#------------------------------------------------------------------------------
#$Date: 2019-11-24 12:53:08 +0200 (Sun, 24 Nov 2019) $
#$Revision: 237947 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/35/00/4350022.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_4350022
loop_
_publ_author_name
'Litvinova, Yulia M.'
'Gayfulin, Yakov M.'
'van Leusen, Jan'
'Samsonenko, Denis G.'
'Lazarenko, Vladimir A.'
'Zubavichus, Yan V.'
'Kögerler, Paul'
'Mironov, Yuri V.'
_publ_section_title
;
 Metal--organic frameworks based on polynuclear lanthanide complexes and
 octahedral rhenium clusters
;
_journal_issue                   6
_journal_name_full               'Inorganic Chemistry Frontiers'
_journal_page_first              1518
_journal_paper_doi               10.1039/C9QI00339H
_journal_volume                  6
_journal_year                    2019
_chemical_formula_sum            'C30 H38 Dy4 N10 O21 Re6 S8'
_chemical_formula_weight         2898.38
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2yn'
_space_group_name_H-M_alt        'P 1 21/n 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     dual
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-2018/3
_audit_update_record
;
2019-03-27 deposited with the CCDC.	2019-05-06 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 110.565(3)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   22.5236(7)
_cell_length_b                   12.3713(3)
_cell_length_c                   23.4758(7)
_cell_measurement_reflns_used    17637
_cell_measurement_temperature    130(2)
_cell_measurement_theta_max      29.18
_cell_measurement_theta_min      3.63
_cell_volume                     6124.6(3)
_computing_cell_refinement       'CrysAlisPro 1.171.38.46 (Rigaku OD, 2015)'
_computing_data_collection       'CrysAlisPro 1.171.38.46 (Rigaku OD, 2015)'
_computing_data_reduction        'CrysAlisPro 1.171.38.46 (Rigaku OD, 2015)'
_computing_molecular_graphics    'ShelXle (Hübschle, 2011)'
_computing_publication_material  'CIFTAB (Sheldrick, 2015)'
_computing_structure_refinement  'SHELXL-2018 (Sheldrick, 2015)'
_computing_structure_solution    'SHELXT-2018 (Sheldrick, 2015)'
_diffrn_ambient_temperature      130(2)
_diffrn_detector                 'CCD plate'
_diffrn_detector_area_resol_mean 10.6
_diffrn_detector_type            AtlasS2
_diffrn_measured_fraction_theta_full 0.995
_diffrn_measured_fraction_theta_max 0.995
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'New Xcalibur, AtlasS2'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_probe          x-ray
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0336
_diffrn_reflns_av_unetI/netI     0.0384
_diffrn_reflns_Laue_measured_fraction_full 0.995
_diffrn_reflns_Laue_measured_fraction_max 0.995
_diffrn_reflns_limit_h_max       27
_diffrn_reflns_limit_h_min       -23
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -11
_diffrn_reflns_limit_l_max       26
_diffrn_reflns_limit_l_min       -28
_diffrn_reflns_number            33174
_diffrn_reflns_point_group_measured_fraction_full 0.995
_diffrn_reflns_point_group_measured_fraction_max 0.995
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         25.348
_diffrn_reflns_theta_min         3.282
_diffrn_source                   'sealed X-ray tube'
_exptl_absorpt_coefficient_mu    16.961
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.34839
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlisPro 1.171.38.46 (Rigaku Oxford Diffraction, 2015)
Empirical absorption correction using spherical harmonics,
implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    3.143
_exptl_crystal_description       stick
_exptl_crystal_F_000             5192
_exptl_crystal_preparation       'Magnetic properties'
_exptl_crystal_size_max          0.18
_exptl_crystal_size_mid          0.09
_exptl_crystal_size_min          0.08
_refine_diff_density_max         2.621
_refine_diff_density_min         -2.995
_refine_diff_density_rms         0.402
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.288
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     847
_refine_ls_number_reflns         11148
_refine_ls_number_restraints     677
_refine_ls_restrained_S_all      1.256
_refine_ls_R_factor_all          0.0679
_refine_ls_R_factor_gt           0.0617
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+596.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1303
_refine_ls_wR_factor_ref         0.1321
_reflns_Friedel_coverage         0.000
_reflns_number_gt                10148
_reflns_number_total             11148
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            c9qi00339h2.cif
_cod_data_source_block           lit74Dy
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               4350022
_shelx_shelxl_version_number     2018/3
_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_min   0.150
_shelx_estimated_absorpt_t_max   0.344
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_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
Re1 Re 0.30632(4) 1.09207(6) 0.57279(3) 0.01162(17) Uani 1 1 d . U . . .
Re2 Re 0.32770(4) 1.29767(6) 0.58825(3) 0.01105(17) Uani 1 1 d . U . . .
Re3 Re 0.23011(3) 1.33756(6) 0.49139(3) 0.00925(16) Uani 1 1 d . U . . .
Re4 Re 0.20859(3) 1.13104(6) 0.47569(3) 0.00904(16) Uani 1 1 d . U . . .
Re5 Re 0.31928(3) 1.20906(6) 0.48560(3) 0.00876(16) Uani 1 1 d . U . . .
Re6 Re 0.21721(4) 1.22127(6) 0.57816(3) 0.01205(17) Uani 1 1 d . U . . .
S1 S 0.4055(2) 1.1725(4) 0.5791(2) 0.0160(10) Uani 1 1 d . . . . .
S2 S 0.3350(2) 1.3996(4) 0.5042(2) 0.0123(10) Uani 1 1 d . . . . .
S3 S 0.2250(2) 1.2451(4) 0.39956(19) 0.0102(9) Uani 1 1 d . . . . .
S4 S 0.2960(2) 1.0187(4) 0.4750(2) 0.0139(10) Uani 1 1 d . . . . .
S5 S 0.3114(3) 1.1850(4) 0.6646(2) 0.0211(12) Uani 1 1 d . . . . .
S6 S 0.2418(2) 1.4104(4) 0.5895(2) 0.0164(10) Uani 1 1 d . . . . .
S7 S 0.1311(2) 1.2565(4) 0.4852(2) 0.0158(10) Uani 1 1 d . . . . .
S8 S 0.2010(2) 1.0303(4) 0.5603(2) 0.0154(10) Uani 1 1 d . . . . .
C1 C 0.3504(9) 0.9562(17) 0.6237(9) 0.017(3) Uani 1 1 d . U . . .
N1 N 0.3755(8) 0.8856(14) 0.6555(8) 0.020(3) Uani 1 1 d . U . . .
C2 C 0.3960(10) 1.3911(17) 0.6537(9) 0.018(3) Uani 1 1 d . U . . .
N2 N 0.4330(9) 1.4430(15) 0.6879(8) 0.022(3) Uani 1 1 d . U . . .
C3 C 0.1872(9) 1.4826(15) 0.4484(8) 0.0105(16) Uani 1 1 d . U . . .
N3 N 0.1625(7) 1.5606(13) 0.4257(7) 0.013(2) Uani 1 1 d . U . . .
