#------------------------------------------------------------------------------
#$Date: 2016-03-25 23:34:43 +0200 (Fri, 25 Mar 2016) $
#$Revision: 180045 $
#$URL: svn://www.crystallography.net/cod/cif/7/03/39/7033923.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_7033923
loop_
_publ_author_name
'Wang, Xiufeng'
'Li, Yungai'
'Hu, Peng'
'Wang, Juanjuan'
'Li, Licun'
_publ_section_title
;
 Slow magnetic relaxation and field-induced metamagnetism in nitronyl
 nitroxide-Dy(iii) magnetic chains.
;
_journal_issue                   10
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              4560
_journal_page_last               4567
_journal_paper_doi               10.1039/c4dt01878h
_journal_volume                  44
_journal_year                    2015
_chemical_formula_sum            'C30 H24 Dy F18 N2 O10'
_chemical_formula_weight         1077.01
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_audit_update_record
;
2014-06-20 deposited with the CCDC.
2015-01-16 downloaded from the CCDC.
;
_cell_angle_alpha                90.00
_cell_angle_beta                 117.44(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   22.252(5)
_cell_length_b                   16.508(3)
_cell_length_c                   23.322(5)
_cell_measurement_reflns_used    23770
_cell_measurement_temperature    113(2)
_cell_measurement_theta_max      27.9060
_cell_measurement_theta_min      1.5778
_cell_volume                     7603(3)
_computing_cell_refinement       'CrystalClear (Rigaku/MSC Inc., 2005)'
_computing_data_collection       'CrystalClear (Rigaku/MSC Inc., 2005)'
_computing_data_reduction        'CrystalClear (Rigaku/MSC Inc., 2005)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      113(2)
_diffrn_measured_fraction_theta_full 0.991
_diffrn_measured_fraction_theta_max 0.991
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'profile data from ω-scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0796
_diffrn_reflns_av_sigmaI/netI    0.0693
_diffrn_reflns_limit_h_max       26
_diffrn_reflns_limit_h_min       -26
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_l_max       27
_diffrn_reflns_limit_l_min       -27
_diffrn_reflns_number            61405
_diffrn_reflns_theta_full        25.01
_diffrn_reflns_theta_max         25.01
_diffrn_reflns_theta_min         1.58
_exptl_absorpt_coefficient_mu    2.110
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.5739
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   CrystalClear
_exptl_crystal_colour            green
_exptl_crystal_density_diffrn    1.882
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Prism
_exptl_crystal_F_000             4208
_exptl_crystal_size_max          0.15
_exptl_crystal_size_mid          0.12
_exptl_crystal_size_min          0.10
_refine_diff_density_max         6.600
_refine_diff_density_min         -3.250
_refine_diff_density_rms         0.171
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.063
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1111
_refine_ls_number_reflns         13286
_refine_ls_number_restraints     42
_refine_ls_restrained_S_all      1.086
_refine_ls_R_factor_all          0.0755
_refine_ls_R_factor_gt           0.0659
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0500P)²+60.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1376
_refine_ls_wR_factor_ref         0.1430
_reflns_number_gt                11289
_reflns_number_total             13286
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c4dt01878h2.cif
_cod_data_source_block           Dy
_cod_depositor_comments
;
The following automatic conversions were performed:

'_exptl_absorpt_correction_type' value 'Multi-scan' changed to
'multi-scan' according to
/usr/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 3008 2015-01-20 13:52:24Z robertas 

 Adding full bibliography for 7033922--7033925.cif.
;
_cod_original_sg_symbol_H-M      P21/c
_cod_database_code               7033923
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
Dy1 Dy 0.009019(16) 0.63314(2) 0.738437(16) 0.01567(11) Uani 1 1 d .
Dy2 Dy 0.488360(16) 0.32325(2) 0.752564(14) 0.01319(10) Uani 1 1 d .
O1 O -0.0554(3) 1.0028(3) 0.7434(3) 0.0274(13) Uani 1 1 d .
O2 O -0.0046(3) 0.7369(3) 0.8022(2) 0.0244(12) Uani 1 1 d .
O3 O 0.0998(3) 0.8478(4) 0.8906(2) 0.0298(14) Uani 1 1 d .
O4 O 0.2462(3) 0.8880(4) 0.7903(3) 0.0366(15) Uani 1 1 d .
O5 O 0.0109(3) 0.5841(3) 0.8353(2) 0.0218(12) Uani 1 1 d .
O6 O 0.1204(3) 0.6454(3) 0.8185(2) 0.0238(12) Uani 1 1 d .
O7 O -0.1039(2) 0.5967(3) 0.7004(2) 0.0183(11) Uani 1 1 d .
O8 O -0.0254(3) 0.5699(3) 0.6371(2) 0.0234(12) Uani 1 1 d .
O9 O -0.0519(3) 0.7377(3) 0.6661(2) 0.0225(12) Uani 1 1 d .
O10 O 0.0765(3) 0.6820(3) 0.6935(2) 0.0242(12) Uani 1 1 d .
O11 O 0.4912(3) 0.7151(3) 0.8027(2) 0.0218(12) Uani 1 1 d .
O12 O 0.4399(3) 0.4540(3) 0.7276(2) 0.0212(12) Uani 1 1 d U
O13 O 0.5927(3) 0.6038(4) 0.8885(2) 0.0302(14) Uani 1 1 d .
O14 O 0.7483(3) 0.5636(4) 0.7990(3) 0.0369(15) Uani 1 1 d .
O15 O 0.5117(2) 0.3912(3) 0.8497(2) 0.0174(11) Uani 1 1 d .
O16 O 0.6019(2) 0.3613(3) 0.7996(2) 0.0184(11) Uani 1 1 d .
O17 O 0.4940(3) 0.3700(3) 0.6594(2) 0.0197(11) Uani 1 1 d .
O18 O 0.3802(3) 0.3088(3) 0.6669(2) 0.0219(12) Uani 1 1 d .
O19 O 0.4159(3) 0.2739(4) 0.7916(2) 0.0255(13) Uani 1 1 d .
O20 O 0.5493(2) 0.2233(3) 0.8318(2) 0.0185(11) Uani 1 1 d .
N1 N -0.0574(3) 0.9323(4) 0.7654(3) 0.0206(14) Uani 1 1 d .
N2 N -0.0337(3) 0.8063(4) 0.7918(3) 0.0177(13) Uani 1 1 d .
N3 N 0.4610(3) 0.6458(4) 0.7873(3) 0.0188(14) Uani 1 1 d .
N4 N 0.4375(3) 0.5233(4) 0.7521(3) 0.0164(13) Uani 1 1 d .
F32 F 0.6620(2) 0.1834(3) 0.9395(2) 0.0344(12) Uani 1 1 d .
F33 F 0.6040(3) 0.1468(4) 0.9870(2) 0.0523(17) Uani 1 1 d .
F20 F 0.7374(2) 0.2875(3) 0.8916(3) 0.0406(13) Uani 1 1 d .
F25 F 0.5221(3) 0.4726(4) 0.5840(2) 0.0529(17) Uani 1 1 d .
F31 F 0.6014(3) 0.0751(3) 0.9096(3) 0.0416(13) Uani 1 1 d .
