7 . . ?
C35A C36 H36A 109.0 . . ?
C35A C36 H36B 109.0 . . ?
C35B C36 H36C 108.9 . . ?
C35B C36 H36D 108.9 . . ?
C35B C36 O18 113.6(10) . . ?
H36A C36 H36B 107.8 . . ?
H36C C36 H36D 107.7 . . ?
O18 C36 C35A 112.8(12) . . ?
O18 C36 H36A 109.0 . . ?
O18 C36 H36B 109.0 . . ?
O18 C36 H36C 108.9 . . ?
O18 C36 H36D 108.9 . . ?
Dy4 O18 H18 118(5) . . ?
C36 O18 Dy4 118.7(6) . . ?
C36 O18 H18 93(5) . . ?
C37 N7 Fe3 106.5(5) . . ?
C37 N7 C39 112.8(8) . . ?
C39 N7 Fe3 108.4(5) . . ?
C41 N7 Fe3 102.9(6) . . ?
C41 N7 C37 113.7(7) . . ?
C41 N7 C39 111.7(8) . . ?
N7 C37 H37A 109.8 . . ?
N7 C37 H37B 109.8 . . ?
N7 C37 C38 109.3(7) . . ?
H37A C37 H37B 108.3 . . ?
C38 C37 H37A 109.8 . . ?
C38 C37 H37B 109.8 . . ?
C37 C38 H38A 110.1 . . ?
C37 C38 H38B 110.1 . . ?
H38A C38 H38B 108.4 . . ?
O19 C38 C37 108.0(7) . . ?
O19 C38 H38A 110.1 . . ?
O19 C38 H38B 110.1 . . ?
Fe3 O19 Dy4 106.7(2) . . ?
C38 O19 Dy4 121.9(5) . . ?
C38 O19 Fe3 115.9(5) . . ?
N7 C39 H39A 109.0 . . ?
N7 C39 H39B 109.0 . . ?
N7 C39 C40 113.1(7) . . ?
H39A C39 H39B 107.8 . . ?
C40 C39 H39A 109.0 . . ?
C40 C39 H39B 109.0 . . ?
C39 C40 H40A 109.5 . . ?
C39 C40 H40B 109.5 . . ?
H40A C40 H40B 108.1 . . ?
O20 C40 C39 110.8(8) . . ?
O20 C40 H40A 109.5 . . ?
O20 C40 H40B 109.5 . . ?
Fe3 O20 Dy5 105.3(2) . . ?
C40 O20 Dy5 134.5(5) . . ?
C40 O20 Fe3 118.7(5) . . ?
N7 C41 H41A 109.7 . . ?
N7 C41 H41B 109.7 . . ?
N7 C41 C42 109.9(8) . . ?
H41A C41 H41B 108.2 . . ?
C42 C41 H41A 109.7 . . ?
C42 C41 H41B 109.7 . . ?
C41 C42 H42A 109.2 . . ?
C41 C42 H42B 109.2 . . ?
H42A C42 H42B 107.9 . . ?
O21 C42 C41 112.1(9) . . ?
O21 C42 H42A 109.2 . . ?
O21 C42 H42B 109.2 . . ?
C42 O21 Fe3 117.7(6) . . ?
C43 N8 Dy5 109.7(5) . . ?
C43 N8 C45 112.1(7) . . ?
C43 N8 C47 109.9(7) . . ?
C45 N8 Dy5 106.8(5) . . ?
C45 N8 C47 110.9(7) . . ?
C47 N8 Dy5 107.4(5) . . ?
N8 C43 H43A 108.9 . . ?
N8 C43 H43B 108.9 . . ?
N8 C43 C44 113.5(7) . . ?
H43A C43 H43B 107.7 . . ?
C44 C43 H43A 108.9 . . ?
C44 C43 H43B 108.9 . . ?
C43 C44 H44A 109.7 . . ?
C43 C44 H44B 109.7 . . ?
H44A C44 H44B 108.2 . . ?
O22 C44 C43 109.8(7) . . ?
O22 C44 H44A 109.7 . . ?
O22 C44 H44B 109.7 . . ?
Fe3 O22 Dy5 107.3(2) . . ?
C44 O22 Dy5 118.8(5) . . ?
C44 O22 Fe3 130.8(6) . . ?