C4 C 0.1365(9) 1.0387(16) 0.4104(9) 0.014(3) Uani 1 1 d . U . . .
N4 N 0.0956(8) 0.9939(14) 0.3752(7) 0.017(3) Uani 1 1 d . U . . .
C5 C 0.3790(9) 1.2129(16) 0.4333(9) 0.014(3) Uani 1 1 d . U . . .
N5 N 0.4127(8) 1.2255(14) 0.4060(7) 0.017(3) Uani 1 1 d . U . . .
C6 C 0.1566(10) 1.2349(18) 0.6286(10) 0.021(3) Uani 1 1 d . U . . .
N6 N 0.1249(9) 1.2508(17) 0.6571(9) 0.030(4) Uani 1 1 d . U . . .
Dy1 Dy 0.41280(5) 0.78868(9) 0.75421(4) 0.0199(2) Uani 1 1 d . U . . .
Dy2 Dy 0.50952(4) 0.54101(7) 0.77730(4) 0.01083(19) Uani 1 1 d . U . . .
Dy3 Dy 0.53610(4) 0.75338(7) 0.67589(4) 0.01218(19) Uani 1 1 d . U . . .
Dy4 Dy 0.59008(4) 0.80696(8) 0.84603(4) 0.0146(2) Uani 1 1 d D U . . .
O1 O 0.4571(6) 0.6683(11) 0.7019(6) 0.0124(19) Uani 1 1 d . U . . .
H1 H 0.424101 0.634202 0.665962 0.015 Uiso 1 1 calc R U . . .
O2 O 0.4965(6) 0.7001(11) 0.8272(6) 0.015(2) Uani 1 1 d . U . . .
H2 H 0.487493 0.684609 0.865224 0.017 Uiso 1 1 calc R U . . .
O3 O 0.5087(6) 0.8529(11) 0.7474(6) 0.015(2) Uani 1 1 d . U . . .
H3 H 0.507156 0.932266 0.738997 0.018 Uiso 1 1 calc R U . . .
O4 O 0.5832(6) 0.6752(11) 0.7745(6) 0.0117(19) Uani 1 1 d . U . . .
H4 H 0.625697 0.643236 0.780090 0.014 Uiso 1 1 calc R U . . .
O1M O 0.4518(8) 0.7247(15) 0.5823(8) 0.036(4) Uani 1 1 d . . . . .
O2M O 0.5122(9) 0.9359(14) 0.6363(8) 0.035(4) Uani 1 1 d . . . . .
O3M O 0.6894(7) 0.7143(15) 0.8904(8) 0.023(4) Uani 0.8 1 d D U P A 1
O4M O 0.5929(10) 0.738(3) 0.9420(8) 0.039(7) Uani 0.8 1 d D U P A 1
O3M' O 0.6990(12) 0.763(6) 0.865(3) 0.021(7) Uani 0.2 1 d D U P A 2
O4M' O 0.619(5) 0.730(12) 0.946(3) 0.037(10) Uani 0.2 1 d D U P A 2
O1A O 0.0844(8) 1.0181(16) 0.7004(9) 0.043(4) Uani 1 1 d . U . . .
O2A O 0.1505(10) 1.1436(19) 0.7672(11) 0.060(5) Uani 1 1 d . U . . .
C1A C 0.1379(13) 1.059(3) 0.7336(16) 0.053(4) Uani 1 1 d D U . . .
C2A C 0.1960(10) 0.996(2) 0.7337(12) 0.065(5) Uani 1 1 d D U . . .
C3A C 0.1979(13) 0.913(2) 0.7017(12) 0.073(6) Uani 1 1 d D U . . .
H3A H 0.157650 0.890921 0.674122 0.088 Uiso 1 1 calc R U . . .
C4A C 0.2483(12) 0.849(2) 0.6998(13) 0.077(6) Uani 1 1 d D U . . .
H4A H 0.242727 0.789365 0.672775 0.092 Uiso 1 1 calc R U . . .
C5A C 0.2506(12) 1.023(2) 0.7712(14) 0.077(6) Uani 1 1 d D U . . .
H5A H 0.256308 1.081240 0.799217 0.092 Uiso 1 1 calc R U . . .
C6A C 0.3008(12) 0.961(2) 0.7675(12) 0.081(6) Uani 1 1 d D U . . .
H6A H 0.341478 0.987204 0.792204 0.097 Uiso 1 1 calc R U . . .
N1A N 0.3024(9) 0.8769(19) 0.7372(11) 0.069(5) Uani 1 1 d D U . . .
O1B O 0.5351(8) 0.9472(13) 0.8693(7) 0.033(2) Uani 1 1 d D U . . .
O2B O 0.4349(13) 0.955(3) 0.8054(13) 0.030(3) Uani 0.6 1 d D U P B 1
C1B C 0.4889(9) 1.001(2) 0.8316(10) 0.031(2) Uani 0.6 1 d D U P B 1
C2B C 0.4931(12) 1.1223(15) 0.8211(7) 0.028(2) Uani 0.6 1 d D U P B 1
C3B C 0.4451(13) 1.186(2) 0.8057(10) 0.027(3) Uani 0.6 1 d D U P B 1
H3B H 0.404154 1.158049 0.800192 0.033 Uiso 0.6 1 calc R U P B 1
C4B C 0.4531(12) 1.296(2) 0.7969(11) 0.027(3) Uani 0.6 1 d D U P B 1
H4B H 0.416174 1.339363 0.785415 0.032 Uiso 0.6 1 calc R U P B 1
C5B C 0.5453(13) 1.170(2) 0.8270(11) 0.028(3) Uani 0.6 1 d D U P B 1
H5B H 0.582407 1.126813 0.838532 0.033 Uiso 0.6 1 calc R U P B 1
C6B C 0.5532(12) 1.280(2) 0.8181(12) 0.027(3) Uani 0.6 1 d D U P B 1
H6B H 0.594083 1.307944 0.823370 0.032 Uiso 0.6 1 calc R U P B 1
N1B N 0.5053(11) 1.3426(15) 0.8030(10) 0.025(3) Uani 0.6 1 d D U P B 1
O2B' O 0.4274(19) 0.932(4) 0.8122(17) 0.031(3) Uani 0.4 1 d D U P B 2
C1B' C 0.4754(9) 0.9649(17) 0.8578(11) 0.031(2) Uani 0.4 1 d D U P B 2
C2B' C 0.4570(16) 1.0337(17) 0.9028(10) 0.032(3) Uani 0.4 1 d D U P B 2
C3B' C 0.4043(14) 1.048(3) 0.9115(12) 0.032(3) Uani 0.4 1 d D U P B 2
H3B' H 0.372570 1.005483 0.882905 0.039 Uiso 0.4 1 calc R U P B 2
C4B' C 0.3766(17) 1.104(3) 0.9475(17) 0.032(3) Uani 0.4 1 d D U P B 2
H4B' H 0.333654 1.101192 0.945154 0.039 Uiso 0.4 1 calc R U P B 2
C5B' C 0.5023(17) 1.089(3) 0.9403(17) 0.032(3) Uani 0.4 1 d D U P B 2
H5B' H 0.545263 1.091872 0.942756 0.038 Uiso 0.4 1 calc R U P B 2
C6B' C 0.4748(17) 1.145(3) 0.9765(17) 0.032(3) Uani 0.4 1 d D U P B 2
H6B' H 0.506292 1.187880 1.005286 0.038 Uiso 0.4 1 calc R U P B 2
N1B' N 0.4220(17) 1.158(2) 0.9842(13) 0.032(3) Uani 0.4 1 d D U P B 2
O1C O 0.5704(7) 0.4564(12) 0.7289(7) 0.023(3) Uani 1 1 d . U . . .