F24 F 0.4947(3) 0.4238(5) 0.9492(2) 0.066(2) Uani 1 1 d .
F28 F 0.2500(3) 0.3839(5) 0.6048(5) 0.108(3) Uani 1 1 d U
F4 F 0.0826(3) 0.5327(4) 0.9988(2) 0.0562(18) Uani 1 1 d .
F5 F -0.0021(3) 0.6127(3) 0.9490(3) 0.0541(17) Uani 1 1 d .
F15 F -0.1381(3) 0.4945(4) 0.4844(2) 0.0487(15) Uani 1 1 d .
F27 F 0.4324(3) 0.4342(4) 0.4998(2) 0.0627(19) Uani 1 1 d .
F23 F 0.5828(4) 0.3543(4) 1.0023(3) 0.0625(19) Uani 1 1 d .
F19 F 0.7605(2) 0.4127(4) 0.9213(2) 0.0454(15) Uani 1 1 d .
F21 F 0.7296(2) 0.3783(3) 0.8229(2) 0.0347(12) Uani 1 1 d .
F22 F 0.5921(3) 0.4793(4) 0.9948(3) 0.0570(18) Uani 1 1 d .
F18 F -0.2273(2) 0.5780(3) 0.6896(2) 0.0349(12) Uani 1 1 d .
F16 F -0.2398(2) 0.6682(3) 0.6187(2) 0.0358(13) Uani 1 1 d .
F17 F -0.2684(2) 0.5456(3) 0.5896(2) 0.0372(13) Uani 1 1 d .
F6 F -0.0088(3) 0.4892(4) 0.9204(2) 0.0481(15) Uani 1 1 d .
F12 F -0.1670(2) 0.7909(3) 0.5678(2) 0.0372(12) Uani 1 1 d .
F11 F -0.1149(3) 0.8323(4) 0.5155(2) 0.0479(16) Uani 1 1 d .
F14 F -0.0326(3) 0.4742(4) 0.5387(2) 0.0528(17) Uani 1 1 d .
F10 F -0.1025(3) 0.8944(3) 0.6010(2) 0.0381(12) Uani 1 1 d .
F3 F 0.2582(3) 0.6792(4) 0.9396(4) 0.074(2) Uani 1 1 d .
F2 F 0.2469(3) 0.6177(6) 0.8539(3) 0.089(3) Uani 1 1 d U
F1 F 0.2584(3) 0.5522(4) 0.9353(3) 0.0544(16) Uani 1 1 d .
F34 F 0.3099(3) 0.2267(5) 0.8080(3) 0.073(2) Uani 1 1 d .
F7 F 0.1806(3) 0.7297(6) 0.6746(3) 0.082(3) Uani 1 1 d .
F36 F 0.3570(4) 0.3195(6) 0.8740(5) 0.102(3) Uani 1 1 d .
F9 F 0.1165(3) 0.7737(5) 0.5826(4) 0.084(2) Uani 1 1 d U
F8 F 0.1257(4) 0.6473(5) 0.6004(4) 0.093(3) Uani 1 1 d U
F35 F 0.3727(3) 0.2006(6) 0.9059(4) 0.099(3) Uani 1 1 d U
C35 C 0.5676(4) 0.5490(5) 0.7282(4) 0.0211(17) Uani 1 1 d .
C39 C 0.4867(4) 0.5798(4) 0.7724(3) 0.0171(15) Uani 1 1 d .
C49 C 0.4501(4) 0.3811(5) 0.6020(3) 0.0248(18) Uani 1 1 d .
C57 C 0.5658(4) 0.3995(5) 0.9004(3) 0.0198(16) Uani 1 1 d .
C60 C 0.7185(4) 0.3633(5) 0.8727(4) 0.0256(18) Uani 1 1 d .
C54 C 0.5422(4) 0.1990(5) 0.8799(3) 0.0187(16) Uani 1 1 d .
C32 C 0.6864(4) 0.5668(5) 0.7959(4) 0.0261(18) Uani 1 1 d .
C9 C -0.0103(4) 0.8746(5) 0.7788(4) 0.0202(16) Uani 1 1 d .
H35 H 0.5318 0.5345 0.6887 0.025 Uiso 1 1 calc R
C41 C 0.3979(4) 0.6287(5) 0.7931(4) 0.0226(17) Uani 1 1 d .
C59 C 0.6439(4) 0.3746(5) 0.8568(3) 0.0207(17) Uani 1 1 d .
F30 F 0.2522(3) 0.2596(4) 0.5909(3) 0.0637(19) Uani 1 1 d .
C45 C 0.3217(4) 0.5680(6) 0.6805(4) 0.033(2) Uani 1 1 d .
H45A H 0.3378 0.6122 0.6645 0.049 Uiso 1 1 calc R
H45B H 0.2787 0.5820 0.6779 0.049 Uiso 1 1 calc R
H45C H 0.3167 0.5207 0.6548 0.049 Uiso 1 1 calc R
C38 C 0.5547(4) 0.5724(5) 0.7793(3) 0.0172(15) Uani 1 1 d .
C58 C 0.6315(4) 0.3947(5) 0.9083(4) 0.0249(18) Uani 1 1 d .
H58 H 0.6678 0.4050 0.9486 0.030 Uiso 1 1 calc R
C36 C 0.6092(4) 0.5882(5) 0.8398(3) 0.0240(17) Uani 1 1 d .
C43 C 0.3471(4) 0.4848(5) 0.7796(4) 0.032(2) Uani 1 1 d .
H43A H 0.3339 0.4384 0.7516 0.049 Uiso 1 1 calc R
H43B H 0.3087 0.5045 0.7838 0.049 Uiso 1 1 calc R
H43C H 0.3824 0.4698 0.8213 0.049 Uiso 1 1 calc R
C50 C 0.4794(5) 0.4099(6) 0.5581(4) 0.040(3) Uani 1 1 d .
C34 C 0.6324(4) 0.5474(5) 0.7360(4) 0.0267(18) Uani 1 1 d .
H34 H 0.6405 0.5334 0.7015 0.032 Uiso 1 1 calc R
F26 F 0.5144(4) 0.3516(4) 0.5485(3) 0.067(2) Uani 1 1 d .
C33 C 0.6751(4) 0.5863(5) 0.8482(4) 0.0257(18) Uani 1 1 d .
H33 H 0.7113 0.5979 0.8883 0.031 Uiso 1 1 calc R
C55 C 0.6032(4) 0.1525(5) 0.9299(4) 0.0238(18) Uani 1 1 d .
C48 C 0.3807(5) 0.3686(5) 0.5751(4) 0.031(2) Uani 1 1 d .
H48 H 0.3533 0.3831 0.5323 0.038 Uiso 1 1 calc R
C47 C 0.3510(4) 0.3348(5) 0.6107(4) 0.0254(19) Uani 1 1 d .
C52 C 0.4269(4) 0.2433(5) 0.8443(4) 0.0248(18) Uani 1 1 d .
C53 C 0.4864(4) 0.2087(5) 0.8908(4) 0.0245(18) Uani 1 1 d .