N8 C45 H45A 109.6 . . ?
N8 C45 H45B 109.6 . . ?
N8 C45 C46 110.3(8) . . ?
H45A C45 H45B 108.1 . . ?
C46 C45 H45A 109.6 . . ?
C46 C45 H45B 109.6 . . ?
C45 C46 H46A 109.8 . . ?
C45 C46 H46B 109.8 . . ?
H46A C46 H46B 108.3 . . ?
O23 C46 C45 109.3(7) . . ?
O23 C46 H46A 109.8 . . ?
O23 C46 H46B 109.8 . . ?
Dy6 O23 Dy5 111.0(3) . . ?
C46 O23 Dy5 124.1(6) . . ?
C46 O23 Dy6 124.2(6) . . ?
N8 C47 H47A 109.0 . . ?
N8 C47 H47B 109.0 . . ?
H47A C47 H47B 107.8 . . ?
C48 C47 N8 112.8(7) . . ?
C48 C47 H47A 109.0 . . ?
C48 C47 H47B 109.0 . . ?
C47 C48 H48A 109.5 . . ?
C47 C48 H48B 109.5 . . ?
H48A C48 H48B 108.1 . . ?
O24 C48 C47 110.7(8) . . ?
O24 C48 H48A 109.5 . . ?
O24 C48 H48B 109.5 . . ?
Dy5 O24 H24 93(5) . . ?
C48 O24 Dy5 122.2(5) . . ?
C48 O24 H24 105(6) . . ?
C49 N9 Dy6 106.8(5) . . ?
C51 N9 Dy6 104.4(6) . . ?
C51 N9 C49 116.7(8) . . ?
C51 N9 C53 107.3(8) . . ?
C53 N9 Dy6 110.9(6) . . ?
C53 N9 C49 110.5(8) . . ?
N9 C49 H49A 108.7 . . ?
N9 C49 H49B 108.7 . . ?
N9 C49 C50 114.1(7) . . ?
H49A C49 H49B 107.6 . . ?
C50 C49 H49A 108.7 . . ?
C50 C49 H49B 108.7 . . ?
C49 C50 H50A 109.8 . . ?
C49 C50 H50B 109.8 . . ?
H50A C50 H50B 108.2 . . ?
O25 C50 C49 109.4(7) . . ?
O25 C50 H50A 109.8 . . ?
O25 C50 H50B 109.8 . . ?
Dy6 O25 Dy5 110.3(2) . . ?
C50 O25 Dy5 135.0(5) . . ?
C50 O25 Dy6 114.2(5) . . ?
N9 C51 H51A 109.2 . . ?
N9 C51 H51B 109.2 . . ?
N9 C51 C52 112.1(9) . . ?
H51A C51 H51B 107.9 . . ?
C52 C51 H51A 109.2 . . ?
C52 C51 H51B 109.2 . . ?
C51 C52 H52A 109.6 . . ?
C51 C52 H52B 109.6 . . ?
H52A C52 H52B 108.1 . . ?
O26 C52 C51 110.4(9) . . ?
O26 C52 H52A 109.6 . . ?
O26 C52 H52B 109.6 . . ?
Fe4 O26 Dy6 106.4(3) . . ?
C52 O26 Dy6 123.3(6) . . ?
C52 O26 Fe4 130.2(6) . . ?
N9 C53 H53A 109.3 . . ?
N9 C53 H53B 109.3 . . ?
N9 C53 C54 111.6(9) . . ?
H53A C53 H53B 108.0 . . ?
C54 C53 H53A 109.3 . . ?
C54 C53 H53B 109.3 . . ?
C53 C54 H54A 109.5 . . ?
C53 C54 H54B 109.5 . . ?
H54A C54 H54B 108.1 . . ?
O27 C54 C53 110.7(9) . . ?
O27 C54 H54A 109.5 . . ?
O27 C54 H54B 109.5 . . ?
Dy6 O27 H27 120(6) . . ?
C54 O27 Dy6 120.7(6) . . ?
C54 O27 H27 96(8) . . ?
C55 N10 Fe4 106.0(6) . . ?
C55 N10 C57 112.0(8) . . ?
C57 N10 Fe4 108.2(6) . . ?
C59 N10 Fe4 101.3(7) . . ?
