#------------------------------------------------------------------------------
#$Date: 2015-07-08 23:13:41 +0300 (Wed, 08 Jul 2015) $
#$Revision: 141325 $
#$URL: svn://www.crystallography.net/cod/cif/4/34/33/4343374.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_4343374
loop_
_publ_author_name
'Brunet, Gabriel'
'Habib, Fatemah'
'Korobkov, Ilia'
'Murugesu, Muralee'
_publ_section_title
;
 Slow Magnetic Relaxation Observed in Dysprosium Compounds Containing
 Unsupported Near-Linear Hydroxo- and Fluoro-Bridges.
;
_journal_issue                   13
_journal_name_full               'Inorganic chemistry'
_journal_page_first              6195
_journal_page_last               6202
_journal_paper_doi               10.1021/acs.inorgchem.5b00343
_journal_volume                  54
_journal_year                    2015
_chemical_formula_sum            'C71 H75 Dy2 N7 Na2 O18'
_chemical_formula_weight         1685.36
_chemical_name_systematic
; 
 ? 
;
_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'
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_atom_sites_solution_hydrogens   mixed
_audit_creation_method           SHELXL-2013
_cell_angle_alpha                90
_cell_angle_beta                 94.0720(10)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   18.1254(4)
_cell_length_b                   17.7273(4)
_cell_length_c                   22.4308(5)
_cell_measurement_reflns_used    9662
_cell_measurement_temperature    200(2)
_cell_measurement_theta_max      28.38
_cell_measurement_theta_min      2.47
_cell_volume                     7189.1(3)
_computing_cell_refinement       'APEX II, Bruker (2009)'
_computing_data_collection       'APEX II, Bruker (2009)'
_computing_data_reduction        'XPREP, Bruker (2009)'
_computing_molecular_graphics    'SHELXTL, Bruker (2004)'
_computing_publication_material  'SHELXTL, Bruker (2004)'
_computing_structure_refinement  'SHELXL-2013 (Sheldrick, 2013)'
_computing_structure_solution    'SHELXS-03 (Sheldrick, 2003)'
_diffrn_ambient_temperature      200(2)
_diffrn_measured_fraction_theta_full 0.996
_diffrn_measured_fraction_theta_max 0.992
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0283
_diffrn_reflns_av_unetI/netI     0.0231
_diffrn_reflns_laue_measured_fraction_full 0.996
_diffrn_reflns_laue_measured_fraction_max 0.992
_diffrn_reflns_limit_h_max       24
_diffrn_reflns_limit_h_min       -24
_diffrn_reflns_limit_k_max       23
_diffrn_reflns_limit_k_min       -23
_diffrn_reflns_limit_l_max       30
_diffrn_reflns_limit_l_min       -30
_diffrn_reflns_number            93221
_diffrn_reflns_point_group_measured_fraction_full 0.996
_diffrn_reflns_point_group_measured_fraction_max 0.992
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         28.407
_diffrn_reflns_theta_min         1.466
_exptl_absorpt_coefficient_mu    2.149
_exptl_absorpt_correction_T_max  0.7457
_exptl_absorpt_correction_T_min  0.6232
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS, Bruker (2003)'
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.557
_exptl_crystal_density_meas      ?
_exptl_crystal_description       block
_exptl_crystal_F_000             3392
_exptl_crystal_size_max          0.160
_exptl_crystal_size_mid          0.140
_exptl_crystal_size_min          0.100
_refine_diff_density_max         2.352
_refine_diff_density_min         -1.045
_refine_diff_density_rms         0.096
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.055
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     959
_refine_ls_number_reflns         17909
_refine_ls_number_restraints     708
_refine_ls_restrained_S_all      1.042
_refine_ls_R_factor_all          0.0452
_refine_ls_R_factor_gt           0.0336
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0420P)²+12.2604P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0839
_refine_ls_wR_factor_ref         0.0910
_reflns_Friedel_coverage         0.000
_reflns_number_gt                14950
_reflns_number_total             17909
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            ic5b00343_si_002.cif
_cod_data_source_block           mm173
_cod_depositor_comments
;
The following automatic conversions were performed:

'_exptl_crystal_density_meas' value 'n/a' was changed to '?' - the
value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 3271 2015-04-21 07:52:19Z andrius 

 Adding full bibliography for 4343373--4343375.cif.
;
_cod_database_code               4343374
_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   0.725
_shelx_estimated_absorpt_t_max   0.814
_shelxl_version_number           2013-4
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
Dy1 Dy 0.45283(2) 0.09125(2) 0.43714(2) 0.02576(4) Uani 1 1 d . U . . .
Dy2 Dy 0.46621(2) 0.12175(2) -0.01367(2) 0.03592(5) Uani 1 1 d . . . . .
Na1 Na 0.61114(7) 0.18334(8) 0.40182(6) 0.0376(3) Uani 1 1 d . . . . .
Na2 Na 0.52422(9) 0.19070(10) 0.12491(6) 0.0470(4) Uani 1 1 d . . . . .
N1 N 0.39703(16) 0.1510(2) 0.52518(14) 0.0427(7) Uani 1 1 d . . . . .
N2 N 0.32951(19) 0.0336(2) 0.46029(16) 0.0541(9) Uani 1 1 d . . . . .
H2A H 0.2920 0.0657 0.4374 0.065 Uiso 1 1 calc R U . . .
N3 N 0.41680(14) -0.02241(17) 0.37072(13) 0.0341(6) Uani 1 1 d . . . . .
N4 N 0.6814(2) 0.2835(2) 0.32277(17) 0.0621(10) Uani 1 1 d . . . . .
N5 N 0.5676(2) 0.1158(2) -0.08663(14) 0.0524(9) Uani 1 1 d . . . . .
N6 N 0.4198(2) 0.0716(2) -0.11630(15) 0.0582(10) Uani 1 1 d . . . . .
H6A H 0.4027 0.1174 -0.1393 0.070 Uiso 1 1 calc R U . . .
N7 N 0.3318(2) 0.07492(19) -0.01798(15) 0.0483(8) Uani 1 1 d . . . . .
O1 O 0.54793(12) 0.14762(14) 0.49360(10) 0.0335(5) Uani 1 1 d . . . . .
O2 O 0.67584(13) 0.21364(17) 0.50123(12) 0.0463(6) Uani 1 1 d . . . . .
O3 O 0.54485(12) 0.07089(13) 0.37664(10) 0.0308(5) Uani 1 1 d . . . . .
O4 O 0.68281(13) 0.08546(16) 0.35630(13) 0.0459(6) Uani 1 1 d . . . . .
O5 O 0.34974(12) 0.14118(14) 0.37614(11) 0.0368(5) Uani 1 1 d . . . . .
O6 O 0.48044(13) 0.21799(14) 0.40172(12) 0.0401(6) Uani 1 1 d . . . . .
O7 O 0.7096(2) 0.2695(2) 0.37253(15) 0.0738(10) Uani 1 1 d . . . . .
O8 O 0.61778(19) 0.2559(2) 0.30787(14) 0.0687(10) Uani 1 1 d . . . . .
O9 O 0.7120(3) 0.3246(3) 0.28765(18) 0.1022(16) Uani 1 1 d . . . . .