H53 H 0.4889 0.1918 0.9299 0.029 Uiso 1 1 calc R
C44 C 0.3726(4) 0.5507(5) 0.7511(4) 0.0198(16) Uani 1 1 d .
C37 C 0.6463(5) 0.6253(6) 0.9506(4) 0.036(2) Uani 1 1 d .
H37A H 0.6677 0.6741 0.9470 0.055 Uiso 1 1 calc R
H37B H 0.6791 0.5823 0.9662 0.055 Uiso 1 1 calc R
H37C H 0.6281 0.6337 0.9803 0.055 Uiso 1 1 calc R
C40 C 0.4215(5) 0.6157(6) 0.8651(4) 0.037(2) Uani 1 1 d .
H40A H 0.4532 0.5716 0.8802 0.055 Uiso 1 1 calc R
H40B H 0.3833 0.6033 0.8721 0.055 Uiso 1 1 calc R
H40C H 0.4430 0.6641 0.8883 0.055 Uiso 1 1 calc R
C56 C 0.5576(4) 0.4160(5) 0.9615(3) 0.0254(18) Uani 1 1 d .
F29 F 0.2429(3) 0.3373(5) 0.5181(3) 0.087(3) Uani 1 1 d U
C31 C 0.8061(4) 0.5825(6) 0.8581(5) 0.044(2) Uani 1 1 d .
H31A H 0.8460 0.5794 0.8523 0.066 Uiso 1 1 calc R
H31B H 0.8097 0.5445 0.8907 0.066 Uiso 1 1 calc R
H31C H 0.8016 0.6363 0.8713 0.066 Uiso 1 1 calc R
C42 C 0.3511(5) 0.7008(5) 0.7689(5) 0.038(2) Uani 1 1 d .
H42A H 0.3724 0.7469 0.7957 0.056 Uiso 1 1 calc R
H42B H 0.3096 0.6889 0.7702 0.056 Uiso 1 1 calc R
H42C H 0.3417 0.7126 0.7252 0.056 Uiso 1 1 calc R
C46 C 0.2740(5) 0.3306(6) 0.5804(4) 0.037(2) Uani 1 1 d .
C3 C 0.1777(4) 0.8643(5) 0.8452(4) 0.0268(18) Uani 1 1 d .
H3 H 0.2152 0.8509 0.8838 0.032 Uiso 1 1 calc R
C2 C 0.1855(4) 0.8857(5) 0.7913(4) 0.0271(19) Uani 1 1 d .
C27 C 0.0575(4) 0.5765(5) 0.8916(3) 0.0230(17) Uani 1 1 d .
C17 C -0.0485(4) 0.7668(5) 0.6175(3) 0.0210(17) Uani 1 1 d .
C22 C -0.1499(4) 0.5778(4) 0.6456(3) 0.0180(16) Uani 1 1 d .
C8 C 0.0568(4) 0.8828(5) 0.7823(3) 0.0204(17) Uani 1 1 d .
C23 C -0.1444(4) 0.5531(5) 0.5915(3) 0.0228(17) Uani 1 1 d .
H23 H -0.1831 0.5380 0.5544 0.027 Uiso 1 1 calc R
F13 F -0.0704(4) 0.5933(4) 0.5015(3) 0.0591(18) Uani 1 1 d .
C24 C -0.0821(4) 0.5506(5) 0.5917(4) 0.0200(16) Uani 1 1 d .
C4 C 0.1295(4) 0.9071(5) 0.7333(4) 0.0277(19) Uani 1 1 d .
H4 H 0.1351 0.9224 0.6977 0.033 Uiso 1 1 calc R
C19 C 0.0636(4) 0.7189(5) 0.6423(4) 0.0249(18) Uani 1 1 d .
C15 C -0.0679(5) 0.8190(6) 0.8756(4) 0.039(2) Uani 1 1 d .
H15A H -0.0466 0.7680 0.8932 0.058 Uiso 1 1 calc R
H15B H -0.1047 0.8276 0.8856 0.058 Uiso 1 1 calc R
H15C H -0.0354 0.8619 0.8940 0.058 Uiso 1 1 calc R
C6 C 0.1136(4) 0.8633(5) 0.8406(3) 0.0218(17) Uani 1 1 d .
C26 C 0.0326(4) 0.5524(6) 0.9404(4) 0.030(2) Uani 1 1 d .
C25 C -0.0807(4) 0.5275(6) 0.5285(4) 0.031(2) Uani 1 1 d .
C16 C -0.1084(4) 0.8213(5) 0.5747(4) 0.0267(18) Uani 1 1 d .
C21 C -0.2217(4) 0.5917(5) 0.6367(4) 0.0249(18) Uani 1 1 d .
C28 C 0.1268(4) 0.5876(6) 0.9138(4) 0.034(2) Uani 1 1 d .
H28 H 0.1566 0.5743 0.9563 0.041 Uiso 1 1 calc R
C5 C 0.0659(4) 0.9053(5) 0.7296(4) 0.0245(18) Uani 1 1 d .
H5 H 0.0285 0.9194 0.6910 0.029 Uiso 1 1 calc R
C14 C -0.0949(4) 0.8182(5) 0.8024(4) 0.0230(17) Uani 1 1 d .
C29 C 0.1522(4) 0.6179(5) 0.8740(4) 0.0276(19) Uani 1 1 d .
C18 C 0.0040(4) 0.7592(5) 0.6012(4) 0.0253(18) Uani 1 1 d .
H18 H -0.0007 0.7811 0.5627 0.030 Uiso 1 1 calc R
C7 C 0.1548(5) 0.8247(6) 0.9515(4) 0.038(2) Uani 1 1 d .
H7A H 0.1766 0.7774 0.9457 0.057 Uiso 1 1 calc R
H7B H 0.1378 0.8129 0.9816 0.057 Uiso 1 1 calc R
H7C H 0.1870 0.8682 0.9679 0.057 Uiso 1 1 calc R
C11 C -0.1195(4) 0.9016(5) 0.7687(4) 0.0253(18) Uani 1 1 d .
C12 C -0.1370(5) 0.9650(6) 0.8072(5) 0.039(2) Uani 1 1 d .
H12A H -0.1734 0.9451 0.8146 0.058 Uiso 1 1 calc R
H12B H -0.1506 1.0146 0.7831 0.058 Uiso 1 1 calc R
H12C H -0.0979 0.9747 0.8479 0.058 Uiso 1 1 calc R
C10 C -0.1757(4) 0.8972(6) 0.6991(4) 0.039(2) Uani 1 1 d .
H10A H -0.1650 0.8560 0.6762 0.058 Uiso 1 1 calc R
H10B H -0.1796 0.9485 0.6783 0.058 Uiso 1 1 calc R
H10C H -0.2178 0.8843 0.6990 0.058 Uiso 1 1 calc R
C51 C 0.3666(4) 0.2461(7) 0.8585(4) 0.040(2) Uani 1 1 d .
C30 C 0.2301(5) 0.6184(7) 0.9003(4) 0.038(2) Uani 1 1 d .
C13 C -0.1439(4) 0.7489(5) 0.7735(5) 0.036(2) Uani 1 1 d .