C59 N10 C55 116.1(8) . . ?
C59 N10 C57 112.2(8) . . ?
N10 C55 H55A 109.6 . . ?
N10 C55 H55B 109.6 . . ?
N10 C55 C56 110.3(8) . . ?
H55A C55 H55B 108.1 . . ?
C56 C55 H55A 109.6 . . ?
C56 C55 H55B 109.6 . . ?
C55 C56 H56A 110.0 . . ?
C55 C56 H56B 110.0 . . ?
H56A C56 H56B 108.4 . . ?
O28 C56 C55 108.6(8) . . ?
O28 C56 H56A 110.0 . . ?
O28 C56 H56B 110.0 . . ?
Fe4 O28 Dy6 106.5(3) . . ?
C56 O28 Dy6 122.1(5) . . ?
C56 O28 Fe4 112.7(5) . . ?
N10 C57 H57A 109.1 . . ?
N10 C57 H57B 109.1 . . ?
N10 C57 C58 112.6(9) . . ?
H57A C57 H57B 107.8 . . ?
C58 C57 H57A 109.1 . . ?
C58 C57 H57B 109.1 . . ?
C57 C58 H58A 109.6 . . ?
C57 C58 H58B 109.6 . . ?
H58A C58 H58B 108.1 . . ?
O29 C58 C57 110.4(9) . . ?
O29 C58 H58A 109.6 . . ?
O29 C58 H58B 109.6 . . ?
Fe4 O29 Dy1 104.0(3) . 16 ?
C58 O29 Dy1 136.9(6) . 16 ?
C58 O29 Fe4 117.7(6) . . ?
N10 C59 H59A 109.5 . . ?
N10 C59 H59B 109.5 . . ?
N10 C59 C60 110.8(9) . . ?
H59A C59 H59B 108.1 . . ?
C60 C59 H59A 109.5 . . ?
C60 C59 H59B 109.5 . . ?
C59 C60 H60A 109.5 . . ?
C59 C60 H60B 109.5 . . ?
H60A C60 H60B 108.1 . . ?
O30 C60 C59 110.5(9) . . ?
O30 C60 H60A 109.5 . . ?
O30 C60 H60B 109.5 . . ?
C60 O30 Fe4 118.1(7) . . ?
O31 N11 Dy1 59.6(5) . . ?
O32 N11 Dy1 56.7(5) . . ?
O32 N11 O31 116.3(9) . . ?
O33 N11 Dy1 176.8(8) . . ?
O33 N11 O31 120.8(9) . . ?
O33 N11 O32 122.8(10) . . ?
N11 O31 Dy1 94.6(6) . . ?
N11 O32 Dy1 98.2(6) . . ?
O34 N12 Dy2 59.6(5) . . ?
O35 N12 Dy2 59.2(5) . . ?
O35 N12 O34 117.4(9) . . ?
O36 N12 Dy2 166.5(8) . . ?
O36 N12 O34 121.3(11) . . ?
O36 N12 O35 121.3(10) . . ?
N12 O34 Dy2 94.4(6) . . ?
N12 O35 Dy2 94.7(5) . . ?
O37 N13 Dy3 57.9(4) . . ?
O38 N13 Dy3 57.6(4) . . ?
O38 N13 O37 115.2(7) . . ?
O39 N13 Dy3 175.8(6) . . ?
O39 N13 O37 122.5(8) . . ?
O39 N13 O38 122.3(8) . . ?
N13 O37 Dy3 96.2(5) . . ?
N13 O38 Dy3 96.8(5) . . ?
O40 N14 Dy4 60.2(4) . . ?
O40 N14 O41 117.3(7) . . ?
O41 N14 Dy4 57.3(4) . . ?
O42 N14 Dy4 176.8(7) . . ?
O42 N14 O40 121.1(9) . . ?
O42 N14 O41 121.5(9) . . ?
N14 O40 Dy4 93.5(5) . . ?
N14 O41 Dy4 96.8(5) . . ?
O43 N15 Dy5 61.5(4) . . ?
O43 N15 O44 118.7(7) . . ?
O44 N15 Dy5 57.9(4) . . ?
O45 N15 Dy5 165.4(7) . . ?
O45 N15 O43 121.3(8) . . ?