O2C O 0.5638(7) 0.5766(12) 0.6571(7) 0.024(3) Uani 1 1 d . U . . .
C1C C 0.5802(11) 0.488(2) 0.6823(10) 0.026(3) Uani 1 1 d . U . . .
C2C C 0.6194(12) 0.413(2) 0.6601(11) 0.032(3) Uani 1 1 d . U . . .
C3C C 0.6325(12) 0.309(2) 0.6808(11) 0.035(4) Uani 1 1 d . U . . .
H3C H 0.614913 0.279511 0.708792 0.042 Uiso 1 1 calc R U . . .
C4C C 0.6717(13) 0.248(2) 0.6598(12) 0.042(4) Uani 1 1 d . U . . .
H4C H 0.679947 0.175100 0.673729 0.050 Uiso 1 1 calc R U . . .
C5C C 0.6438(12) 0.452(2) 0.6161(12) 0.037(4) Uani 1 1 d . U . . .
H5C H 0.634300 0.522885 0.599581 0.045 Uiso 1 1 calc R U . . .
C6C C 0.6827(13) 0.382(2) 0.5984(12) 0.039(4) Uani 1 1 d . U . . .
H6C H 0.698467 0.405775 0.567960 0.047 Uiso 1 1 calc R U . . .
N1C N 0.6991(11) 0.2842(19) 0.6208(10) 0.043(4) Uani 1 1 d . U . . .
O1D O 0.6310(7) 0.8344(13) 0.7145(7) 0.026(3) Uani 1 1 d D U . . .
O2D O 0.6485(9) 0.9137(15) 0.8046(7) 0.026(4) Uani 0.8 1 d D U P A 1
O2D' O 0.629(4) 0.9257(18) 0.791(3) 0.025(5) Uani 0.2 1 d D U P A 2
C1D C 0.6559(10) 0.9041(17) 0.7545(7) 0.023(3) Uani 1 1 d D U . . .
C2D C 0.7073(10) 0.9757(18) 0.7468(9) 0.021(3) Uani 1 1 d . U . . .
C3D C 0.7295(10) 0.9557(19) 0.6993(10) 0.023(4) Uani 1 1 d . U . . .
H3D H 0.712234 0.898360 0.671444 0.028 Uiso 1 1 calc R U . . .
C4D C 0.7764(10) 1.0197(18) 0.6935(10) 0.025(4) Uani 1 1 d . U . . .
H4D H 0.791559 1.004839 0.661304 0.030 Uiso 1 1 calc R U . . .
C5D C 0.7310(10) 1.0610(19) 0.7838(10) 0.023(3) Uani 1 1 d . U . . .
H5D H 0.715076 1.077932 0.815220 0.028 Uiso 1 1 calc R U . . .
C6D C 0.7789(11) 1.125(2) 0.7757(11) 0.028(4) Uani 1 1 d . U . . .
H6D H 0.795730 1.184225 0.801923 0.034 Uiso 1 1 calc R U . . .
N1D N 0.8017(9) 1.1006(16) 0.7300(9) 0.029(3) Uani 1 1 d . U . . .
O1W O 0.3402(8) 0.6405(15) 0.5841(8) 0.039(4) Uani 1 1 d . . . . .
O2W O 0.7380(11) 0.7283(19) 1.0292(11) 0.040(6) Uani 0.75 1 d . U P . .
O3W O 0.4899(15) 0.604(3) 0.9421(14) 0.043(8) Uani 0.6 1 d . U P . .
O4W O 0.4683(16) 0.744(3) 0.4714(14) 0.034(8) Uani 0.5 1 d . U P . .
O5W O 0.4886(19) 0.460(4) 0.5454(19) 0.053(11) Uani 0.5 1 d . U P . .
O6W O 0.4767(17) 1.383(3) 0.9329(15) 0.040(9) Uani 0.5 1 d . . P . .
O7W O 0.485(2) 1.081(3) 0.7189(18) 0.051(10) Uani 0.5 1 d . U P . .
O8W O 0.429(3) 0.950(5) 0.429(3) 0.027(14) Uani 0.25 1 d . U P . .
O9W O 0.578(2) 1.154(3) 0.8274(18) 0.028(3) Uani 0.4 1 d . U P C 2
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'
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'
S S 0.1246 0.1234 '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'
Re Re -1.0185 7.2310 '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
Re2 Re1 Re4 89.96(3) . .
Re2 Re1 Re5 59.87(3) . .
Re2 Re1 Re6 59.93(3) . .
Re4 Re1 Re5 60.12(3) . .
Re4 Re1 Re6 59.91(3) . .
Re6 Re1 Re5 89.89(3) . .
S1 Re1 Re2 57.40(12) . .
S1 Re1 Re4 117.41(12) . .
S1 Re1 Re5 57.32(12) . .
S1 Re1 Re6 117.29(12) . .
S1 Re1 S4 89.51(17) . .
S1 Re1 S5 89.78(18) . .
S1 Re1 S8 173.30(17) . .
S4 Re1 Re2 117.11(12) . .
S4 Re1 Re4 57.61(12) . .
S4 Re1 Re5 57.27(12) . .
S4 Re1 Re6 117.46(12) . .
S4 Re1 S5 173.25(18) . .
S4 Re1 S8 90.21(17) . .
S5 Re1 Re2 57.19(13) . .
S5 Re1 Re4 117.09(14) . .
S5 Re1 Re5 117.02(13) . .
S5 Re1 Re6 57.22(14) . .
S5 Re1 S8 89.72(18) . .
S8 Re1 Re2 117.07(13) . .
S8 Re1 Re4 57.18(11) . .
S8 Re1 Re5 117.26(12) . .
S8 Re1 Re6 57.18(13) . .
C1 Re1 Re2 132.7(6) . .
C1 Re1 Re4 137.2(6) . .
C1 Re1 Re5 137.0(5) . .
C1 Re1 Re6 133.1(5) . .
C1 Re1 S1 93.0(6) . .
C1 Re1 S4 96.3(6) . .
C1 Re1 S5 90.5(6) . .
C1 Re1 S8 93.7(6) . .
Re1 Re2 Re3 90.31(3) . .
Re1 Re2 Re5 60.36(3) . .
Re1 Re2 Re6 60.28(3) . .
Re5 Re2 Re3 60.21(3) . .
Re5 Re2 Re6 90.37(3) . .
Re6 Re2 Re3 59.94(3) . .
S1 Re2 Re1 57.34(13) . .
S1 Re2 Re3 117.65(12) . .
S1 Re2 Re5 57.49(12) . .