O10 O 0.5000 0.0000 0.5000 0.0526(10) Uani 1 2 d S U P . .
H10C H 0.5534 0.0339 0.5107 0.063 Uiso 0.5 1 d R U P A -1
O11 O 0.57508(15) 0.1519(2) 0.03675(12) 0.0584(8) Uani 1 1 d . . . . .
O12 O 0.65725(16) 0.1641(2) 0.13671(12) 0.0627(9) Uani 1 1 d . . . . .
O13 O 0.43271(16) 0.10668(17) 0.08123(11) 0.0484(7) Uani 1 1 d . . . . .
O14 O 0.45296(16) 0.12974(17) 0.19507(11) 0.0480(7) Uani 1 1 d . . . . .
O15 O 0.43911(15) 0.22057(14) -0.08238(11) 0.0415(6) Uani 1 1 d . . . . .
O16 O 0.44851(17) 0.24198(16) 0.03736(11) 0.0494(7) Uani 1 1 d . . . . .
O17 O 0.5205(3) 0.0049(5) -0.0023(3) 0.0455(16) Uani 0.5 1 d . . P B -1
H17B H 0.5703 0.0179 -0.0081 0.055 Uiso 0.5 1 calc R U P B -1
O18 O 0.5601(2) 0.2864(2) 0.19259(16) 0.0809(11) Uani 1 1 d . . . . .
H18B H 0.5677 0.3394 0.1883 0.121 Uiso 1 1 d R U . . .
H18C H 0.5776 0.2696 0.2340 0.121 Uiso 1 1 d R U . . .
C1 C 0.55618(18) 0.20161(19) 0.53255(14) 0.0332(7) Uani 1 1 d . U . . .
C2 C 0.6262(2) 0.2385(2) 0.53976(15) 0.0397(8) Uani 1 1 d . U . . .
C3 C 0.6399(3) 0.2947(3) 0.58127(19) 0.0578(11) Uani 1 1 d . U . . .
H3A H 0.6871 0.3180 0.5856 0.069 Uiso 1 1 calc R U . . .
C4 C 0.5845(3) 0.3171(3) 0.6167(2) 0.0760(15) Uani 1 1 d . U . . .
H4A H 0.5938 0.3558 0.6455 0.091 Uiso 1 1 calc R U . . .
C5 C 0.5175(3) 0.2842(3) 0.6106(2) 0.0618(12) Uani 1 1 d . U . . .
H5A H 0.4803 0.3004 0.6355 0.074 Uiso 1 1 calc R U . . .
C6 C 0.5006(2) 0.2267(2) 0.56869(15) 0.0410(8) Uani 1 1 d . U . . .
C7 C 0.7469(2) 0.2480(4) 0.5055(2) 0.0723(15) Uani 1 1 d . . . . .
H7A H 0.7774 0.2258 0.4756 0.108 Uiso 1 1 calc R U . . .
H7B H 0.7707 0.2395 0.5456 0.108 Uiso 1 1 calc R U . . .
H7C H 0.7417 0.3023 0.4983 0.108 Uiso 1 1 calc R U . . .
C8 C 0.4267(2) 0.1952(2) 0.56490(16) 0.0435(8) Uani 1 1 d . U . . .
H8A H 0.3964 0.2094 0.5959 0.052 Uiso 1 1 calc R U . . .
C9 C 0.3211(2) 0.1271(3) 0.5341(2) 0.0622(12) Uani 1 1 d . U . . .
H9A H 0.2860 0.1556 0.5068 0.075 Uiso 1 1 calc R U . . .
H9B H 0.3095 0.1380 0.5757 0.075 Uiso 1 1 calc R U . . .
C10 C 0.3132(2) 0.0441(3) 0.52199(18) 0.0551(11) Uani 1 1 d . U . . .
H10A H 0.3483 0.0150 0.5489 0.066 Uiso 1 1 calc R U . . .
H10B H 0.2623 0.0271 0.5282 0.066 Uiso 1 1 calc R U . . .
C11 C 0.3159(2) -0.0406(3) 0.4369(2) 0.0627(12) Uani 1 1 d . U . . .
H11A H 0.2622 -0.0514 0.4365 0.075 Uiso 1 1 calc R U . . .
H11B H 0.3421 -0.0777 0.4637 0.075 Uiso 1 1 calc R U . . .
C12 C 0.3408(2) -0.0499(3) 0.3743(2) 0.0495(10) Uani 1 1 d . U . . .
H12A H 0.3383 -0.1039 0.3630 0.059 Uiso 1 1 calc R U . . .
H12B H 0.3072 -0.0216 0.3457 0.059 Uiso 1 1 calc R U . . .
C13 C 0.45857(18) -0.0639(2) 0.34131(15) 0.0358(7) Uani 1 1 d . U . . .
H13A H 0.4369 -0.1087 0.3248 0.043 Uiso 1 1 calc R U . . .
C14 C 0.57339(17) 0.01545(19) 0.34829(13) 0.0307(6) Uani 1 1 d . U . . .
C15 C 0.53563(18) -0.0508(2) 0.32985(14) 0.0333(7) Uani 1 1 d . U . . .
C16 C 0.5718(2) -0.1070(2) 0.29893(16) 0.0407(8) Uani 1 1 d . U . . .
H16A H 0.5453 -0.1511 0.2863 0.049 Uiso 1 1 calc R U . . .
C17 C 0.6441(2) -0.1002(2) 0.28650(17) 0.0455(9) Uani 1 1 d . U . . .
H17A H 0.6675 -0.1390 0.2656 0.055 Uiso 1 1 calc R U . . .
C18 C 0.6834(2) -0.0355(2) 0.30473(16) 0.0443(8) Uani 1 1 d . U . . .
H18A H 0.7338 -0.0303 0.2963 0.053 Uiso 1 1 calc R U . . .
C19 C 0.64931(18) 0.0211(2) 0.33492(14) 0.0360(7) Uani 1 1 d . U . . .
C20 C 0.7615(2) 0.0911(3) 0.3537(2) 0.0556(11) Uani 1 1 d . . . . .
H20A H 0.7787 0.1394 0.3708 0.083 Uiso 1 1 calc R U . . .
H20B H 0.7741 0.0880 0.3120 0.083 Uiso 1 1 calc R U . . .
H20C H 0.7856 0.0497 0.3766 0.083 Uiso 1 1 calc R U . . .
C21 C 0.32811(17) 0.2050(2) 0.35582(14) 0.0320(7) Uani 1 1 d . U . . .
C22 C 0.36972(19) 0.2704(2) 0.35915(17) 0.0397(8) Uani 1 1 d . U . . .
H22A H 0.3470 0.3156 0.3444 0.048 Uiso 1 1 calc R U . . .
C23 C 0.44329(19) 0.2742(2) 0.38293(15) 0.0352(7) Uani 1 1 d . U . . .