H13A H -0.1548 0.7428 0.7289 0.054 Uiso 1 1 calc R
H13B H -0.1845 0.7599 0.7769 0.054 Uiso 1 1 calc R
H13C H -0.1236 0.6998 0.7964 0.054 Uiso 1 1 calc R
C1 C 0.3061(4) 0.8698(6) 0.8488(5) 0.042(2) Uani 1 1 d .
H1A H 0.3452 0.8770 0.8421 0.064 Uiso 1 1 calc R
H1B H 0.3042 0.8147 0.8611 0.064 Uiso 1 1 calc R
H1C H 0.3090 0.9055 0.8825 0.064 Uiso 1 1 calc R
C20 C 0.1221(5) 0.7184(6) 0.6246(4) 0.039(2) Uani 1 1 d .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Dy Dy -0.1892 4.4098 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
O18 Dy2 O16 154.26(17) . .
O18 Dy2 O19 70.80(17) . .
O16 Dy2 O19 134.83(16) . .
O18 Dy2 O15 123.76(18) . .
O16 Dy2 O15 73.06(17) . .
O19 Dy2 O15 71.21(18) . .
O18 Dy2 O17 73.54(18) . .
O16 Dy2 O17 80.74(17) . .
O19 Dy2 O17 144.27(18) . .
O15 Dy2 O17 130.19(18) . .
O18 Dy2 O12 73.04(18) . .
O16 Dy2 O12 98.20(18) . .
O19 Dy2 O12 95.48(19) . .
O15 Dy2 O12 71.07(17) . .
O17 Dy2 O12 71.76(17) . .
O18 Dy2 O11 80.63(19) . 2_646
O16 Dy2 O11 91.21(18) . 2_646
O19 Dy2 O11 106.9(2) . 2_646
O15 Dy2 O11 150.32(17) . 2_646
O17 Dy2 O11 68.95(17) . 2_646
O12 Dy2 O11 137.40(17) . 2_646
O18 Dy2 O20 126.08(18) . .
O16 Dy2 O20 73.48(17) . .
O19 Dy2 O20 72.77(17) . .
O15 Dy2 O20 77.86(17) . .
O17 Dy2 O20 133.47(17) . .
O12 Dy2 O20 148.89(16) . .
O11 Dy2 O20 73.52(17) 2_646 .
C49 O17 Dy2 133.1(5) . .
C57 O15 Dy2 130.7(5) . .
O12 N4 C39 125.3(6) . .
O12 N4 C44 119.6(6) . .
C39 N4 C44 114.6(6) . .
C59 O16 Dy2 131.8(5) . .
C54 O20 Dy2 130.4(5) . .
C47 O18 Dy2 134.6(5) . .
N4 O12 Dy2 143.9(4) . .
C52 O19 Dy2 132.0(5) . .
O11 N3 C39 124.0(6) . .
O11 N3 C41 122.1(6) . .
C39 N3 C41 113.4(6) . .
N4 C39 N3 106.1(6) . .
N4 C39 C38 128.1(7) . .
N3 C39 C38 125.8(7) . .
C36 O13 C37 118.0(6) . .
O17 C49 C48 128.1(7) . .
O17 C49 C50 113.5(7) . .
C48 C49 C50 118.4(7) . .
O15 C57 C58 128.0(7) . .
O15 C57 C56 115.1(6) . .
C58 C57 C56 116.9(6) . .
F21 C60 F20 108.2(7) . .
F21 C60 F19 106.7(7) . .
F20 C60 F19 107.2(7) . .
F21 C60 C59 112.7(6) . .
F20 C60 C59 109.6(7) . .
F19 C60 C59 112.2(7) . .
C32 O14 C31 119.3(7) . .
O20 C54 C53 127.8(7) . .
O20 C54 C55 113.9(6) . .
C53 C54 C55 118.2(6) . .
O14 C32 C33 123.7(8) . .
O14 C32 C34 115.5(7) . .
C33 C32 C34 120.8(7) . .
C34 C35 C38 120.6(7) . .
N3 C41 C42 109.3(7) . .
N3 C41 C40 105.3(6) . .
C42 C41 C40 110.6(7) . .
N3 C41 C44 100.3(6) . .
C42 C41 C44 115.5(7) . .
C40 C41 C44 114.7(7) . .
O16 C59 C58 128.1(7) . .
O16 C59 C60 115.5(6) . .
C58 C59 C60 116.3(6) . .
C36 C38 C35 119.2(7) . .
C36 C38 C39 118.1(6) . .
C35 C38 C39 122.7(7) . .
C57 C58 C59 121.0(7) . .
O13 C36 C33 123.8(7) . .
O13 C36 C38 115.7(7) . .
C33 C36 C38 120.5(7) . .
F26 C50 F27 107.0(7) . .
F26 C50 F25 106.7(9) . .
F27 C50 F25 106.6(7) . .
F26 C50 C49 110.8(8) . .
F27 C50 C49 113.5(8) . .
F25 C50 C49 111.8(7) . .
C35 C34 C32 119.6(7) . .
C36 C33 C32 119.1(7) . .
F32 C55 F33 107.6(7) . .
F32 C55 F31 106.9(6) . .
F33 C55 F31 105.6(7) . .
F32 C55 C54 113.4(7) . .
F33 C55 C54 113.4(6) . .
F31 C55 C54 109.5(6) . .
C49 C48 C47 121.7(7) . .
O18 C47 C48 127.4(8) . .
O18 C47 C46 113.8(8) . .
C48 C47 C46 118.8(7) . .
O19 C52 C53 128.4(7) . .
O19 C52 C51 114.2(7) . .
C53 C52 C51 117.4(7) . .
C54 C53 C52 121.0(7) . .
N4 C44 C43 109.2(6) . .
N4 C44 C45 107.6(6) . .
C43 C44 C45 111.3(7) . .
N4 C44 C41 100.0(6) . .
C43 C44 C41 114.6(6) . .
C45 C44 C41 113.3(7) . .
F24 C56 F22 109.1(8) . .
F24 C56 F23 106.9(7) . .
F22 C56 F23 104.3(7) . .
F24 C56 C57 112.8(6) . .
F22 C56 C57 113.5(7) . .
F23 C56 C57 109.7(7) . .
F28 C46 F29 108.7(9) . .
F28 C46 F30 104.9(10) . .
F29 C46 F30 103.2(8) . .
F28 C46 C47 111.8(8) . .
F29 C46 C47 115.1(9) . .
F30 C46 C47 112.4(7) . .
O6 Dy1 O7 153.32(17) . .
O6 Dy1 O10 70.29(18) . .
O7 Dy1 O10 136.30(17) . .
O6 Dy1 O1 73.6(2) . 2_546
O7 Dy1 O1 98.06(19) . 2_546
O10 Dy1 O1 94.46(19) . 2_546
O6 Dy1 O9 124.05(19) . .
O7 Dy1 O9 75.64(18) . .
O10 Dy1 O9 72.69(18) . .
O1 Dy1 O9 149.70(18) 2_546 .
O6 Dy1 O8 125.13(18) . .
O7 Dy1 O8 73.10(17) . .
O10 Dy1 O8 71.51(18) . .
O1 Dy1 O8 71.78(19) 2_546 .