S1 Re2 Re6 117.58(13) . .
S2 Re2 Re1 117.69(12) . .
S2 Re2 Re3 57.33(12) . .
S2 Re2 Re5 57.38(12) . .
S2 Re2 Re6 117.25(12) . .
S2 Re2 S1 90.17(17) . .
S2 Re2 S5 173.85(18) . .
S5 Re2 Re1 57.60(13) . .
S5 Re2 Re3 117.39(14) . .
S5 Re2 Re5 117.92(13) . .
S5 Re2 Re6 57.47(14) . .
S5 Re2 S1 90.00(18) . .
S6 Re2 Re1 117.54(12) . .
S6 Re2 Re3 57.35(12) . .
S6 Re2 Re5 117.53(12) . .
S6 Re2 Re6 57.28(12) . .
S6 Re2 S1 173.79(17) . .
S6 Re2 S2 89.61(17) . .
S6 Re2 S5 89.56(19) . .
C2 Re2 Re1 134.1(6) . .
C2 Re2 Re3 135.6(6) . .
C2 Re2 Re5 135.1(6) . .
C2 Re2 Re6 134.5(6) . .
C2 Re2 S1 92.9(6) . .
C2 Re2 S2 93.9(6) . .
C2 Re2 S5 92.2(6) . .
C2 Re2 S6 93.3(6) . .
Re2 Re3 Re4 89.75(3) . .
Re2 Re3 Re5 59.86(3) . .
Re5 Re3 Re4 60.10(3) . .
Re6 Re3 Re2 60.01(3) . .
Re6 Re3 Re4 59.98(3) . .
Re6 Re3 Re5 90.20(3) . .
S2 Re3 Re2 57.15(11) . .
S2 Re3 Re4 117.25(12) . .
S2 Re3 Re5 57.20(12) . .
S2 Re3 Re6 117.14(12) . .
S2 Re3 S3 89.99(16) . .
S2 Re3 S6 89.35(16) . .
S2 Re3 S7 173.14(17) . .
S3 Re3 Re2 116.98(11) . .
S3 Re3 Re4 57.21(11) . .
S3 Re3 Re5 57.17(11) . .
S3 Re3 Re6 117.16(12) . .
S6 Re3 Re2 57.11(13) . .
S6 Re3 Re4 117.16(13) . .
S6 Re3 Re5 116.94(13) . .
S6 Re3 Re6 57.23(12) . .
S6 Re3 S3 172.94(17) . .
S6 Re3 S7 90.06(17) . .
S7 Re3 Re2 117.13(13) . .
S7 Re3 Re4 57.24(12) . .
S7 Re3 Re5 117.31(13) . .
S7 Re3 Re6 57.18(12) . .
S7 Re3 S3 89.76(16) . .
C3 Re3 Re2 133.1(5) . .
C3 Re3 Re4 137.1(5) . .
C3 Re3 Re5 136.4(5) . .
C3 Re3 Re6 133.3(5) . .
C3 Re3 S2 93.0(5) . .
C3 Re3 S3 96.1(5) . .
C3 Re3 S6 91.0(5) . .
C3 Re3 S7 93.8(5) . .
Re1 Re4 Re3 89.98(3) . .
Re1 Re4 Re5 60.09(3) . .
Re3 Re4 Re5 59.94(3) . .
Re6 Re4 Re1 60.15(3) . .
Re6 Re4 Re3 59.81(3) . .
Re6 Re4 Re5 90.01(3) . .
S3 Re4 Re1 117.20(11) . .
S3 Re4 Re3 57.31(11) . .
S3 Re4 Re5 57.14(11) . .
S3 Re4 Re6 117.08(12) . .
S3 Re4 S4 89.69(16) . .
S4 Re4 Re1 57.13(12) . .
S4 Re4 Re3 117.02(12) . .
S4 Re4 Re5 57.12(12) . .
S4 Re4 Re6 117.22(12) . .
S7 Re4 Re1 117.21(12) . .
S7 Re4 Re3 57.21(12) . .
S7 Re4 Re5 117.11(12) . .
S7 Re4 Re6 57.10(12) . .
S7 Re4 S3 89.80(16) . .
S7 Re4 S4 172.99(17) . .
S8 Re4 Re1 57.46(12) . .
S8 Re4 Re3 117.13(13) . .
S8 Re4 Re5 117.51(12) . .
S8 Re4 Re6 57.36(12) . .
S8 Re4 S3 173.32(17) . .
S8 Re4 S4 90.08(17) . .
S8 Re4 S7 89.61(17) . .
C4 Re4 Re1 136.8(5) . .
C4 Re4 Re3 133.2(5) . .
C4 Re4 Re5 136.5(5) . .
C4 Re4 Re6 133.4(5) . .
C4 Re4 S3 93.2(5) . .
C4 Re4 S4 95.9(5) . .
C4 Re4 S7 91.1(5) . .
C4 Re4 S8 93.4(5) . .
Re1 Re5 Re4 59.79(3) . .
Re2 Re5 Re1 59.77(3) . .
Re2 Re5 Re3 59.93(3) . .
Re2 Re5 Re4 89.71(3) . .
Re3 Re5 Re1 89.82(3) . .
Re3 Re5 Re4 59.96(3) . .
S1 Re5 Re1 57.06(12) . .
S1 Re5 Re2 57.28(12) . .
S1 Re5 Re3 117.17(12) . .
S1 Re5 Re4 116.82(13) . .
S2 Re5 Re1 116.91(11) . .
S2 Re5 Re2 57.17(11) . .
S2 Re5 Re3 57.17(11) . .
S2 Re5 Re4 117.07(12) . .
S2 Re5 S1 89.90(17) . .
S2 Re5 S3 90.07(16) . .
S2 Re5 S4 172.97(16) . .
S3 Re5 Re1 116.96(11) . .
S3 Re5 Re2 117.22(11) . .
S3 Re5 Re3 57.33(11) . .
S3 Re5 Re4 57.20(11) . .
S3 Re5 S1 172.97(16) . .
S3 Re5 S4 89.93(17) . .
S4 Re5 Re1 57.11(11) . .
S4 Re5 Re2 116.85(12) . .
S4 Re5 Re3 117.35(12) . .
S4 Re5 Re4 57.44(12) . .
S4 Re5 S1 89.24(17) . .
C5 Re5 Re1 137.5(5) . .
C5 Re5 Re2 132.5(5) . .
C5 Re5 Re3 132.5(5) . .
C5 Re5 Re4 137.7(5) . .
C5 Re5 S1 93.5(5) . .
C5 Re5 S2 90.0(6) . .
C5 Re5 S3 93.6(5) . .
C5 Re5 S4 97.0(6) . .
Re2 Re6 Re1 59.79(3) . .
Re2 Re6 Re4 89.90(3) . .
Re3 Re6 Re1 90.09(3) . .
Re3 Re6 Re2 60.05(3) . .
Re3 Re6 Re4 60.21(3) . .
Re4 Re6 Re1 59.95(3) . .
S5 Re6 Re1 57.34(13) . .
S5 Re6 Re2 57.18(13) . .