C24 C 0.2513(11) 0.210(2) 0.3293(19) 0.044(4) Uani 0.5 1 d D U P C 1
C25 C 0.1944(5) 0.1788(8) 0.3563(7) 0.083(3) Uani 0.5 1 d D U P C 1
H25 H 0.2042 0.1525 0.3929 0.099 Uiso 0.5 1 calc R U P C 1
C26 C 0.1214(5) 0.1842(8) 0.3319(7) 0.096(4) Uani 0.5 1 d D U P C 1
H26 H 0.0826 0.1608 0.3516 0.116 Uiso 0.5 1 calc R U P C 1
C27 C 0.1060(9) 0.2222(13) 0.2811(10) 0.083(6) Uani 0.5 1 d D U P C 1
H27 H 0.0560 0.2300 0.2667 0.100 Uiso 0.5 1 calc R U P C 1
C28 C 0.1628(6) 0.2503(8) 0.2495(6) 0.080(4) Uani 0.5 1 d D U P C 1
H28 H 0.1530 0.2716 0.2108 0.096 Uiso 0.5 1 calc R U P C 1
C29 C 0.2343(6) 0.2465(7) 0.2758(5) 0.068(3) Uani 0.5 1 d D U P C 1
H29 H 0.2730 0.2701 0.2563 0.082 Uiso 0.5 1 calc R U P C 1
C24' C 0.2501(9) 0.208(2) 0.3250(16) 0.035(3) Uani 0.5 1 d D U P C 2
C25' C 0.2071(4) 0.1460(5) 0.3224(4) 0.0467(19) Uani 0.5 1 d D U P C 2
H25' H 0.2263 0.0999 0.3386 0.056 Uiso 0.5 1 calc R U P C 2
C26' C 0.1342(4) 0.1481(6) 0.2960(4) 0.055(2) Uani 0.5 1 d D U P C 2
H26' H 0.1036 0.1047 0.2968 0.066 Uiso 0.5 1 calc R U P C 2
C27' C 0.1083(8) 0.2115(11) 0.2698(8) 0.056(3) Uani 0.5 1 d D U P C 2
H27' H 0.0611 0.2116 0.2484 0.068 Uiso 0.5 1 calc R U P C 2
C28' C 0.1499(6) 0.2768(7) 0.2737(6) 0.069(3) Uani 0.5 1 d D U P C 2
H28' H 0.1297 0.3229 0.2582 0.083 Uiso 0.5 1 calc R U P C 2
C29' C 0.2214(5) 0.2749(6) 0.3003(5) 0.054(2) Uani 0.5 1 d D U P C 2
H29' H 0.2508 0.3193 0.3017 0.065 Uiso 0.5 1 calc R U P C 2
C30 C 0.4786(2) 0.3502(2) 0.38806(17) 0.0438(8) Uani 1 1 d . U . . .
C31 C 0.4600(3) 0.4080(3) 0.3473(2) 0.0655(13) Uani 1 1 d . U . . .
H31A H 0.4258 0.3986 0.3141 0.079 Uiso 1 1 calc R U . . .
C32 C 0.4907(4) 0.4780(3) 0.3551(3) 0.0880(18) Uani 1 1 d . U . . .
H32A H 0.4785 0.5167 0.3268 0.106 Uiso 1 1 calc R U . . .
C33 C 0.5398(4) 0.4930(3) 0.4041(3) 0.096(2) Uani 1 1 d . U . . .
H33A H 0.5607 0.5418 0.4098 0.115 Uiso 1 1 calc R U . . .
C34 C 0.5577(4) 0.4366(4) 0.4441(3) 0.095(2) Uani 1 1 d . U . . .
H34A H 0.5916 0.4461 0.4775 0.114 Uiso 1 1 calc R U . . .
C35 C 0.5270(3) 0.3663(3) 0.4362(2) 0.0688(14) Uani 1 1 d . U . . .
H35A H 0.5395 0.3280 0.4648 0.083 Uiso 1 1 calc R U . . .
C36 C 0.6462(2) 0.1487(3) 0.03282(17) 0.0478(9) Uani 1 1 d . U . . .
C37 C 0.6945(2) 0.1571(3) 0.08561(18) 0.0499(9) Uani 1 1 d . U . . .
C38 C 0.7699(2) 0.1580(3) 0.0840(2) 0.0577(11) Uani 1 1 d . U . . .
H38A H 0.8004 0.1638 0.1199 0.069 Uiso 1 1 calc R U . . .
C39 C 0.8017(3) 0.1503(3) 0.0299(2) 0.0651(12) Uani 1 1 d . U . . .
H39A H 0.8539 0.1520 0.0285 0.078 Uiso 1 1 calc R U . . .
C40 C 0.7574(3) 0.1403(3) -0.0217(2) 0.0605(11) Uani 1 1 d . U . . .
H40A H 0.7796 0.1348 -0.0586 0.073 Uiso 1 1 calc R U . . .
C41 C 0.6794(2) 0.1380(3) -0.02113(18) 0.0510(10) Uani 1 1 d . U . . .
C42 C 0.7002(3) 0.1647(4) 0.1926(2) 0.0832(18) Uani 1 1 d . . . . .
H42A H 0.6674 0.1703 0.2252 0.125 Uiso 1 1 calc R U . . .
H42B H 0.7350 0.2071 0.1934 0.125 Uiso 1 1 calc R U . . .
H42C H 0.7278 0.1173 0.1975 0.125 Uiso 1 1 calc R U . . .
C43 C 0.6366(3) 0.1234(3) -0.07789(18) 0.0589(12) Uani 1 1 d . U . . .
H43A H 0.6643 0.1192 -0.1122 0.071 Uiso 1 1 calc R U . . .
C44 C 0.5399(3) 0.0984(3) -0.14872(17) 0.0665(14) Uani 1 1 d . U . . .
H44A H 0.5809 0.0786 -0.1711 0.080 Uiso 1 1 calc R U . . .
H44B H 0.5212 0.1451 -0.1687 0.080 Uiso 1 1 calc R U . . .
C45 C 0.4793(3) 0.0414(3) -0.14908(17) 0.0648(14) Uani 1 1 d . U . . .
H45A H 0.4610 0.0300 -0.1907 0.078 Uiso 1 1 calc R U . . .
H45B H 0.4981 -0.0060 -0.1302 0.078 Uiso 1 1 calc R U . . .
C46 C 0.3554(3) 0.0247(3) -0.1159(2) 0.0769(16) Uani 1 1 d . U . . .
H46A H 0.3694 -0.0253 -0.0989 0.092 Uiso 1 1 calc R U . . .
H46B H 0.3341 0.0171 -0.1573 0.092 Uiso 1 1 calc R U . . .
C47 C 0.2986(3) 0.0603(3) -0.07935(19) 0.0610(12) Uani 1 1 d . U . . .
H47A H 0.2555 0.0263 -0.0776 0.073 Uiso 1 1 calc R U . . .
H47B H 0.2813 0.1083 -0.0981 0.073 Uiso 1 1 calc R U . . .
C48 C 0.2928(2) 0.0534(2) 0.02410(19) 0.0494(9) Uani 1 1 d . U . . .
H48A H 0.2473 0.0293 0.0122 0.059 Uiso 1 1 calc R U . . .
C49 C 0.3780(2) 0.0895(2) 0.11235(16) 0.0402(8) Uani 1 1 d . U . . .
C50 C 0.3101(2) 0.0614(2) 0.08826(18) 0.0451(8) Uani 1 1 d . U . . .