O45 N15 O44 119.7(8) . . ?
N15 O43 Dy5 92.5(4) . . ?
N15 O44 Dy5 96.2(5) . . ?
O46 N16 Dy6 59.4(5) . . ?
O46 N16 O47 118.6(8) . . ?
O47 N16 Dy6 59.2(5) . . ?
O48 N16 Dy6 176.2(7) . . ?
O48 N16 O46 121.0(9) . . ?
O48 N16 O47 120.4(10) . . ?
N16 O46 Dy6 95.3(6) . . ?
N16 O47 Dy6 94.8(6) . . ?
N71 C71 C72 178.5(16) . . ?
C71 C72 H72A 109.5 . . ?
C71 C72 H72B 109.5 . . ?
C71 C72 H72C 109.5 . . ?
H72A C72 H72B 109.5 . . ?
H72A C72 H72C 109.5 . . ?
H72B C72 H72C 109.5 . . ?
N72 C73 C74 170(3) . . ?
C73 C74 H74A 109.5 . . ?
C73 C74 H74B 109.5 . . ?
C73 C74 H74C 109.5 . . ?
H74A C74 H74B 109.5 . . ?
H74A C74 H74C 109.5 . . ?
H74B C74 H74C 109.5 . . ?
C81 O81 H81 109.5 . . ?
O81 C81 H81A 109.5 . . ?
O81 C81 H81B 109.5 . . ?
O81 C81 H81C 109.5 . . ?
H81A C81 H81B 109.5 . . ?
H81A C81 H81C 109.5 . . ?
H81B C81 H81C 109.5 . . ?

loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_site_symmetry_A
_geom_hbond_publ_flag
O3 H3 O30 0.98(3) 1.63(3) 2.581(10) 165(11) 16 yes
O9 H9 O6 0.97(4) 1.60(4) 2.486(11) 149(7) . yes
O12 H12 O43 0.91(3) 2.14(3) 2.990(8) 154(7) 17_666 yes
O18 H18 O15 0.98(4) 1.64(4) 2.529(9) 148(7) . yes
O24 H24 O21 0.97(3) 1.63(3) 2.559(9) 158(8) . yes
O27 H27 O44 0.94(4) 2.16(4) 2.986(10) 145(7) . yes
O81 H81 O9 0.84 1.94 2.737(15) 157.7 . yes

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_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
Dy1 N1 C1 C2 -51.4(10) . . . . ?
Dy1 N1 C3 C4 -47.7(13) . . . . ?
Dy1 N1 C5 C6 -25.2(13) . . . . ?
Dy2 N3 C13 C14 -24.4(10) . . . . ?
Dy2 N3 C15 C16 48.7(9) . . . . ?
Dy2 N3 C17 C18 -52.4(10) . . . . ?
Dy3 N4 C19 C20 20.2(9) . . . . ?
Dy3 N4 C21 C22 -47.4(10) . . . . ?
Dy3 N4 C23 C24 47.6(9) . . . . ?
Dy4 N6 C31A C32 42.5(17) . . . . ?
Dy4 N6 C31B C32 -38.7(14) . . . . ?
Dy4 N6 C33A C34 40.3(16) . . . . ?
Dy4 N6 C33B C34 -19.1(17) . . . . ?
Dy4 N6 C35A C36 21(2) . . . . ?
Dy4 N6 C35B C36 -52.1(14) . . . . ?
Dy5 N8 C43 C44 22.9(9) . . . . ?
Dy5 N8 C45 C46 -47.4(9) . . . . ?
Dy5 N8 C47 C48 50.4(9) . . . . ?
Dy6 N9 C49 C50 -24.5(9) . . . . ?
Dy6 N9 C51 C52 48.4(9) . . . . ?
Dy6 N9 C53 C54 -49.2(10) . . . . ?
Fe1 N2 C7 C8 28.9(12) . . . . ?
Fe1 N2 C9 C10 -37.7(10) . . . . ?
Fe1 N2 C11 C12 -45.5(13) . . . . ?
Fe2 N5 C25 C26 38.5(8) . . . . ?
Fe2 N5 C27 C28 3.7(14) . . . . ?
Fe2 N5 C29 C30 -49.0(9) . . . . ?