S5 Re6 Re3 117.20(13) . .
S5 Re6 Re4 117.25(13) . .
S6 Re6 Re1 116.93(12) . .
S6 Re6 Re2 57.16(12) . .
S6 Re6 Re3 57.36(12) . .
S6 Re6 Re4 117.50(12) . .
S6 Re6 S5 89.29(18) . .
S6 Re6 S8 173.27(16) . .
S7 Re6 Re1 117.31(12) . .
S7 Re6 Re2 117.44(12) . .
S7 Re6 Re3 57.44(12) . .
S7 Re6 Re4 57.40(12) . .
S7 Re6 S5 173.43(17) . .
S7 Re6 S6 90.31(18) . .
S7 Re6 S8 89.73(17) . .
S8 Re6 Re1 57.36(12) . .
S8 Re6 Re2 117.11(12) . .
S8 Re6 Re3 117.42(11) . .
S8 Re6 Re4 57.25(11) . .
S8 Re6 S5 89.90(18) . .
C6 Re6 Re1 137.7(6) . .
C6 Re6 Re2 135.3(6) . .
C6 Re6 Re3 132.2(6) . .
C6 Re6 Re4 134.7(6) . .
C6 Re6 S5 95.4(6) . .
C6 Re6 S6 91.7(6) . .
C6 Re6 S7 91.1(6) . .
C6 Re6 S8 95.0(6) . .
Re1 S1 Re2 65.26(13) . .
Re1 S1 Re5 65.61(13) . .
Re2 S1 Re5 65.23(13) . .
Re2 S2 Re3 65.52(12) . .
Re2 S2 Re5 65.45(12) . .
Re3 S2 Re5 65.63(12) . .
Re4 S3 Re3 65.48(11) . .
Re5 S3 Re3 65.49(11) . .
Re5 S3 Re4 65.65(12) . .
Re1 S4 Re4 65.27(12) . .
Re1 S4 Re5 65.62(13) . .
Re5 S4 Re4 65.44(12) . .
Re2 S5 Re1 65.20(12) . .
Re2 S5 Re6 65.35(13) . .
Re6 S5 Re1 65.44(13) . .
Re2 S6 Re3 65.54(12) . .
Re2 S6 Re6 65.56(13) . .
Re6 S6 Re3 65.41(13) . .
Re3 S7 Re4 65.55(12) . .
Re6 S7 Re3 65.38(13) . .
Re6 S7 Re4 65.50(13) . .
Re4 S8 Re1 65.35(12) . .
Re4 S8 Re6 65.39(13) . .
Re6 S8 Re1 65.46(13) . .
N1 C1 Re1 175.1(18) . .
C1 N1 Dy1 153.6(16) . .
N2 C2 Re2 178.4(19) . .
C2 N2 Dy2 170.1(17) . 1_565
N3 C3 Re3 178.0(16) . .
C3 N3 Dy4 161.5(15) . 4_585
N4 C4 Re4 176.2(18) . .
C4 N4 Dy2 158.2(16) . 4_575
N5 C5 Re5 173.4(18) . .
C5 N5 Dy3 166.8(15) . 3_676
N6 C6 Re6 174.5(19) . .
C6 N6 Dy1 162.7(18) . 2_556
N1 Dy1 N6 138.6(6) . 2_546
N1 Dy1 Dy2 121.9(4) . .
N1 Dy1 Dy3 71.0(4) . .
N1 Dy1 Dy4 116.3(4) . .
N1 Dy1 N1A 70.3(7) . .
N6 Dy1 Dy2 94.4(4) 2_546 .
N6 Dy1 Dy3 150.4(4) 2_546 .
N6 Dy1 Dy4 97.6(5) 2_546 .
N6 Dy1 N1A 68.3(7) 2_546 .
Dy2 Dy1 Dy3 59.26(2) . .
Dy2 Dy1 Dy4 61.30(2) . .
Dy4 Dy1 Dy3 59.38(2) . .
O1 Dy1 N1 83.4(5) . .
O1 Dy1 N6 129.1(6) . 2_546
O1 Dy1 Dy2 38.5(3) . .
O1 Dy1 Dy3 34.4(3) . .
O1 Dy1 Dy4 77.4(3) . .
O1 Dy1 N1A 137.4(7) . .
O2 Dy1 N1 146.8(5) . .
O2 Dy1 N6 74.2(5) . 2_546
O2 Dy1 Dy2 38.5(3) . .
O2 Dy1 Dy3 76.4(3) . .
O2 Dy1 Dy4 36.6(3) . .
O2 Dy1 O1 72.9(5) . .
O2 Dy1 O3 71.6(5) . .
O2 Dy1 N1A 142.1(6) . .
O2 Dy1 O2B 93.6(8) . .
O3 Dy1 N1 78.0(5) . .
O3 Dy1 N6 133.8(6) . 2_546
O3 Dy1 Dy2 77.4(3) . .
O3 Dy1 Dy3 34.5(3) . .
O3 Dy1 Dy4 38.5(3) . .
O3 Dy1 O1 67.3(5) . .
O3 Dy1 N1A 133.9(6) . .
O2A Dy1 N1 101.4(8) 2_546 .
O2A Dy1 N6 70.6(8) 2_546 2_546
O2A Dy1 Dy2 70.3(6) 2_546 .
O2A Dy1 Dy3 108.1(5) 2_546 .
O2A Dy1 Dy4 129.2(6) 2_546 .
O2A Dy1 O1 74.3(6) 2_546 .
O2A Dy1 O2 94.3(7) 2_546 .
O2A Dy1 O3 141.4(6) 2_546 .
O2A Dy1 N1A 78.7(8) 2_546 .
O2A Dy1 O2B 145.4(9) 2_546 .
N1A Dy1 Dy2 148.2(6) . .
N1A Dy1 Dy3 141.3(5) . .
N1A Dy1 Dy4 144.2(6) . .
O2B Dy1 N1 89.8(8) . .
O2B Dy1 N6 79.3(9) . 2_546
O2B Dy1 Dy2 130.1(7) . .
O2B Dy1 Dy3 106.5(8) . .
O2B Dy1 Dy4 70.5(7) . .
O2B Dy1 O1 140.1(8) . .
O2B Dy1 O3 72.8(8) . .
O2B Dy1 N1A 74.5(9) . .
O2B' Dy1 N1 96.8(11) . .
O2B' Dy1 Dy2 129.0(10) . .
O2B' Dy1 Dy3 114.4(12) . .
O2B' Dy1 Dy4 72.6(11) . .
O2B' Dy1 O1 146.6(13) . .
O2B' Dy1 O2 90.9(11) . .
O2B' Dy1 O3 80.1(13) . .
O2B' Dy1 N1A 71.6(13) . .
N2 Dy2 Dy1 94.7(4) 1_545 .
N2 Dy2 Dy3 91.4(4) 1_545 .
N2 Dy2 Dy4 148.4(4) 1_545 .
N2 Dy2 N1B 70.1(7) 1_545 1_545
N4 Dy2 N2 141.0(6) 4_676 1_545
N4 Dy2 Dy1 120.8(4) 4_676 .