C51 C 0.2549(2) 0.0399(3) 0.1257(2) 0.0595(11) Uani 1 1 d . U . . .
H51A H 0.2096 0.0197 0.1087 0.071 Uiso 1 1 calc R U . . .
C52 C 0.2655(3) 0.0477(3) 0.1865(2) 0.0663(13) Uani 1 1 d . U . . .
H52A H 0.2281 0.0323 0.2115 0.080 Uiso 1 1 calc R U . . .
C53 C 0.3321(3) 0.0785(3) 0.2117(2) 0.0555(10) Uani 1 1 d . U . . .
H53A H 0.3391 0.0849 0.2537 0.067 Uiso 1 1 calc R U . . .
C54 C 0.3863(2) 0.0990(2) 0.17620(16) 0.0437(8) Uani 1 1 d . U . . .
C55 C 0.4689(3) 0.1366(3) 0.25812(16) 0.0609(12) Uani 1 1 d . . . . .
H55A H 0.5177 0.1597 0.2661 0.091 Uiso 1 1 calc R U . . .
H55B H 0.4687 0.0864 0.2765 0.091 Uiso 1 1 calc R U . . .
H55C H 0.4313 0.1682 0.2750 0.091 Uiso 1 1 calc R U . . .
C56 C 0.42931(17) 0.2912(2) -0.08413(15) 0.0343(7) Uani 1 1 d . U . . .
C57 C 0.42114(19) 0.3359(2) -0.03386(16) 0.0370(7) Uani 1 1 d . U . . .
H57A H 0.4105 0.3880 -0.0394 0.044 Uiso 1 1 calc R U . . .
C58 C 0.42794(19) 0.3074(2) 0.02429(16) 0.0402(8) Uani 1 1 d . U . . .
C59 C 0.42336(16) 0.3260(2) -0.14526(15) 0.0326(7) Uani 1 1 d . U . . .
C60 C 0.39838(19) 0.2826(2) -0.19373(15) 0.0376(7) Uani 1 1 d . U . . .
H60A H 0.3853 0.2314 -0.1877 0.045 Uiso 1 1 calc R U . . .
C61 C 0.3921(2) 0.3125(2) -0.25110(17) 0.0437(8) Uani 1 1 d . U . . .
H61A H 0.3747 0.2821 -0.2841 0.052 Uiso 1 1 calc R U . . .
C62 C 0.4110(2) 0.3861(3) -0.25961(19) 0.0505(10) Uani 1 1 d . U . . .
H62A H 0.4064 0.4071 -0.2987 0.061 Uiso 1 1 calc R U . . .
C63 C 0.4370(2) 0.4304(3) -0.2117(2) 0.0524(10) Uani 1 1 d . U . . .
H63A H 0.4517 0.4810 -0.2182 0.063 Uiso 1 1 calc R U . . .
C64 C 0.4416(2) 0.4009(2) -0.15492(18) 0.0435(8) Uani 1 1 d . U . . .
H64A H 0.4575 0.4320 -0.1220 0.052 Uiso 1 1 calc R U . . .
C65 C 0.4083(2) 0.3563(3) 0.07576(18) 0.0486(9) Uani 1 1 d . U . . .
C66 C 0.4106(2) 0.4340(3) 0.0737(2) 0.0594(11) Uani 1 1 d . U . . .
H66A H 0.4257 0.4589 0.0390 0.071 Uiso 1 1 calc R U . . .
C67 C 0.3906(3) 0.4760(4) 0.1228(3) 0.0781(15) Uani 1 1 d . U . . .
H67A H 0.3932 0.5295 0.1220 0.094 Uiso 1 1 calc R U . . .
C68 C 0.3672(3) 0.4395(5) 0.1723(3) 0.0884(18) Uani 1 1 d . U . . .
H68A H 0.3525 0.4682 0.2051 0.106 Uiso 1 1 calc R U . . .
C69 C 0.3650(4) 0.3631(4) 0.1748(2) 0.0874(17) Uani 1 1 d . U . . .
H69A H 0.3498 0.3387 0.2096 0.105 Uiso 1 1 calc R U . . .
C70 C 0.3848(3) 0.3209(3) 0.12689(19) 0.0654(12) Uani 1 1 d . U . . .
H70A H 0.3825 0.2675 0.1286 0.079 Uiso 1 1 calc R U . . .
O19 O 0.6091(6) 0.4473(6) 0.0417(5) 0.106(3) Uiso 0.5 1 d D . P D 1
H19 H 0.6117 0.4331 0.0776 0.160 Uiso 0.5 1 calc R U P D 1
C71 C 0.6133(10) 0.3735(9) -0.0021(8) 0.108(5) Uiso 0.5 1 d D U P D 1
H71A H 0.6548 0.3793 -0.0274 0.163 Uiso 0.5 1 calc R U P D 1
H71B H 0.5671 0.3693 -0.0274 0.163 Uiso 0.5 1 calc R U P D 1
H71C H 0.6204 0.3278 0.0222 0.163 Uiso 0.5 1 calc R U P D 1
O20 O 0.6118(8) 0.3996(8) 0.0217(6) 0.126(4) Uiso 0.5 1 d D . P E 2
H20 H 0.6260 0.3868 0.0567 0.189 Uiso 0.5 1 calc R U P E 2
C72 C 0.6149(6) 0.3231(6) -0.0248(5) 0.069(3) Uiso 0.5 1 d D U P E 2
H72A H 0.6630 0.2981 -0.0183 0.104 Uiso 0.5 1 calc R U P E 2
H72B H 0.6079 0.3398 -0.0665 0.104 Uiso 0.5 1 calc R U P E 2
H72C H 0.5755 0.2876 -0.0164 0.104 Uiso 0.5 1 calc R U P E 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'
Na Na 0.0362 0.0249 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Dy Dy -0.1892 4.4098 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
O3 Dy1 O10 89.87(6) . .
O3 Dy1 O1 80.97(8) . .
O10 Dy1 O1 74.50(6) . .
O3 Dy1 O5 107.15(8) . .
O10 Dy1 O5 149.07(6) . .
O1 Dy1 O5 132.58(9) . .
O3 Dy1 O6 76.96(9) . .
O10 Dy1 O6 141.12(5) . .
O1 Dy1 O6 67.44(8) . .
O5 Dy1 O6 69.26(8) . .
O3 Dy1 N1 153.70(9) . .
O10 Dy1 N1 88.11(7) . .
O1 Dy1 N1 73.23(9) . .
O5 Dy1 N1 87.26(9) . .
O6 Dy1 N1 88.35(10) . .
O3 Dy1 N2 139.22(11) . .
O10 Dy1 N2 83.38(9) . .
O1 Dy1 N2 134.32(10) . .
O5 Dy1 N2 66.78(10) . .
O6 Dy1 N2 129.64(11) . .
N1 Dy1 N2 66.48(12) . .
O3 Dy1 N3 72.11(8) . .
O10 Dy1 N3 82.54(6) . .
O1 Dy1 N3 144.47(8) . .
O5 Dy1 N3 78.64(9) . .
O6 Dy1 N3 125.65(9) . .