Fe3 N7 C37 C38 -33.2(8) . . . . ?
Fe3 N7 C39 C40 27.7(11) . . . . ?
Fe3 N7 C41 C42 45.8(9) . . . . ?
Fe4 N10 C55 C56 -33.7(9) . . . . ?
Fe4 N10 C57 C58 30.4(10) . . . . ?
Fe4 N10 C59 C60 45.5(9) . . . . ?
N1 C1 C2 O1 49.6(13) . . . . ?
N1 C3 C4 O2 35.0(16) . . . . ?
N1 C5 C6 O3 49.7(15) . . . . ?
C1 N1 C3 C4 66.1(13) . . . . ?
C1 N1 C5 C6 -143.2(11) . . . . ?
C1 C2 O1 Dy1 -21.4(13) . . . . ?
C1 C2 O1 Fe4 -155.2(8) . . . 16 ?
C3 N1 C1 C2 -165.4(9) . . . . ?
C3 N1 C5 C6 94.3(14) . . . . ?
C3 C4 O2 Dy1 -0.5(15) . . . . ?
C3 C4 O2 Fe1 -175.4(8) . . . . ?
C5 N1 C1 C2 70.6(13) . . . . ?
C5 N1 C3 C4 -170.7(12) . . . . ?
C5 C6 O3 Dy1 -50.1(12) . . . . ?
N2 C7 C8 O4 -48.7(13) . . . . ?
N2 C9 C10 O5 44.6(12) . . . . ?
N2 C11 C12 O6 36.1(18) . . . . ?
C7 N2 C9 C10 81.7(11) . . . . ?
C7 N2 C11 C12 -161.2(11) . . . . ?
C7 C8 O4 Dy1 -86.1(9) . . . . ?
C7 C8 O4 Fe1 45.8(10) . . . . ?
C9 N2 C7 C8 -90.7(11) . . . . ?
C9 N2 C11 C12 68.1(14) . . . . ?
C9 C10 O5 Dy2 125.3(8) . . . . ?
C9 C10 O5 Fe1 -30.7(11) . . . . ?
C11 N2 C7 C8 142.1(11) . . . . ?
C11 N2 C9 C10 -147.8(10) . . . . ?
C11 C12 O6 Fe1 -4.7(16) . . . . ?
N3 C13 C14 O7 46.5(11) . . . . ?
N3 C15 C16 O8 -50.9(11) . . . . ?
N3 C17 C18 O9 44.0(13) . . . . ?
C13 N3 C15 C16 -72.2(10) . . . . ?
C13 N3 C17 C18 68.8(11) . . . . ?
C13 C14 O7 Dy2 -48.1(9) . . . . ?
C13 C14 O7 Fe1 103.9(8) . . . . ?
C15 N3 C13 C14 93.1(9) . . . . ?
C15 N3 C17 C18 -164.5(9) . . . . ?
C15 C16 O8 Dy2 24.5(10) . . . . ?
C15 C16 O8 Dy3 -143.0(6) . . . . ?
C17 N3 C13 C14 -143.4(9) . . . . ?
C17 N3 C15 C16 162.1(9) . . . . ?
C17 C18 O9 Dy2 -11.6(12) . . . . ?
N4 C19 C20 O10 -46.1(10) . . . . ?
N4 C21 C22 O11 46.4(12) . . . . ?
N4 C23 C24 O12 -53.5(11) . . . . ?
C19 N4 C21 C22 67.8(10) . . . . ?
C19 N4 C23 C24 -73.2(10) . . . . ?
C19 C20 O10 Dy2 -119.6(8) . . . . ?
C19 C20 O10 Dy3 51.2(9) . . . . ?
C21 N4 C19 C20 -94.1(9) . . . . ?
C21 N4 C23 C24 164.6(8) . . . . ?
C21 C22 O11 Dy3 -21.3(11) . . . . ?
C21 C22 O11 Fe2 147.5(7) . . . . ?
C23 N4 C19 C20 143.1(8) . . . . ?
C23 N4 C21 C22 -167.6(9) . . . . ?
C23 C24 O12 Dy3 34.2(10) . . . . ?
N5 C25 C26 O13 -55.8(10) . . . . ?
N5 C27 C28 O14 -20.5(19) . . . . ?
N5 C29 C30 O15 43.4(12) . . . . ?