N4 Dy2 Dy3 117.8(4) 4_676 .
N4 Dy2 Dy4 69.9(4) 4_676 .
N4 Dy2 N1B 72.1(6) 4_676 1_545
Dy1 Dy2 Dy3 62.63(2) . .
Dy1 Dy2 Dy4 61.06(3) . .
Dy3 Dy2 Dy4 60.36(2) . .
O1 Dy2 N2 71.2(5) . 1_545
O1 Dy2 N4 147.1(5) . 4_676
O1 Dy2 Dy1 38.7(3) . .
O1 Dy2 Dy3 36.9(3) . .
O1 Dy2 Dy4 77.3(3) . .
O1 Dy2 O2 72.5(4) . .
O1 Dy2 O4 71.4(4) . .
O1 Dy2 O1A 89.7(6) . 2_546
O1 Dy2 N1B 140.8(6) . 1_545
O2 Dy2 N2 130.5(5) . 1_545
O2 Dy2 N4 83.0(5) . 4_676
O2 Dy2 Dy1 37.8(3) . .
O2 Dy2 Dy3 78.8(3) . .
O2 Dy2 Dy4 36.7(3) . .
O2 Dy2 O4 68.9(4) . .
O2 Dy2 O1A 73.4(6) . 2_546
O2 Dy2 N1B 131.9(6) . 1_545
O4 Dy2 N2 126.7(5) . 1_545
O4 Dy2 N4 79.6(5) . 4_676
O4 Dy2 Dy1 78.3(3) . .
O4 Dy2 Dy3 38.4(3) . .
O4 Dy2 Dy4 34.5(3) . .
O4 Dy2 O1A 141.3(6) . 2_546
O4 Dy2 N1B 140.4(6) . 1_545
O1A Dy2 N2 73.9(6) 2_546 1_545
O1A Dy2 N4 104.1(6) 2_546 4_676
O1A Dy2 Dy1 66.7(5) 2_546 .
O1A Dy2 Dy3 125.5(5) 2_546 .
O1A Dy2 Dy4 109.7(4) 2_546 .
O1A Dy2 N1B 73.8(7) 2_546 1_545
N1B Dy2 Dy1 140.3(5) 1_545 .
N1B Dy2 Dy3 149.3(5) 1_545 .
N1B Dy2 Dy4 141.5(5) 1_545 .
O1C Dy2 N2 73.9(6) . 1_545
O1C Dy2 N4 88.3(5) . 4_676
O1C Dy2 Dy1 136.4(4) . .
O1C Dy2 Dy3 75.5(4) . .
O1C Dy2 Dy4 108.7(4) . .
O1C Dy2 O1 99.2(5) . .
O1C Dy2 O2 145.0(5) . .
O1C Dy2 O4 76.2(5) . .
O1C Dy2 O1A 141.5(6) . 2_546
O1C Dy2 N1B 75.9(6) . 1_545
N5 Dy3 Dy1 158.4(4) 3_676 .
N5 Dy3 Dy2 139.5(4) 3_676 .
N5 Dy3 Dy4 134.7(4) 3_676 .
Dy2 Dy3 Dy1 58.12(2) . .
Dy2 Dy3 Dy4 61.08(2) . .
Dy4 Dy3 Dy1 59.84(2) . .
O1 Dy3 N5 145.6(5) . 3_676
O1 Dy3 Dy1 35.0(3) . .
O1 Dy3 Dy2 37.4(3) . .
O1 Dy3 Dy4 78.2(3) . .
O1 Dy3 O3 68.3(5) . .
O1 Dy3 O4 71.5(4) . .
O1 Dy3 O1M 74.8(5) . .
O1 Dy3 O2M 115.7(5) . .
O1 Dy3 O2C 84.6(5) . .
O3 Dy3 N5 141.6(5) . 3_676
O3 Dy3 Dy1 34.9(3) . .
O3 Dy3 Dy2 76.7(3) . .
O3 Dy3 Dy4 38.7(3) . .
O3 Dy3 O4 69.9(4) . .
O3 Dy3 O1M 114.7(5) . .
O3 Dy3 O2M 72.9(5) . .
O3 Dy3 O2C 141.1(5) . .
O4 Dy3 N5 126.9(5) . 3_676
O4 Dy3 Dy1 74.5(3) . .
O4 Dy3 Dy2 38.0(3) . .
O4 Dy3 Dy4 35.2(3) . .
O4 Dy3 O2M 135.3(5) . .
O1M Dy3 N5 75.4(5) . 3_676
O1M Dy3 Dy1 89.0(4) . .
O1M Dy3 Dy2 103.3(4) . .
O1M Dy3 Dy4 148.8(4) . .
O1M Dy3 O4 140.9(5) . .
O1M Dy3 O2M 77.7(6) . .
O2M Dy3 N5 73.6(6) . 3_676
O2M Dy3 Dy1 88.7(4) . .
O2M Dy3 Dy2 146.6(4) . .
O2M Dy3 Dy4 100.7(4) . .
O2C Dy3 N5 74.8(5) . 3_676
O2C Dy3 Dy1 118.4(4) . .
O2C Dy3 Dy2 65.0(4) . .
O2C Dy3 Dy4 110.5(4) . .
O2C Dy3 O4 75.4(5) . .
O2C Dy3 O1M 82.3(6) . .
O2C Dy3 O2M 146.0(5) . .
O1D Dy3 N5 69.1(5) . 3_676
O1D Dy3 Dy1 120.0(4) . .
O1D Dy3 Dy2 113.6(4) . .
O1D Dy3 Dy4 65.8(4) . .
O1D Dy3 O1 143.5(5) . .
O1D Dy3 O3 85.9(5) . .
O1D Dy3 O4 75.7(5) . .
O1D Dy3 O1M 141.3(5) . .
O1D Dy3 O2M 77.9(6) . .
O1D Dy3 O2C 102.3(5) . .
N3 Dy4 Dy3 139.2(3) 4_686 .
O2 Dy4 N3 140.7(5) . 4_686
O2 Dy4 Dy3 77.0(3) . .
O2 Dy4 O3 68.7(4) . .
O2 Dy4 O3M 116.3(6) . .
O2 Dy4 O4M' 83(3) . .
O3 Dy4 N3 127.2(5) . 4_686
O3 Dy4 Dy3 36.4(3) . .
O4 Dy4 N3 146.9(5) . 4_686
O4 Dy4 Dy3 36.6(3) . .
O4 Dy4 O2 69.3(4) . .
O4 Dy4 O3 69.0(4) . .
O4 Dy4 O3M 78.0(5) . .
O4 Dy4 O4M 113.9(9) . .
O4 Dy4 O3M' 77.3(18) . .
O4 Dy4 O4M' 111(4) . .
O4 Dy4 O1B 143.1(5) . .
O4 Dy4 O2D 90.0(5) . .
O4 Dy4 O2D' 89.2(10) . .
O3M Dy4 N3 74.6(6) . 4_686
O3M Dy4 Dy3 106.1(4) . .
O3M Dy4 O3 142.2(5) . .