N1 Dy1 N3 133.41(10) . .
N2 Dy1 N3 67.14(11) . .
O3 Dy1 Na1 43.32(6) . .
O10 Dy1 Na1 101.38(2) . .
O1 Dy1 Na1 46.73(6) . .
O5 Dy1 Na1 108.73(6) . .
O6 Dy1 Na1 45.31(6) . .
N1 Dy1 Na1 111.67(8) . .
N2 Dy1 Na1 174.94(10) . .
N3 Dy1 Na1 114.92(7) . .
O11 Dy2 O13 80.87(10) . .
O11 Dy2 O17 78.88(19) . .
O13 Dy2 O17 86.04(19) . .
O11 Dy2 O15 106.49(11) . .
O13 Dy2 O15 129.95(10) . .
O17 Dy2 O15 143.89(19) . .
O11 Dy2 O16 72.55(11) . .
O13 Dy2 O16 67.16(10) . .
O17 Dy2 O16 143.2(2) . .
O15 Dy2 O16 68.39(9) . .
O11 Dy2 N5 71.83(11) . .
O13 Dy2 N5 148.23(11) . .
O17 Dy2 N5 73.22(17) . .
O15 Dy2 N5 74.80(10) . .
O16 Dy2 N5 117.40(11) . .
O11 Dy2 N6 138.68(12) . .
O13 Dy2 N6 135.32(12) . .
O17 Dy2 N6 84.1(2) . .
O15 Dy2 N6 68.30(10) . .
O16 Dy2 N6 132.69(11) . .
N5 Dy2 N6 67.26(13) . .
O11 Dy2 N7 152.17(11) . .
O13 Dy2 N7 71.42(10) . .
O17 Dy2 N7 96.31(16) . .
O15 Dy2 N7 93.58(10) . .
O16 Dy2 N7 98.25(11) . .
N5 Dy2 N7 133.44(12) . .
N6 Dy2 N7 66.58(13) . .
O11 Dy2 Na2 42.70(7) . .
O13 Dy2 Na2 43.82(8) . .
O17 Dy2 Na2 96.86(19) . .
O15 Dy2 Na2 111.27(7) . .
O16 Dy2 Na2 46.35(7) . .
N5 Dy2 Na2 114.04(9) . .
N6 Dy2 Na2 178.56(10) . .
N7 Dy2 Na2 112.19(8) . .
O3 Na1 O4 65.04(9) . .
O3 Na1 O6 74.76(9) . .
O4 Na1 O6 136.36(10) . .
O3 Na1 O8 106.73(10) . .
O4 Na1 O8 87.36(13) . .
O6 Na1 O8 88.53(11) . .
O3 Na1 O7 144.86(12) . .
O4 Na1 O7 84.97(12) . .
O6 Na1 O7 124.15(13) . .
O8 Na1 O7 51.25(11) . .
O3 Na1 O2 126.10(10) . .
O4 Na1 O2 107.24(11) . .
O6 Na1 O2 109.83(10) . .
O8 Na1 O2 126.71(11) . .
O7 Na1 O2 78.63(10) . .
O3 Na1 O1 74.36(8) . .
O4 Na1 O1 116.92(10) . .
O6 Na1 O1 64.24(8) . .
O8 Na1 O1 151.83(12) . .
O7 Na1 O1 138.99(11) . .
O2 Na1 O1 62.31(8) . .
O3 Na1 N4 127.70(11) . .
O4 Na1 N4 84.75(12) . .
O6 Na1 N4 108.43(12) . .
O8 Na1 N4 26.30(10) . .
O7 Na1 N4 24.98(10) . .
O2 Na1 N4 102.54(11) . .
O1 Na1 N4 155.79(12) . .
O3 Na1 Dy1 40.60(6) . .
O4 Na1 Dy1 103.70(7) . .
O6 Na1 Dy1 45.30(6) . .
O8 Na1 Dy1 122.23(9) . .
O7 Na1 Dy1 169.44(12) . .
O2 Na1 Dy1 104.02(7) . .
O1 Na1 Dy1 41.78(5) . .
N4 Na1 Dy1 148.13(10) . .
O18 Na2 O11 130.75(15) . .
O18 Na2 O14 92.26(13) . .
O11 Na2 O14 133.87(14) . .
O18 Na2 O13 150.76(15) . .
O11 Na2 O13 76.94(11) . .
O14 Na2 O13 65.92(10) . .
O18 Na2 O12 80.97(14) . .
O11 Na2 O12 65.92(10) . .
O14 Na2 O12 114.78(12) . .
O13 Na2 O12 124.99(13) . .
O18 Na2 O16 111.11(13) . .
O11 Na2 O16 70.67(10) . .
O14 Na2 O16 113.29(12) . .
O13 Na2 O16 64.89(10) . .
O12 Na2 O16 129.69(12) . .
O18 Na2 Dy2 154.04(12) . .
O11 Na2 Dy2 41.01(7) . .
O14 Na2 Dy2 107.02(8) . .
O13 Na2 Dy2 41.18(7) . .
O12 Na2 Dy2 105.35(8) . .
O16 Na2 Dy2 45.50(6) . .
C8 N1 C9 115.7(4) . .
C8 N1 Dy1 129.3(2) . .
C9 N1 Dy1 114.8(3) . .
C11 N2 C10 115.3(4) . .
C11 N2 Dy1 115.2(3) . .
C10 N2 Dy1 112.7(2) . .
C13 N3 C12 115.5(3) . .
C13 N3 Dy1 128.2(2) . .
C12 N3 Dy1 115.5(2) . .
O7 N4 O9 121.8(4) . .
O7 N4 O8 118.3(4) . .
O9 N4 O8 119.9(4) . .
O7 N4 Na1 58.9(2) . .
O9 N4 Na1 177.9(4) . .
O8 N4 Na1 59.5(2) . .
C43 N5 C44 115.8(4) . .
C43 N5 Dy2 130.5(3) . .
C44 N5 Dy2 113.7(3) . .
C46 N6 C45 115.2(4) . .
C46 N6 Dy2 114.3(3) . .
C45 N6 Dy2 112.1(3) . .
C48 N7 C47 115.1(4) . .
C48 N7 Dy2 129.9(3) . .
C47 N7 Dy2 114.3(3) . .
C1 O1 Dy1 137.7(2) . .
C1 O1 Na1 109.2(2) . .
Dy1 O1 Na1 91.49(8) . .
C2 O2 C7 117.0(3) . .
C2 O2 Na1 110.19(19) . .
C7 O2 Na1 121.1(3) . .
C14 O3 Dy1 139.0(2) . .
C14 O3 Na1 122.66(19) . .
Dy1 O3 Na1 96.08(9) . .
C19 O4 C20 117.6(3) . .
C19 O4 Na1 120.4(2) . .
C20 O4 Na1 121.9(2) . .
C21 O5 Dy1 137.6(2) . .
C23 O6 Dy1 136.0(2) . .
C23 O6 Na1 133.9(2) . .
Dy1 O6 Na1 89.40(9) . .
N4 O7 Na1 96.1(2) . .
N4 O8 Na1 94.2(2) . .
Dy1 O10 Dy1 180.0 . 3_656
C36 O11 Dy2 142.0(2) . .