O9 Dy1 O8 78.08(18) . .
O6 Dy1 O2 80.23(19) . .
O7 Dy1 O2 89.91(18) . .
O10 Dy1 O2 109.00(19) . .
O1 Dy1 O2 136.22(18) 2_546 .
O9 Dy1 O2 73.95(17) . .
O8 Dy1 O2 150.16(18) . .
O6 Dy1 O5 73.81(18) . .
O7 Dy1 O5 79.52(17) . .
O10 Dy1 O5 144.00(18) . .
O1 Dy1 O5 72.66(19) 2_546 .
O9 Dy1 O5 132.91(17) . .
O8 Dy1 O5 130.83(19) . .
O2 Dy1 O5 66.61(18) . .
C27 O5 Dy1 132.5(5) . .
C29 O6 Dy1 133.7(5) . .
C22 O7 Dy1 133.2(4) . .
N2 C9 N1 107.9(6) . .
N2 C9 C8 124.1(7) . .
N1 C9 C8 127.9(7) . .
O2 N2 C9 125.6(6) . .
O2 N2 C14 120.0(6) . .
C9 N2 C14 113.9(6) . .
C19 O10 Dy1 133.2(5) . .
C24 O8 Dy1 133.5(5) . .
C2 O4 C1 118.2(7) . .
C17 O9 Dy1 131.9(5) . .
N2 O2 Dy1 136.3(4) . .
C6 C3 C2 119.1(8) . .
O4 C2 C3 124.0(8) . .
O4 C2 C4 115.2(7) . .
C3 C2 C4 120.8(7) . .
C6 O3 C7 118.1(6) . .
O5 C27 C28 128.1(7) . .
O5 C27 C26 113.6(7) . .
C28 C27 C26 118.4(7) . .
O9 C17 C18 127.9(7) . .
O9 C17 C16 114.5(7) . .
C18 C17 C16 117.5(7) . .
O7 C22 C23 128.9(7) . .
O7 C22 C21 114.4(6) . .
C23 C22 C21 116.5(7) . .
C5 C8 C6 119.0(7) . .
C5 C8 C9 122.6(7) . .
C6 C8 C9 118.3(7) . .
C24 C23 C22 120.9(7) . .
O8 C24 C23 127.7(7) . .
O8 C24 C25 114.4(7) . .
C23 C24 C25 117.8(7) . .
C5 C4 C2 119.2(7) . .
O10 C19 C18 127.9(7) . .
O10 C19 C20 113.8(7) . .
C18 C19 C20 118.3(7) . .
O3 C6 C3 124.7(7) . .
O3 C6 C8 114.5(7) . .
C3 C6 C8 120.7(7) . .
F6 C26 F5 106.5(7) . .
F6 C26 F4 106.4(7) . .
F5 C26 F4 107.2(7) . .
F6 C26 C27 111.9(6) . .
F5 C26 C27 110.6(7) . .
F4 C26 C27 113.8(7) . .
F14 C25 F13 109.3(7) . .
F14 C25 F15 106.1(8) . .
F13 C25 F15 106.4(7) . .
F14 C25 C24 111.5(6) . .
F13 C25 C24 109.6(7) . .
F15 C25 C24 113.9(7) . .
F11 C16 F10 107.1(7) . .
F11 C16 F12 107.1(7) . .
F10 C16 F12 106.3(7) . .
F11 C16 C17 113.7(7) . .
F10 C16 C17 111.0(6) . .
F12 C16 C17 111.3(7) . .
F18 C21 F16 108.2(7) . .
F18 C21 F17 107.4(7) . .
F16 C21 F17 105.7(6) . .
F18 C21 C22 113.0(6) . .
F16 C21 C22 109.2(7) . .
F17 C21 C22 113.0(7) . .
C29 C28 C27 121.5(7) . .
C4 C5 C8 121.1(8) . .
N2 C14 C13 110.5(7) . .
N2 C14 C15 105.4(6) . .
C13 C14 C15 109.7(7) . .
N2 C14 C11 99.6(6) . .
C13 C14 C11 115.6(7) . .
C15 C14 C11 115.0(7) . .
O6 C29 C28 128.2(8) . .
O6 C29 C30 114.1(7) . .
C28 C29 C30 117.7(7) . .
C17 C18 C19 120.6(7) . .
N3 O11 Dy2 136.3(4) . 2_656
N1 C11 C10 106.4(6) . .
N1 C11 C12 106.5(6) . .
C10 C11 C12 110.4(7) . .
N1 C11 C14 101.8(6) . .
C10 C11 C14 114.9(7) . .
C12 C11 C14 115.6(7) . .
F35 C51 F34 107.7(9) . .
F35 C51 F36 105.6(9) . .
F34 C51 F36 105.2(9) . .
F35 C51 C52 114.5(8) . .
F34 C51 C52 112.2(8) . .
F36 C51 C52 111.1(8) . .
F2 C30 F3 111.3(9) . .
F2 C30 F1 105.5(9) . .
F3 C30 F1 105.1(7) . .
F2 C30 C29 111.7(7) . .
F3 C30 C29 111.6(8) . .
F1 C30 C29 111.3(8) . .
F7 C20 F9 106.5(8) . .
F7 C20 F8 106.1(9) . .
F9 C20 F8 107.7(9) . .
F7 C20 C19 112.4(7) . .
F9 C20 C19 113.6(8) . .
F8 C20 C19 110.2(8) . .
O1 N1 C9 124.8(6) . .
O1 N1 C11 121.9(7) . .
C9 N1 C11 112.7(6) . .
N1 O1 Dy1 149.0(5) . 2_556
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Dy2 O18 2.326(5) .
Dy2 O16 2.329(5) .
Dy2 O19 2.334(5) .
Dy2 O15 2.361(5) .
Dy2 O17 2.363(5) .
Dy2 O12 2.363(5) .
Dy2 O11 2.366(5) 2_646
Dy2 O20 2.381(5) .
O17 C49 1.255(9) .
O15 C57 1.247(9) .
N4 O12 1.289(8) .
N4 C39 1.347(9) .
N4 C44 1.503(9) .
F32 C55 1.324(9) .
O16 C59 1.247(8) .
O20 C54 1.267(8) .
F21 C60 1.316(9) .
O18 C47 1.242(9) .
O19 C52 1.245(9) .
N3 O11 1.291(8) .
N3 C39 1.348(9) .
N3 C41 1.499(9) .
F33 C55 1.326(9) .
C39 C38 1.452(10) .
F20 C60 1.328(10) .
F25 C50 1.345(10) .
F31 C55 1.356(10) .
O13 C36 1.370(9) .
O13 C37 1.433(9) .
C49 C48 1.389(12) .
C49 C50 1.521(11) .
F24 C56 1.300(9) .
C57 C58 1.390(10) .
C57 C56 1.542(10) .
C60 F19 1.360(9) .
C60 C59 1.537(10) .
O14 C32 1.348(9) .
O14 C31 1.420(11) .
F27 C50 1.339(11) .
F23 C56 1.328(10) .
C54 C53 1.385(10) .
C54 C55 1.529(10) .
C32 C33 1.391(11) .
C32 C34 1.397(11) .