O4M Dy4 N3 75.3(8) . 4_686
O4M Dy4 Dy3 145.1(8) . .
O4M Dy4 O2 72.9(7) . .
O4M Dy4 O3 137.2(6) . .
O4M Dy4 O3M 73.0(8) . .
O3M' Dy4 Dy3 95.0(18) . .
O3M' Dy4 O2 133(2) . .
O3M' Dy4 O3 127.2(19) . .
O3M' Dy4 O4M' 80(3) . .
O4M' Dy4 Dy3 147(4) . .
O4M' Dy4 O3 150(2) . .
O1B Dy4 N3 66.9(6) . 4_686
O1B Dy4 Dy3 112.3(4) . .
O1B Dy4 O2 87.0(5) . .
O1B Dy4 O3 76.4(5) . .
O1B Dy4 O3M 138.8(6) . .
O1B Dy4 O4M 83.5(9) . .
O1B Dy4 O3M' 136.5(19) . .
O1B Dy4 O4M' 93(4) . .
O1B Dy4 O2D 95.9(7) . .
O1B Dy4 O2D' 89.5(9) . .
O2D Dy4 N3 68.5(5) . 4_686
O2D Dy4 Dy3 71.1(4) . .
O2D Dy4 O2 146.5(5) . .
O2D Dy4 O3 79.5(6) . .
O2D Dy4 O3M 82.7(7) . .
O2D Dy4 O4M 140.6(7) . .
O2D' Dy4 Dy3 64.6(16) . .
O2D' Dy4 O2 137(2) . .
O2D' Dy4 O3 68(2) . .
O2D' Dy4 O3M' 72(3) . .
O2D' Dy4 O4M' 140(3) . .
Dy1 O1 H1 112.3 . .
Dy2 O1 Dy1 102.8(5) . .
Dy2 O1 H1 112.3 . .
Dy3 O1 Dy1 110.7(5) . .
Dy3 O1 Dy2 105.8(5) . .
Dy3 O1 H1 112.3 . .
Dy1 O2 Dy2 103.7(5) . .
Dy1 O2 Dy4 108.0(5) . .
Dy1 O2 H2 112.5 . .
Dy2 O2 Dy4 107.2(5) . .
Dy2 O2 H2 112.5 . .
Dy4 O2 H2 112.5 . .
Dy1 O3 Dy4 104.8(5) . .
Dy1 O3 H3 112.0 . .
Dy3 O3 Dy1 110.5(5) . .
Dy3 O3 Dy4 104.9(5) . .
Dy3 O3 H3 112.0 . .
Dy4 O3 H3 112.0 . .
Dy2 O4 Dy3 103.6(5) . .
Dy2 O4 H4 111.5 . .
Dy3 O4 H4 111.5 . .
Dy4 O4 Dy2 110.1(5) . .
Dy4 O4 Dy3 108.2(5) . .
Dy4 O4 H4 111.5 . .
C1A O1A Dy2 122.5(17) . 2_556
C1A O2A Dy1 122.1(19) . 2_556
O1A C1A C2A 115(3) . .
O2A C1A O1A 131(2) . .
O2A C1A C2A 114(3) . .
C3A C2A C1A 128(2) . .
C3A C2A C5A 113.3(17) . .
C5A C2A C1A 119(2) . .
C2A C3A H3A 114.1 . .
C2A C3A C4A 132(2) . .
C4A C3A H3A 114.1 . .
C3A C4A H4A 122.8 . .
N1A C4A C3A 114(2) . .
N1A C4A H4A 122.8 . .
C2A C5A H5A 122.8 . .
C2A C5A C6A 114(2) . .
C6A C5A H5A 122.8 . .
C5A C6A H6A 114.0 . .
N1A C6A C5A 132(2) . .
N1A C6A H6A 114.0 . .
C4A N1A Dy1 128.2(15) . .
C6A N1A Dy1 117.9(16) . .
C6A N1A C4A 113.8(18) . .
C1B O1B Dy4 126.7(16) . .
C1B' O1B Dy4 133.1(15) . .
C1B O2B Dy1 129(3) . .
O1B C1B O2B 119(3) . .
O1B C1B C2B 122.7(19) . .
O2B C1B C2B 118(2) . .
C3B C2B C1B 124(2) . .
C5B C2B C1B 123(2) . .
C5B C2B C3B 113.4(18) . .
C2B C3B H3B 120.1 . .
C2B C3B C4B 120(2) . .
C4B C3B H3B 120.1 . .
C3B C4B H4B 116.9 . .
N1B C4B C3B 126(2) . .
N1B C4B H4B 116.9 . .
C2B C5B H5B 116.7 . .
C2B C5B C6B 127(2) . .
C6B C5B H5B 116.7 . .
C5B C6B H6B 120.2 . .
N1B C6B C5B 120(2) . .
N1B C6B H6B 120.2 . .
C4B N1B Dy2 121.7(15) . 1_565
C6B N1B Dy2 123.8(16) . 1_565
C6B N1B C4B 114.3(18) . .
C1B' O2B' Dy1 132(3) . .
O1B C1B' C2B' 118(2) . .
O2B' C1B' O1B 129(3) . .
O2B' C1B' C2B' 114(3) . .
C3B' C2B' C1B' 133(3) . .
C3B' C2B' C5B' 111.9(17) . .
C5B' C2B' C1B' 115(3) . .
C2B' C3B' H3B' 108.5 . .
C2B' C3B' C4B' 143(2) . .
C4B' C3B' H3B' 108.5 . .
C3B' C4B' H4B' 127.8 . .
N1B' C4B' C3B' 104(2) . .
N1B' C4B' H4B' 127.8 . .
C2B' C5B' H5B' 127.3 . .
C2B' C5B' C6B' 105(2) . .
C6B' C5B' H5B' 127.3 . .
C5B' C6B' H6B' 109.2 . .
N1B' C6B' C5B' 142(3) . .
N1B' C6B' H6B' 109.2 . .
C4B' N1B' C6B' 113.7(19) . .
C1C O1C Dy2 127.4(14) . .
C1C O2C Dy3 142.0(14) . .
O1C C1C C2C 115(2) . .
O2C C1C O1C 125(2) . .
O2C C1C C2C 120(2) . .
C3C C2C C1C 123(2) . .
C3C C2C C5C 120(2) . .
C5C C2C C1C 118(2) . .
C2C C3C H3C 120.9 . .
C2C C3C C4C 118(2) . .
C4C C3C H3C 120.9 . .
C3C C4C H4C 117.9 . .
N1C C4C C3C 124(3) . .
N1C C4C H4C 117.9 . .
C2C C5C H5C 121.8 . .
C6C C5C C2C 116(2) . .
C6C C5C H5C 121.8 . .
C5C C6C H6C 117.7 . .
N1C C6C C5C 125(2) . .
N1C C6C H6C 117.7 . .
C6C N1C C4C 117(2) . .
C1D O1D Dy3 136.3(14) . .
C1D O2D Dy4 128.8(14) . .
C1D O2D' Dy4 128.2(16) . .
O1D C1D O2D' 118(3) . .
O1D C1D C2D 118.3(15) . .