C36 O11 Na2 121.5(2) . .
Dy2 O11 Na2 96.28(11) . .
C37 O12 C42 117.5(4) . .
C37 O12 Na2 117.6(2) . .
C42 O12 Na2 124.3(3) . .
C49 O13 Dy2 143.4(2) . .
C49 O13 Na2 117.6(2) . .
Dy2 O13 Na2 95.00(11) . .
C54 O14 C55 117.0(3) . .
C54 O14 Na2 119.3(2) . .
C55 O14 Na2 122.5(3) . .
C56 O15 Dy2 141.0(2) . .
C58 O16 Dy2 138.2(2) . .
C58 O16 Na2 131.7(2) . .
Dy2 O16 Na2 88.15(9) . .
Dy2 O17 Dy2 160.5(3) 3_655 .
O1 C1 C6 124.6(3) . .
O1 C1 C2 118.3(3) . .
C6 C1 C2 117.2(3) . .
O2 C2 C3 124.6(4) . .
O2 C2 C1 113.7(3) . .
C3 C2 C1 121.7(4) . .
C2 C3 C4 119.6(4) . .
C5 C4 C3 120.3(4) . .
C4 C5 C6 122.3(4) . .
C1 C6 C5 118.9(4) . .
C1 C6 C8 122.7(3) . .
C5 C6 C8 118.3(4) . .
N1 C8 C6 128.2(3) . .
N1 C9 C10 109.7(4) . .
N2 C10 C9 106.0(4) . .
N2 C11 C12 112.7(4) . .
N3 C12 C11 110.9(3) . .
N3 C13 C15 127.8(3) . .
O3 C14 C15 125.0(3) . .
O3 C14 C19 118.1(3) . .
C15 C14 C19 116.9(3) . .
C16 C15 C14 120.2(3) . .
C16 C15 C13 117.5(3) . .
C14 C15 C13 122.3(3) . .
C17 C16 C15 121.8(4) . .
C16 C17 C18 119.4(4) . .
C19 C18 C17 120.3(3) . .
O4 C19 C18 125.2(3) . .
O4 C19 C14 113.3(3) . .
C18 C19 C14 121.4(3) . .
O5 C21 C22 125.0(3) . .
O5 C21 C24 117.0(10) . .
C22 C21 C24 117.9(11) . .
O5 C21 C24' 116.7(10) . .
C22 C21 C24' 118.3(10) . .
C21 C22 C23 124.2(3) . .
O6 C23 C22 124.1(3) . .
O6 C23 C30 118.2(3) . .
C22 C23 C30 117.7(3) . .
C25 C24 C29 116.7(12) . .
C25 C24 C21 121.6(16) . .
C29 C24 C21 121.6(16) . .
C24 C25 C26 122.0(12) . .
C27 C26 C25 120.1(12) . .
C26 C27 C28 120.1(13) . .
C27 C28 C29 118.1(12) . .
C28 C29 C24 122.5(12) . .
C25' C24' C29' 118.6(10) . .
C25' C24' C21 119.9(15) . .
C29' C24' C21 121.5(17) . .
C24' C25' C26' 121.1(10) . .
C27' C26' C25' 119.8(9) . .
C26' C27' C28' 120.2(10) . .
C27' C28' C29' 119.7(10) . .
C28' C29' C24' 120.3(11) . .
C35 C30 C31 118.2(4) . .
C35 C30 C23 119.7(4) . .
C31 C30 C23 121.9(4) . .
C32 C31 C30 120.3(5) . .
C31 C32 C33 120.5(5) . .
C34 C33 C32 119.2(5) . .
C35 C34 C33 120.4(5) . .
C34 C35 C30 121.4(5) . .
O11 C36 C41 123.5(4) . .
O11 C36 C37 119.4(4) . .
C41 C36 C37 117.1(4) . .
C38 C37 O12 124.8(4) . .
C38 C37 C36 122.2(4) . .
O12 C37 C36 113.1(4) . .
C37 C38 C39 119.9(4) . .
C40 C39 C38 119.8(4) . .
C39 C40 C41 121.4(4) . .
C36 C41 C40 119.6(4) . .
C36 C41 C43 122.8(4) . .
C40 C41 C43 117.6(4) . .
N5 C43 C41 127.7(4) . .
N5 C44 C45 110.3(4) . .
N6 C45 C44 108.7(4) . .
N6 C46 C47 110.5(4) . .
C46 C47 N7 109.3(4) . .
N7 C48 C50 127.5(4) . .
O13 C49 C50 124.3(3) . .
O13 C49 C54 118.8(3) . .
C50 C49 C54 116.9(4) . .
C49 C50 C51 120.6(4) . .
C49 C50 C48 122.5(4) . .
C51 C50 C48 116.9(4) . .
C52 C51 C50 120.9(4) . .
C51 C52 C53 119.7(4) . .
C54 C53 C52 120.3(4) . .
O14 C54 C53 125.9(4) . .
O14 C54 C49 112.5(3) . .
C53 C54 C49 121.5(4) . .
O15 C56 C57 124.1(3) . .
O15 C56 C59 115.8(3) . .
C57 C56 C59 120.1(3) . .
C58 C57 C56 122.8(3) . .
O16 C58 C57 124.2(3) . .
O16 C58 C65 116.0(3) . .
C57 C58 C65 119.9(4) . .
C60 C59 C64 118.5(3) . .
C60 C59 C56 119.3(3) . .
C64 C59 C56 122.2(3) . .
C59 C60 C61 121.2(4) . .
C62 C61 C60 119.3(4) . .
C61 C62 C63 120.5(4) . .
C64 C63 C62 119.9(4) . .
C63 C64 C59 120.6(4) . .
C66 C65 C70 119.2(4) . .
C66 C65 C58 122.6(4) . .
C70 C65 C58 118.2(4) . .
C65 C66 C67 119.7(5) . .
C68 C67 C66 119.7(6) . .
C69 C68 C67 121.0(5) . .
C70 C69 C68 119.9(6) . .
C69 C70 C65 120.5(6) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Dy1 O3 2.253(2) .
Dy1 O10 2.27254(14) .
Dy1 O1 2.294(2) .
Dy1 O5 2.405(2) .
Dy1 O6 2.447(2) .
Dy1 N1 2.515(3) .
Dy1 N2 2.545(3) .
Dy1 N3 2.563(3) .
Dy1 Na1 3.4422(13) .
Dy2 O11 2.268(3) .
Dy2 O13 2.270(3) .
Dy2 O17 2.299(8) .
Dy2 O15 2.362(2) .
Dy2 O16 2.451(3) .
Dy2 N5 2.549(4) .
Dy2 N6 2.554(3) .
Dy2 N7 2.569(4) .
Dy2 Na2 3.4348(14) .
Na1 O3 2.375(3) .
Na1 O4 2.435(3) .
Na1 O6 2.447(3) .
Na1 O8 2.480(3) .
Na1 O7 2.473(4) .
Na1 O2 2.503(3) .
Na1 O1 2.507(3) .
Na1 N4 2.871(4) .
Na2 O18 2.338(4) .
Na2 O11 2.343(3) .
Na2 O14 2.367(3) .