C25 N5 C27 C28 121.1(12) . . . . ?
C25 N5 C29 C30 -163.7(9) . . . . ?
C25 C26 O13 Dy3 -80.7(8) . . . . ?
C25 C26 O13 Fe2 44.1(8) . . . . ?
C27 N5 C25 C26 -80.6(9) . . . . ?
C27 N5 C29 C30 68.2(11) . . . . ?
C27 C28 O14 Dy4 157.5(10) . . . . ?
C27 C28 O14 Fe2 28.1(17) . . . . ?
C29 N5 C25 C26 151.9(8) . . . . ?
C29 N5 C27 C28 -110.2(12) . . . . ?
C29 C30 O15 Fe2 -14.6(12) . . . . ?
N6 C31A C32 O16 -36(2) . . . . ?
N6 C31B C32 O16 51.6(16) . . . . ?
N6 C33A C34 O17 -24.9(19) . . . . ?
N6 C33B C34 O17 37.1(18) . . . . ?
N6 C35A C36 O18 -41(2) . . . . ?
N6 C35B C36 O18 36.4(18) . . . . ?
C31A N6 C33A C34 -72.0(18) . . . . ?
C31A N6 C35A C36 141.3(17) . . . . ?
C31A C32 O16 Dy4 8.3(15) . . . . ?
C31A C32 O16 Fe2 145.5(12) . . . . ?
C31B N6 C33B C34 -140.6(13) . . . . ?
C31B N6 C35B C36 62.6(17) . . . . ?
C31B C32 O16 Dy4 -39.4(12) . . . . ?
C31B C32 O16 Fe2 97.7(11) . . . . ?
C33A N6 C31A C32 154.9(14) . . . . ?
C33A N6 C35A C36 -101(2) . . . . ?
C33A C34 O17 Dy4 -8.0(15) . . . . ?
C33A C34 O17 Fe3 174.1(10) . . . . ?
C33B N6 C31B C32 85.0(16) . . . . ?
C33B N6 C35B C36 -172.2(12) . . . . ?
C33B C34 O17 Dy4 -41.3(14) . . . . ?
C33B C34 O17 Fe3 140.8(10) . . . . ?
C35A N6 C31A C32 -82.5(19) . . . . ?
C35A N6 C33A C34 166.9(14) . . . . ?
C35A C36 O18 Dy4 43.4(15) . . . . ?
C35B N6 C31B C32 -150.3(12) . . . . ?
C35B N6 C33B C34 95.8(16) . . . . ?
C35B C36 O18 Dy4 2.0(14) . . . . ?
N7 C37 C38 O19 49.6(9) . . . . ?
N7 C39 C40 O20 -36.1(12) . . . . ?
N7 C41 C42 O21 -40.3(14) . . . . ?
C37 N7 C39 C40 -90.1(10) . . . . ?
C37 N7 C41 C42 160.6(8) . . . . ?
C37 C38 O19 Dy4 89.8(7) . . . . ?
C37 C38 O19 Fe3 -43.0(8) . . . . ?
C39 N7 C37 C38 85.6(8) . . . . ?
C39 N7 C41 C42 -70.3(11) . . . . ?
C39 C40 O20 Dy5 -136.0(7) . . . . ?
C39 C40 O20 Fe3 27.6(10) . . . . ?
C41 N7 C37 C38 -145.9(8) . . . . ?
C41 N7 C39 C40 140.4(9) . . . . ?
C41 C42 O21 Fe3 10.8(13) . . . . ?
N8 C43 C44 O22 -44.5(10) . . . . ?
N8 C45 C46 O23 48.8(11) . . . . ?
N8 C47 C48 O24 -42.3(11) . . . . ?
C43 N8 C45 C46 72.7(9) . . . . ?
C43 N8 C47 C48 -68.9(9) . . . . ?
C43 C44 O22 Dy5 47.2(9) . . . . ?
C43 C44 O22 Fe3 -110.1(8) . . . . ?
C45 N8 C43 C44 -95.6(9) . . . . ?
C45 N8 C47 C48 166.7(8) . . . . ?
C45 C46 O23 Dy5 -25.0(11) . . . . ?
C45 C46 O23 Dy6 144.1(6) . . . . ?