O2D C1D O1D 127(2) . .
O2D C1D C2D 114.5(15) . .
O2D' C1D C2D 122(3) . .
C3D C2D C1D 119.5(18) . .
C5D C2D C1D 121.7(17) . .
C5D C2D C3D 118.8(19) . .
C2D C3D H3D 120.5 . .
C4D C3D C2D 119(2) . .
C4D C3D H3D 120.5 . .
C3D C4D H4D 118.3 . .
N1D C4D C3D 123(2) . .
N1D C4D H4D 118.3 . .
C2D C5D H5D 120.0 . .
C2D C5D C6D 120.0(19) . .
C6D C5D H5D 120.0 . .
C5D C6D H6D 120.0 . .
N1D C6D C5D 120(2) . .
N1D C6D H6D 120.0 . .
C4D N1D C6D 118.6(19) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Re1 Re2 2.5904(11) .
Re1 Re4 2.5979(10) .
Re1 Re5 2.6057(10) .
Re1 Re6 2.6031(11) .
Re1 S1 2.401(5) .
Re1 S4 2.402(5) .
Re1 S5 2.409(5) .
Re1 S8 2.410(5) .
Re1 C1 2.10(2) .
Re2 Re3 2.5950(11) .
Re2 Re5 2.5930(10) .
Re2 Re6 2.5939(11) .
Re2 S1 2.403(5) .
Re2 S2 2.396(5) .
Re2 S5 2.398(5) .
Re2 S6 2.394(5) .
Re2 C2 2.10(2) .
Re3 Re4 2.6026(10) .
Re3 Re5 2.6022(10) .
Re3 Re6 2.5922(10) .
Re3 S2 2.400(5) .
Re3 S3 2.408(4) .
Re3 S6 2.400(5) .
Re3 S7 2.403(5) .
Re3 C3 2.118(19) .
Re4 Re5 2.6064(10) .
Re4 Re6 2.5968(10) .
Re4 S3 2.405(4) .
Re4 S4 2.415(5) .
Re4 S7 2.404(5) .
Re4 S8 2.402(5) .
Re4 C4 2.131(19) .
Re5 S1 2.408(5) .
Re5 S2 2.401(5) .
Re5 S3 2.403(4) .
Re5 S4 2.407(5) .
Re5 C5 2.116(19) .
Re6 S5 2.406(6) .
Re6 S6 2.397(5) .
Re6 S7 2.396(5) .
Re6 S8 2.405(5) .
Re6 C6 2.10(2) .
C1 N1 1.16(3) .
N1 Dy1 2.479(17) .
C2 N2 1.13(3) .
N2 Dy2 2.510(18) 1_565
C3 N3 1.15(2) .
N3 Dy4 2.588(16) 4_585
C4 N4 1.14(3) .
N4 Dy2 2.469(16) 4_575
C5 N5 1.16(2) .
N5 Dy3 2.579(16) 3_676
C6 N6 1.15(3) .
N6 Dy1 2.554(19) 2_556
Dy1 Dy2 3.6875(13) .
Dy1 Dy3 3.8565(12) .
Dy1 Dy4 3.8203(14) .
Dy1 O1 2.363(12) .
Dy1 O2 2.328(13) .
Dy1 O3 2.359(13) .
Dy1 O2A 2.24(2) 2_546
Dy1 N1A 2.616(17) .
Dy1 O2B 2.34(3) .
Dy1 O2B' 2.19(5) .
Dy2 Dy3 3.7325(13) .
Dy2 Dy4 3.8294(13) .
Dy2 O1 2.354(13) .
Dy2 O2 2.361(13) .
Dy2 O4 2.365(13) .
Dy2 O1A 2.368(15) 2_546
Dy2 N1B 2.537(19) 1_545
Dy2 O1C 2.316(14) .
Dy3 Dy4 3.8026(13) .
Dy3 O1 2.326(12) .
Dy3 O3 2.334(13) .
Dy3 O4 2.386(13) .
Dy3 O1M 2.373(17) .
Dy3 O2M 2.429(16) .
Dy3 O2C 2.357(15) .
Dy3 O1D 2.243(15) .
Dy4 O2 2.395(13) .
Dy4 O3 2.462(13) .
Dy4 O4 2.307(13) .
Dy4 O3M 2.402(13) .
Dy4 O4M 2.392(13) .
Dy4 O3M' 2.395(15) .
Dy4 O4M' 2.395(15) .
Dy4 O1B 2.307(16) .
Dy4 O2D 2.307(15) .
Dy4 O2D' 2.311(17) .
O1 H1 1.0000 .
O2 H2 1.0000 .
O3 H3 1.0000 .
O4 H4 1.0000 .
O1A C1A 1.29(4) .
O2A C1A 1.28(4) .
C1A C2A 1.52(2) .
C2A C3A 1.280(17) .
C2A C5A 1.282(17) .
C3A H3A 0.9500 .
C3A C4A 1.40(2) .
C4A H4A 0.9500 .
C4A N1A 1.274(17) .
C5A H5A 0.9500 .
C5A C6A 1.39(2) .
C6A H6A 0.9500 .
C6A N1A 1.273(16) .
O1B C1B 1.290(17) .
O1B C1B' 1.293(18) .
O2B C1B 1.291(17) .
C1B C2B 1.52(2) .
C2B C3B 1.281(17) .
C2B C5B 1.280(17) .
C3B H3B 0.9500 .
C3B C4B 1.39(2) .
C4B H4B 0.9500 .
C4B N1B 1.275(17) .
C5B H5B 0.9500 .
C5B C6B 1.39(2) .
C6B H6B 0.9500 .
C6B N1B 1.272(17) .
O2B' C1B' 1.292(18) .
C1B' C2B' 1.52(3) .
C2B' C3B' 1.285(17) .
C2B' C5B' 1.287(17) .
C3B' H3B' 0.9500 .
C3B' C4B' 1.39(2) .
C4B' H4B' 0.9500 .
C4B' N1B' 1.275(17) .
C5B' H5B' 0.9500 .
C5B' C6B' 1.40(2) .
C6B' H6B' 0.9500 .
C6B' N1B' 1.276(17) .
O1C C1C 1.25(3) .
O2C C1C 1.24(3) .
C1C C2C 1.49(3) .
C2C C3C 1.37(4) .
C2C C5C 1.42(3) .
C3C H3C 0.9500 .
C3C C4C 1.38(4) .
C4C H4C 0.9500 .
C4C N1C 1.35(3) .
C5C H5C 0.9500 .
C5C C6C 1.40(3) .
C6C H6C 0.9500 .
C6C N1C 1.31(3) .
O1D C1D 1.253(15) .
O2D C1D 1.251(15) .
O2D' C1D 1.255(16) .
C1D C2D 1.52(3) .
C2D C3D 1.40(3) .
C2D C5D 1.35(3) .
C3D H3D 0.9500 .
C3D C4D 1.37(3) .
C4D H4D 0.9500 .
C4D N1D 1.31(3) .
C5D H5D 0.9500 .
C5D C6D 1.40(3) .
C6D H6D 0.9500 .
C6D N1D 1.38(3) .