Na2 O13 2.387(3) .
Na2 O12 2.453(3) .
Na2 O16 2.487(3) .
N1 C8 1.277(5) .
N1 C9 1.466(5) .
N2 C11 1.430(6) .
N2 C10 1.447(5) .
N3 C13 1.273(5) .
N3 C12 1.468(4) .
N4 O7 1.220(5) .
N4 O9 1.233(5) .
N4 O8 1.275(5) .
N5 C43 1.259(6) .
N5 C44 1.479(5) .
N6 C46 1.433(7) .
N6 C45 1.451(6) .
N7 C48 1.277(6) .
N7 C47 1.485(5) .
O1 C1 1.297(4) .
O2 C2 1.364(5) .
O2 C7 1.422(5) .
O3 C14 1.298(4) .
O4 C19 1.363(4) .
O4 C20 1.436(4) .
O5 C21 1.271(4) .
O6 C23 1.259(4) .
O10 Dy1 2.27257(14) 3_656
O11 C36 1.300(5) .
O12 C37 1.376(5) .
O12 C42 1.428(5) .
O13 C49 1.289(5) .
O14 C54 1.365(5) .
O14 C55 1.429(4) .
O15 C56 1.266(4) .
O16 C58 1.247(5) .
O17 Dy2 2.284(8) 3_655
C1 C6 1.409(5) .
C1 C2 1.427(5) .
C2 C3 1.374(5) .
C3 C4 1.383(7) .
C4 C5 1.344(7) .
C5 C6 1.406(6) .
C6 C8 1.449(6) .
C9 C10 1.502(7) .
C11 C12 1.516(7) .
C13 C15 1.457(5) .
C14 C15 1.406(5) .
C14 C19 1.433(4) .
C15 C16 1.404(5) .
C16 C17 1.365(6) .
C17 C18 1.395(6) .
C18 C19 1.380(5) .
C21 C22 1.383(5) .
C21 C24 1.477(14) .
C21 C24' 1.530(12) .
C22 C23 1.402(5) .
C23 C30 1.492(5) .
C24 C25 1.35(2) .
C24 C29 1.38(2) .
C25 C26 1.398(11) .
C26 C27 1.336(15) .
C27 C28 1.383(17) .
C28 C29 1.387(11) .
C24' C25' 1.35(2) .
C24' C29' 1.39(2) .
C25' C26' 1.408(9) .
C26' C27' 1.338(14) .
C27' C28' 1.382(16) .
C28' C29' 1.389(11) .
C30 C35 1.373(6) .
C30 C31 1.399(6) .
C31 C32 1.366(7) .
C32 C33 1.391(8) .
C33 C34 1.366(8) .
C34 C35 1.370(7) .
C36 C41 1.402(5) .
C36 C37 1.429(5) .
C37 C38 1.370(6) .
C38 C39 1.386(7) .
C39 C40 1.372(7) .
C40 C41 1.417(6) .
C41 C43 1.465(6) .
C44 C45 1.492(8) .
C46 C47 1.499(8) .
C48 C50 1.458(5) .
C49 C50 1.401(5) .
C49 C54 1.439(5) .
C50 C51 1.404(6) .
C51 C52 1.369(7) .
C52 C53 1.406(7) .
C53 C54 1.358(6) .
C56 C57 1.395(5) .
C56 C59 1.500(5) .
C57 C58 1.396(5) .
C58 C65 1.506(5) .
C59 C60 1.381(5) .
C59 C64 1.390(5) .
C60 C61 1.389(5) .
C61 C62 1.366(6) .
C62 C63 1.385(6) .
C63 C64 1.374(6) .
C65 C66 1.379(7) .
C65 C70 1.400(7) .
C66 C67 1.399(7) .
C67 C68 1.378(9) .
C68 C69 1.356(10) .
C69 C70 1.377(7) .
O19 C71 1.643(15) .
O20 C72 1.716(14) .
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
O9 N4 O7 Na1 -177.8(5)
O8 N4 O7 Na1 3.9(5)
O7 N4 O8 Na1 -3.9(5)
O9 N4 O8 Na1 177.7(5)
Dy1 O1 C1 C6 24.7(5)
Na1 O1 C1 C6 139.7(3)
Dy1 O1 C1 C2 -155.5(3)
Na1 O1 C1 C2 -40.4(3)
C7 O2 C2 C3 1.1(6)
Na1 O2 C2 C3 -142.6(3)
C7 O2 C2 C1 179.8(4)
Na1 O2 C2 C1 36.1(4)
O1 C1 C2 O2 3.2(5)
C6 C1 C2 O2 -177.0(3)
O1 C1 C2 C3 -178.1(4)
C6 C1 C2 C3 1.8(5)
O2 C2 C3 C4 177.8(4)
C1 C2 C3 C4 -0.8(7)
C2 C3 C4 C5 -0.1(8)
C3 C4 C5 C6 -0.1(9)
O1 C1 C6 C5 177.9(4)
C2 C1 C6 C5 -2.0(5)
O1 C1 C6 C8 -1.5(5)
C2 C1 C6 C8 178.6(3)
C4 C5 C6 C1 1.2(7)
C4 C5 C6 C8 -179.3(5)
C9 N1 C8 C6 178.7(4)
Dy1 N1 C8 C6 3.3(6)
C1 C6 C8 N1 -11.1(6)
C5 C6 C8 N1 169.4(4)
C8 N1 C9 C10 -136.2(4)
Dy1 N1 C9 C10 39.8(4)
C11 N2 C10 C9 -172.2(4)
Dy1 N2 C10 C9 52.7(4)
N1 C9 C10 N2 -60.7(5)
C10 N2 C11 C12 -174.5(3)
Dy1 N2 C11 C12 -40.6(5)
C13 N3 C12 C11 137.2(4)
Dy1 N3 C12 C11 -34.0(4)
N2 C11 C12 N3 49.3(5)
C12 N3 C13 C15 179.4(3)
Dy1 N3 C13 C15 -10.7(5)
Dy1 O3 C14 C15 25.0(5)
Na1 O3 C14 C15 -176.9(2)
Dy1 O3 C14 C19 -154.5(2)
Na1 O3 C14 C19 3.7(4)
O3 C14 C15 C16 179.5(3)
C19 C14 C15 C16 -1.1(5)
O3 C14 C15 C13 -0.1(5)
C19 C14 C15 C13 179.3(3)
N3 C13 C15 C16 176.4(3)
N3 C13 C15 C14 -4.0(5)
C14 C15 C16 C17 0.9(5)
C13 C15 C16 C17 -179.5(3)
C15 C16 C17 C18 -0.2(6)
C16 C17 C18 C19 -0.2(6)
C20 O4 C19 C18 -7.9(5)
Na1 O4 C19 C18 175.3(3)
C20 O4 C19 C14 170.3(3)
Na1 O4 C19 C14 -6.5(4)
C17 C18 C19 O4 177.9(3)
C17 C18 C19 C14 -0.1(5)
O3 C14 C19 O4 2.0(4)
C15 C14 C19 O4 -177.5(3)
O3 C14 C19 C18 -179.8(3)
C15 C14 C19 C18 0.7(5)