F22 C56 1.318(10) .
C35 C34 1.368(11) .
C35 C38 1.401(10) .
C41 C42 1.509(11) .
C41 C40 1.525(11) .
C41 C44 1.558(11) .
C59 C58 1.391(10) .
F30 C46 1.335(11) .
C45 C44 1.536(11) .
C38 C36 1.398(10) .
C36 C33 1.388(11) .
C43 C44 1.516(10) .
C50 F26 1.320(12) .
C48 C47 1.393(12) .
C47 C46 1.524(12) .
C52 C53 1.390(11) .
C52 C51 1.524(11) .
F28 C46 1.291(11) .
F29 C46 1.293(10) .
Dy1 O6 2.325(5) .
Dy1 O7 2.325(5) .
Dy1 O10 2.335(5) .
Dy1 O1 2.340(5) 2_546
Dy1 O9 2.358(5) .
Dy1 O8 2.366(5) .
Dy1 O2 2.378(5) .
Dy1 O5 2.382(5) .
F18 C21 1.313(9) .
O5 C27 1.249(9) .
O6 C29 1.239(9) .
O7 C22 1.253(9) .
F16 C21 1.334(10) .
F17 C21 1.347(10) .
F6 C26 1.327(10) .
C9 N2 1.334(9) .
C9 N1 1.344(10) .
C9 C8 1.462(10) .
F12 C16 1.336(10) .
N2 O2 1.284(8) .
N2 C14 1.505(9) .
F11 C16 1.332(9) .
O10 C19 1.251(9) .
O8 C24 1.259(9) .
O4 C2 1.363(9) .
O4 C1 1.432(11) .
O9 C17 1.264(9) .
F10 C16 1.332(10) .
C3 C6 1.380(11) .
C3 C2 1.391(11) .
C2 C4 1.397(12) .
F4 C26 1.342(9) .
F5 C26 1.331(10) .
O3 C6 1.361(9) .
O3 C7 1.436(10) .
F15 C25 1.333(11) .
C27 C28 1.394(11) .
C27 C26 1.528(11) .
C17 C18 1.391(11) .
C17 C16 1.535(11) .
C22 C23 1.385(10) .
C22 C21 1.532(10) .
C8 C5 1.387(10) .
C8 C6 1.402(10) .
C23 C24 1.384(10) .
F13 C25 1.327(10) .
C24 C25 1.537(11) .
C4 C5 1.376(11) .
C19 C18 1.396(11) .
C19 C20 1.535(11) .
C15 C14 1.525(11) .
F14 C25 1.318(9) .
C28 C29 1.385(12) .
C14 C13 1.509(11) .
C14 C11 1.555(12) .
C29 C30 1.550(12) .
F3 C30 1.308(11) .
F2 C30 1.297(10) .
O11 Dy2 2.366(5) 2_656
F1 C30 1.336(11) .
F34 C51 1.309(11) .
F7 C20 1.302(11) .
F36 C51 1.310(13) .
F9 C20 1.303(10) .
F8 C20 1.320(12) .
F35 C51 1.290(10) .
C11 N1 1.508(9) .
C11 C10 1.528(11) .
C11 C12 1.539(11) .
N1 O1 1.280(8) .
O1 Dy1 2.340(5) 2_556
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_4
O18 Dy2 O17 C49 6.0(7) . .
O16 Dy2 O17 C49 -173.0(7) . .
O19 Dy2 O17 C49 2.3(8) . .
O15 Dy2 O17 C49 -114.6(7) . .
O12 Dy2 O17 C49 -71.1(7) . .
O11 Dy2 O17 C49 92.1(7) 2_646 .
O20 Dy2 O17 C49 130.5(6) . .
O18 Dy2 O15 C57 175.3(6) . .
O16 Dy2 O15 C57 -26.4(6) . .
O19 Dy2 O15 C57 125.5(7) . .
O17 Dy2 O15 C57 -87.9(7) . .
O12 Dy2 O15 C57 -131.6(7) . .
O11 Dy2 O15 C57 34.2(8) 2_646 .
O20 Dy2 O15 C57 49.8(6) . .
O18 Dy2 O16 C59 160.8(6) . .
O19 Dy2 O16 C59 -13.1(8) . .
O15 Dy2 O16 C59 25.8(7) . .
O17 Dy2 O16 C59 163.0(7) . .
O12 Dy2 O16 C59 93.1(7) . .
O11 Dy2 O16 C59 -128.6(7) 2_646 .
O20 Dy2 O16 C59 -56.2(7) . .
O18 Dy2 O20 C54 -75.3(7) . .
O16 Dy2 O20 C54 123.5(6) . .
O19 Dy2 O20 C54 -26.0(6) . .
O15 Dy2 O20 C54 47.8(6) . .
O17 Dy2 O20 C54 -177.3(6) . .
O12 Dy2 O20 C54 45.3(8) . .
O11 Dy2 O20 C54 -140.1(7) 2_646 .
O16 Dy2 O18 C47 -12.0(10) . .
O19 Dy2 O18 C47 163.5(8) . .
O15 Dy2 O18 C47 113.5(7) . .
O17 Dy2 O18 C47 -14.2(7) . .
O12 Dy2 O18 C47 61.2(7) . .
O11 Dy2 O18 C47 -84.9(7) 2_646 .
O20 Dy2 O18 C47 -146.5(7) . .
C39 N4 O12 Dy2 74.9(10) . .
C44 N4 O12 Dy2 -113.7(7) . .
O18 Dy2 O12 N4 146.5(8) . .
O16 Dy2 O12 N4 -58.3(8) . .
O19 Dy2 O12 N4 78.5(8) . .
O15 Dy2 O12 N4 10.6(7) . .
O17 Dy2 O12 N4 -135.7(8) . .
O11 Dy2 O12 N4 -159.2(7) 2_646 .
O20 Dy2 O12 N4 13.2(10) . .
O18 Dy2 O19 C52 166.4(8) . .
O16 Dy2 O19 C52 -16.4(9) . .
O15 Dy2 O19 C52 -55.8(7) . .
O17 Dy2 O19 C52 170.2(7) . .
O12 Dy2 O19 C52 -123.7(8) . .
O11 Dy2 O19 C52 93.0(8) 2_646 .
O20 Dy2 O19 C52 26.9(7) . .
O12 N4 C39 N3 173.0(6) . .
C44 N4 C39 N3 1.3(8) . .
O12 N4 C39 C38 -8.7(11) . .
C44 N4 C39 C38 179.5(7) . .
O11 N3 C39 N4 -173.2(6) . .
C41 N3 C39 N4 14.8(8) . .
O11 N3 C39 C38 8.5(11) . .
C41 N3 C39 C38 -163.6(7) . .
Dy2 O17 C49 C48 0.4(13) . .
Dy2 O17 C49 C50 -177.9(5) . .
Dy2 O15 C57 C58 23.2(13) . .
Dy2 O15 C57 C56 -155.9(5) . .
Dy2 O20 C54 C53 18.1(12) . .
Dy2 O20 C54 C55 -163.1(5) . .
C31 O14 C32 C33 -1.3(13) . .
C31 O14 C32 C34 180.0(8) . .