C47 N8 C43 C44 140.7(8) . . . . ?
C47 N8 C45 C46 -164.1(8) . . . . ?
C47 C48 O24 Dy5 11.2(10) . . . . ?
N9 C49 C50 O25 51.5(10) . . . . ?
N9 C51 C52 O26 -48.0(12) . . . . ?
N9 C53 C54 O27 46.5(12) . . . . ?
C49 N9 C51 C52 -69.3(11) . . . . ?
C49 N9 C53 C54 69.1(11) . . . . ?
C49 C50 O25 Dy5 117.5(8) . . . . ?
C49 C50 O25 Dy6 -53.4(8) . . . . ?
C51 N9 C49 C50 91.8(10) . . . . ?
C51 N9 C53 C54 -162.6(9) . . . . ?
C51 C52 O26 Dy6 20.3(12) . . . . ?
C51 C52 O26 Fe4 -155.1(7) . . . . ?
C53 N9 C49 C50 -145.2(8) . . . . ?
C53 N9 C51 C52 166.1(9) . . . . ?
C53 C54 O27 Dy6 -21.2(11) . . . . ?
N10 C55 C56 O28 50.4(11) . . . . ?
N10 C57 C58 O29 -38.9(12) . . . . ?
N10 C59 C60 O30 -37.8(13) . . . . ?
C55 N10 C57 C58 -86.0(11) . . . . ?
C55 N10 C59 C60 159.8(9) . . . . ?
C55 C56 O28 Dy6 87.0(8) . . . . ?
C55 C56 O28 Fe4 -41.7(9) . . . . ?
C57 N10 C55 C56 84.1(10) . . . . ?
C57 N10 C59 C60 -69.6(12) . . . . ?
C57 C58 O29 Dy1 -135.3(8) . . . 16 ?
C57 C58 O29 Fe4 28.6(11) . . . . ?
C59 N10 C55 C56 -145.2(9) . . . . ?
C59 N10 C57 C58 141.3(10) . . . . ?
C59 C60 O30 Fe4 6.8(12) . . . . ?
O31 N11 O32 Dy1 -0.6(10) . . . . ?
O32 N11 O31 Dy1 0.6(9) . . . . ?
O33 N11 O31 Dy1 -176.3(9) . . . . ?
O33 N11 O32 Dy1 176.2(10) . . . . ?
O34 N12 O35 Dy2 -13.6(9) . . . . ?
O35 N12 O34 Dy2 13.6(9) . . . . ?
O36 N12 O34 Dy2 -164.3(9) . . . . ?
O36 N12 O35 Dy2 164.2(9) . . . . ?
O37 N13 O38 Dy3 6.2(7) . . . . ?
O38 N13 O37 Dy3 -6.2(7) . . . . ?
O39 N13 O37 Dy3 175.1(7) . . . . ?
O39 N13 O38 Dy3 -175.1(7) . . . . ?
O40 N14 O41 Dy4 5.0(8) . . . . ?
O41 N14 O40 Dy4 -4.8(7) . . . . ?
O42 N14 O40 Dy4 176.6(7) . . . . ?
O42 N14 O41 Dy4 -176.5(7) . . . . ?
O43 N15 O44 Dy5 10.2(8) . . . . ?
O44 N15 O43 Dy5 -9.8(8) . . . . ?
O45 N15 O43 Dy5 163.5(8) . . . . ?
O45 N15 O44 Dy5 -163.2(8) . . . . ?
O46 N16 O47 Dy6 1.8(9) . . . . ?
O47 N16 O46 Dy6 -1.7(9) . . . . ?
O48 N16 O46 Dy6 175.6(8) . . . . ?
O48 N16 O47 Dy6 -175.6(8) . . . . ?

# start Validation Reply Form
_vrf_PLAT417_p60302_sq           
;
PROBLEM: Short Inter D-H..H-D       H9       ..H81      .       1.92 Ang.  
RESPONSE: H81 is involved in a rather short H-bond between O81 and O9,
and H9 is similarly involved in an even shorter H-bond between O9 and O6.
;
# end Validation Reply Form

_platon_squeeze_void_probe_radius 1.20
_olex2_submission_special_instructions 'No special instructions were received'
_exptl_crystal_preparation       'Magnetic properties'