Dy1 O5 C21 C22 9.0(5)
Dy1 O5 C21 C24 -168(2)
Dy1 O5 C21 C24' -171.5(19)
O5 C21 C22 C23 3.4(6)
C24 C21 C22 C23 -180(2)
C24' C21 C22 C23 -176.1(19)
Dy1 O6 C23 C22 -21.6(6)
Na1 O6 C23 C22 145.9(3)
Dy1 O6 C23 C30 156.2(3)
Na1 O6 C23 C30 -36.3(5)
C21 C22 C23 O6 2.9(6)
C21 C22 C23 C30 -175.0(3)
O5 C21 C24 C25 45(5)
C22 C21 C24 C25 -132(3)
C24' C21 C24 C25 131(33)
O5 C21 C24 C29 -135(3)
C22 C21 C24 C29 48(5)
C24' C21 C24 C29 -49(26)
C29 C24 C25 C26 -1(5)
C21 C24 C25 C26 179(3)
C24 C25 C26 C27 -1(4)
C25 C26 C27 C28 6(4)
C26 C27 C28 C29 -8(3)
C27 C28 C29 C24 6(4)
C25 C24 C29 C28 -2(5)
C21 C24 C29 C28 179(3)
O5 C21 C24' C25' 2(4)
C22 C21 C24' C25' -178(2)
C24 C21 C24' C25' -94(27)
O5 C21 C24' C29' -179(2)
C22 C21 C24' C29' 1(4)
C24 C21 C24' C29' 85(32)
C29' C24' C25' C26' -1(5)
C21 C24' C25' C26' 178(2)
C24' C25' C26' C27' 4(3)
C25' C26' C27' C28' -6(3)
C26' C27' C28' C29' 6(3)
C27' C28' C29' C24' -2(3)
C25' C24' C29' C28' 0(5)
C21 C24' C29' C28' -179(2)
O6 C23 C30 C35 -34.7(6)
C22 C23 C30 C35 143.3(4)
O6 C23 C30 C31 150.0(4)
C22 C23 C30 C31 -32.0(6)
C35 C30 C31 C32 1.4(8)
C23 C30 C31 C32 176.7(5)
C30 C31 C32 C33 -1.2(10)
C31 C32 C33 C34 0.8(12)
C32 C33 C34 C35 -0.6(12)
C33 C34 C35 C30 0.9(11)
C31 C30 C35 C34 -1.2(9)
C23 C30 C35 C34 -176.7(6)
Dy2 O11 C36 C41 18.4(8)
Na2 O11 C36 C41 -169.2(3)
Dy2 O11 C36 C37 -162.2(4)
Na2 O11 C36 C37 10.2(6)
C42 O12 C37 C38 -6.6(7)
Na2 O12 C37 C38 165.8(4)
C42 O12 C37 C36 173.5(5)
Na2 O12 C37 C36 -14.2(5)
O11 C36 C37 C38 -176.7(5)
C41 C36 C37 C38 2.7(7)
O11 C36 C37 O12 3.2(6)
C41 C36 C37 O12 -177.4(4)
O12 C37 C38 C39 179.9(5)
C36 C37 C38 C39 -0.2(7)
C37 C38 C39 C40 -1.3(8)
C38 C39 C40 C41 0.3(8)
O11 C36 C41 C40 175.7(4)
C37 C36 C41 C40 -3.6(7)
O11 C36 C41 C43 -5.0(7)
C37 C36 C41 C43 175.7(4)
C39 C40 C41 C36 2.2(7)
C39 C40 C41 C43 -177.1(5)
C44 N5 C43 C41 -177.7(5)
Dy2 N5 C43 C41 0.4(8)
C36 C41 C43 N5 -2.7(8)
C40 C41 C43 N5 176.6(5)
C43 N5 C44 C45 139.8(4)
Dy2 N5 C44 C45 -38.6(4)
C46 N6 C45 C44 176.4(4)
Dy2 N6 C45 C44 -50.6(4)
N5 C44 C45 N6 59.5(5)
C45 N6 C46 C47 178.3(4)
Dy2 N6 C46 C47 46.4(5)
N6 C46 C47 N7 -56.6(5)
C48 N7 C47 C46 -132.2(4)
Dy2 N7 C47 C46 39.3(5)
C47 N7 C48 C50 -178.7(4)
Dy2 N7 C48 C50 11.4(6)
Dy2 O13 C49 C50 9.0(7)
Na2 O13 C49 C50 159.4(3)
Dy2 O13 C49 C54 -171.5(3)
Na2 O13 C49 C54 -21.1(4)
O13 C49 C50 C51 176.2(4)
C54 C49 C50 C51 -3.3(6)
O13 C49 C50 C48 -4.2(6)
C54 C49 C50 C48 176.3(4)
N7 C48 C50 C49 -5.9(7)
N7 C48 C50 C51 173.8(4)
C49 C50 C51 C52 1.6(7)
C48 C50 C51 C52 -178.0(4)
C50 C51 C52 C53 0.8(8)
C51 C52 C53 C54 -1.4(8)
C55 O14 C54 C53 4.2(6)
Na2 O14 C54 C53 -163.5(3)
C55 O14 C54 C49 -175.7(4)
Na2 O14 C54 C49 16.6(4)
C52 C53 C54 O14 179.6(4)
C52 C53 C54 C49 -0.5(7)
O13 C49 C54 O14 3.2(5)
C50 C49 C54 O14 -177.3(3)
O13 C49 C54 C53 -176.7(4)
C50 C49 C54 C53 2.8(6)
Dy2 O15 C56 C57 -11.0(6)
Dy2 O15 C56 C59 171.6(2)
O15 C56 C57 C58 4.4(5)
C59 C56 C57 C58 -178.3(3)
Dy2 O16 C58 C57 -14.1(6)
Na2 O16 C58 C57 144.6(3)
Dy2 O16 C58 C65 164.6(3)
Na2 O16 C58 C65 -36.7(5)
C56 C57 C58 O16 7.0(6)
C56 C57 C58 C65 -171.7(3)
O15 C56 C59 C60 26.6(4)
C57 C56 C59 C60 -150.9(3)
O15 C56 C59 C64 -154.0(3)
C57 C56 C59 C64 28.5(5)
C64 C59 C60 C61 0.5(5)
C56 C59 C60 C61 -180.0(3)
C59 C60 C61 C62 0.1(6)
C60 C61 C62 C63 0.7(6)
C61 C62 C63 C64 -2.1(6)
C62 C63 C64 C59 2.7(6)
C60 C59 C64 C63 -1.9(5)
C56 C59 C64 C63 178.6(3)
O16 C58 C65 C66 156.0(4)
C57 C58 C65 C66 -25.2(6)
O16 C58 C65 C70 -25.9(5)
C57 C58 C65 C70 152.9(4)
C70 C65 C66 C67 1.0(6)
C58 C65 C66 C67 179.1(4)
C65 C66 C67 C68 -1.4(7)
C66 C67 C68 C69 1.7(9)
C67 C68 C69 C70 -1.4(9)
C68 C69 C70 C65 0.9(9)
C66 C65 C70 C69 -0.7(7)
C58 C65 C70 C69 -178.9(4)