O11 N3 C41 C42 42.6(9) . .
C39 N3 C41 C42 -145.1(7) . .
O11 N3 C41 C40 -76.3(8) . .
C39 N3 C41 C40 96.0(7) . .
O11 N3 C41 C44 164.4(6) . .
C39 N3 C41 C44 -23.4(8) . .
Dy2 O16 C59 C58 -21.7(13) . .
Dy2 O16 C59 C60 155.2(5) . .
F21 C60 C59 O16 29.7(11) . .
F20 C60 C59 O16 -90.9(8) . .
F19 C60 C59 O16 150.1(7) . .
F21 C60 C59 C58 -153.1(8) . .
F20 C60 C59 C58 86.4(9) . .
F19 C60 C59 C58 -32.6(11) . .
C34 C35 C38 C36 -4.7(12) . .
C34 C35 C38 C39 176.2(7) . .
N4 C39 C38 C36 -123.2(8) . .
N3 C39 C38 C36 54.8(10) . .
N4 C39 C38 C35 55.9(11) . .
N3 C39 C38 C35 -126.1(8) . .
O15 C57 C58 C59 -3.5(14) . .
C56 C57 C58 C59 175.6(8) . .
O16 C59 C58 C57 2.4(14) . .
C60 C59 C58 C57 -174.5(8) . .
C37 O13 C36 C33 4.8(12) . .
C37 O13 C36 C38 -176.3(7) . .
C35 C38 C36 O13 -174.6(7) . .
C39 C38 C36 O13 4.6(11) . .
C35 C38 C36 C33 4.4(12) . .
C39 C38 C36 C33 -176.5(7) . .
O17 C49 C50 F26 69.7(10) . .
C48 C49 C50 F26 -108.8(10) . .
O17 C49 C50 F27 -169.9(7) . .
C48 C49 C50 F27 11.6(12) . .
O17 C49 C50 F25 -49.2(11) . .
C48 C49 C50 F25 132.2(9) . .
C38 C35 C34 C32 1.9(12) . .
O14 C32 C34 C35 -180.0(8) . .
C33 C32 C34 C35 1.3(13) . .
O13 C36 C33 C32 177.6(8) . .
C38 C36 C33 C32 -1.2(13) . .
O14 C32 C33 C36 179.8(8) . .
C34 C32 C33 C36 -1.6(13) . .
O20 C54 C55 F32 39.3(10) . .
C53 C54 C55 F32 -141.8(7) . .
O20 C54 C55 F33 162.4(7) . .
C53 C54 C55 F33 -18.6(11) . .
O20 C54 C55 F31 -79.9(8) . .
C53 C54 C55 F31 99.0(8) . .
O17 C49 C48 C47 -4.7(14) . .
C50 C49 C48 C47 173.6(8) . .
Dy2 O18 C47 C48 16.3(13) . .
Dy2 O18 C47 C46 -161.3(5) . .
C49 C48 C47 O18 -3.6(14) . .
C49 C48 C47 C46 173.9(8) . .
Dy2 O19 C52 C53 -19.4(14) . .
Dy2 O19 C52 C51 159.9(6) . .
O20 C54 C53 C52 5.2(14) . .
C55 C54 C53 C52 -173.6(8) . .
O19 C52 C53 C54 -5.1(15) . .
C51 C52 C53 C54 175.7(8) . .
O12 N4 C44 C43 52.0(8) . .
C39 N4 C44 C43 -135.7(7) . .
O12 N4 C44 C45 -68.9(8) . .
C39 N4 C44 C45 103.4(7) . .
O12 N4 C44 C41 172.6(6) . .
C39 N4 C44 C41 -15.1(7) . .
N3 C41 C44 N4 20.7(7) . .
C42 C41 C44 N4 137.9(7) . .
C40 C41 C44 N4 -91.6(7) . .
N3 C41 C44 C43 137.3(7) . .
C42 C41 C44 C43 -105.5(8) . .
C40 C41 C44 C43 25.0(10) . .
N3 C41 C44 C45 -93.6(7) . .
C42 C41 C44 C45 23.7(9) . .
C40 C41 C44 C45 154.1(7) . .
O15 C57 C56 F24 -4.2(11) . .
C58 C57 C56 F24 176.6(8) . .
O15 C57 C56 F22 -129.0(8) . .
C58 C57 C56 F22 51.8(11) . .
O15 C57 C56 F23 114.7(8) . .
C58 C57 C56 F23 -64.5(10) . .
O18 C47 C46 F28 72.3(11) . .
C48 C47 C46 F28 -105.5(10) . .
O18 C47 C46 F29 -163.1(8) . .
C48 C47 C46 F29 19.1(12) . .
O18 C47 C46 F30 -45.3(11) . .
C48 C47 C46 F30 136.9(9) . .
O6 Dy1 O5 C27 -0.8(7) . .
O7 Dy1 O5 C27 178.5(7) . .
O10 Dy1 O5 C27 3.5(9) . .
O1 Dy1 O5 C27 76.6(7) 2_546 .
O9 Dy1 O5 C27 -122.6(7) . .
O8 Dy1 O5 C27 121.9(7) . .
O2 Dy1 O5 C27 -87.0(7) . .
O7 Dy1 O6 C29 12.6(10) . .
O10 Dy1 O6 C29 -163.3(8) . .
O1 Dy1 O6 C29 -62.3(8) 2_546 .
O9 Dy1 O6 C29 145.2(7) . .
O8 Dy1 O6 C29 -114.9(7) . .
O2 Dy1 O6 C29 82.3(8) . .
O5 Dy1 O6 C29 14.0(7) . .
O6 Dy1 O7 C22 -154.8(6) . .
O10 Dy1 O7 C22 19.6(8) . .
O1 Dy1 O7 C22 -85.6(6) 2_546 .
O9 Dy1 O7 C22 64.2(6) . .
O8 Dy1 O7 C22 -17.5(6) . .
O2 Dy1 O7 C22 137.6(6) . .
O5 Dy1 O7 C22 -156.2(7) . .
N1 C9 N2 O2 174.8(6) . .
C8 C9 N2 O2 -7.9(12) . .
N1 C9 N2 C14 -13.0(9) . .
C8 C9 N2 C14 164.3(7) . .
O6 Dy1 O10 C19 -160.5(8) . .
O7 Dy1 O10 C19 22.2(8) . .
O1 Dy1 O10 C19 128.7(7) 2_546 .
O9 Dy1 O10 C19 -23.2(7) . .
O8 Dy1 O10 C19 59.7(7) . .
O2 Dy1 O10 C19 -88.8(7) . .
O5 Dy1 O10 C19 -164.9(6) . .
O6 Dy1 O8 C24 171.4(6) . .
O7 Dy1 O8 C24 13.3(6) . .
O10 Dy1 O8 C24 -140.7(7) . .
O1 Dy1 O8 C24 118.0(7) 2_546 .
O9 Dy1 O8 C24 -65.2(7) . .
O2 Dy1 O8 C24 -44.6(8) . .
O5 Dy1 O8 C24 72.3(7) . .
O6 Dy1 O9 C17 74.2(7) . .
O7 Dy1 O9 C17 -125.8(7) . .
O10 Dy1 O9 C17 23.7(6) . .
O1 Dy1 O9 C17 -44.5(8) 2_546 .
O8 Dy1 O9 C17 -50.4(6) . .
O2 Dy1 O9 C17 140.1(7) . .
O5 Dy1 O9 C17 173.9(6) . .
C9 N2 O2 Dy1 -76.5(9) . .
C14 N2 O2 Dy1 111.6(7) . .
O6 Dy1 O2 N2 131.9(7) . .
O7 Dy1 O2 N2 -73.0(7) . .
O10 Dy1 O2 N2 66.8(7) . .
O1 Dy1 O2 N2 -174.6(6) 2_546 .
O9 Dy1 O2 N2 2.1(6) . .
O8 Dy1 O2 N2 -18.9(9) . .
O5 Dy1 O2 N2 -151.6(7) . .
C1 O4 C2 C3 -2.2(13) . .
C1 O4 C2 C4 177.6(8) . .
C6 C3 C2 O4 -179.3(8) . .
C6 C3 C2 C4 0.9(13) . .
Dy1 O5 C27 C28 -7.6(13) . .
Dy1 O5 C27 C26 172.2(5) . .
Dy1 O9 C17 C18 -17.6(12) . .
Dy1 O9 C17 C16 166.6(5) . .
Dy1 O7 C22 C23 17.7(12) . .
Dy1 O7 C22 C21 -156.3(5) . .
N2 C9 C8 C5 120.9(9) . .
N1 C9 C8 C5 -62.3(12) . .
N2 C9 C8 C6 -55.9(11) . .
N1 C9 C8 C6 120.8(9) . .
O7 C22 C23 C24 -3.6(13) . .
C21 C22 C23 C24 170.3(7) . .
Dy1 O8 C24 C23 -8.5(12) . .
Dy1 O8 C24 C25 167.0(5) . .
C22 C23 C24 O8 -1.0(13) . .
C22 C23 C24 C25 -176.4(7) . .
O4 C2 C4 C5 178.9(8) . .
C3 C2 C4 C5 -1.3(13) . .
Dy1 O10 C19 C18 16.1(13) . .
Dy1 O10 C19 C20 -164.3(6) . .
C7 O3 C6 C3 -5.2(12) . .
C7 O3 C6 C8 177.9(7) . .
C2 C3 C6 O3 -176.1(8) . .
C2 C3 C6 C8 0.5(13) . .
C5 C8 C6 O3 175.4(7) . .
C9 C8 C6 O3 -7.7(11) . .
C5 C8 C6 C3 -1.6(12) . .
C9 C8 C6 C3 175.3(8) . .
O5 C27 C26 F6 50.1(10) . .
C28 C27 C26 F6 -130.1(9) . .
O5 C27 C26 F5 -68.5(9) . .
C28 C27 C26 F5 111.3(9) . .
O5 C27 C26 F4 170.7(7) . .
C28 C27 C26 F4 -9.5(12) . .
O8 C24 C25 F14 49.5(10) . .
C23 C24 C25 F14 -134.5(8) . .
O8 C24 C25 F13 -71.6(9) . .
C23 C24 C25 F13 104.4(9) . .
O8 C24 C25 F15 169.5(7) . .
C23 C24 C25 F15 -14.5(11) . .
O9 C17 C16 F11 -161.6(7) . .
C18 C17 C16 F11 22.2(11) . .
O9 C17 C16 F10 77.6(9) . .
C18 C17 C16 F10 -98.7(8) . .
O9 C17 C16 F12 -40.6(9) . .
C18 C17 C16 F12 143.1(7) . .
O7 C22 C21 F18 -34.8(10) . .
C23 C22 C21 F18 150.5(7) . .
O7 C22 C21 F16 85.7(8) . .
C23 C22 C21 F16 -89.0(8) . .
O7 C22 C21 F17 -156.9(6) . .
C23 C22 C21 F17 28.3(10) . .
O5 C27 C28 C29 6.9(15) . .
C26 C27 C28 C29 -172.9(8) . .
C2 C4 C5 C8 0.1(13) . .
C6 C8 C5 C4 1.3(12) . .
C9 C8 C5 C4 -175.5(8) . .
O2 N2 C14 C13 -45.3(9) . .
C9 N2 C14 C13 142.0(7) . .
O2 N2 C14 C15 73.2(8) . .
C9 N2 C14 C15 -99.5(8) . .
O2 N2 C14 C11 -167.3(6) . .
C9 N2 C14 C11 19.9(8) . .
Dy1 O6 C29 C28 -19.8(14) . .
Dy1 O6 C29 C30 160.1(6) . .
C27 C28 C29 O6 7.1(16) . .
C27 C28 C29 C30 -172.8(9) . .
O9 C17 C18 C19 -3.6(13) . .
C16 C17 C18 C19 172.1(7) . .
O10 C19 C18 C17 4.7(14) . .
C20 C19 C18 C17 -175.0(8) . .
C39 N3 O11 Dy2 75.3(9) . 2_656
C41 N3 O11 Dy2 -113.3(7) . 2_656
N2 C14 C11 N1 -17.6(7) . .
C13 C14 C11 N1 -136.0(7) . .
C15 C14 C11 N1 94.5(7) . .
N2 C14 C11 C10 96.9(7) . .
C13 C14 C11 C10 -21.5(10) . .
C15 C14 C11 C10 -151.0(7) . .
N2 C14 C11 C12 -132.6(7) . .
C13 C14 C11 C12 109.0(8) . .
C15 C14 C11 C12 -20.5(10) . .
O19 C52 C51 F35 166.5(9) . .
C53 C52 C51 F35 -14.1(14) . .
O19 C52 C51 F34 43.4(12) . .
C53 C52 C51 F34 -137.3(9) . .
O19 C52 C51 F36 -74.1(11) . .
C53 C52 C51 F36 105.3(10) . .
O6 C29 C30 F2 -24.5(13) . .
C28 C29 C30 F2 155.4(9) . .
O6 C29 C30 F3 100.7(9) . .
C28 C29 C30 F3 -79.3(11) . .
O6 C29 C30 F1 -142.2(8) . .
C28 C29 C30 F1 37.8(12) . .
O10 C19 C20 F7 -41.3(12) . .
C18 C19 C20 F7 138.4(9) . .
O10 C19 C20 F9 -162.2(8) . .
C18 C19 C20 F9 17.5(13) . .
O10 C19 C20 F8 76.8(10) . .
C18 C19 C20 F8 -103.5(10) . .
N2 C9 N1 O1 -171.3(6) . .
C8 C9 N1 O1 11.5(12) . .
N2 C9 N1 C11 -0.6(8) . .
C8 C9 N1 C11 -177.8(7) . .
C10 C11 N1 O1 63.0(9) . .
C12 C11 N1 O1 -54.8(9) . .
C14 C11 N1 O1 -176.4(6) . .
C10 C11 N1 C9 -107.9(8) . .
C12 C11 N1 C9 134.2(7) . .
C14 C11 N1 C9 12.7(8) . .
C9 N1 O1 Dy1 -75.0(12) . 2_556
C11 N1 O1 Dy1 115.2(9) . 2_556
