#------------------------------------------------------------------------------
#$Date: 2016-02-16 03:10:39 +0200 (Tue, 16 Feb 2016) $
#$Revision: 176453 $
#$URL: svn://www.crystallography.net/cod/cif/7/11/01/7110118.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_7110118
loop_
_publ_author_name
'Fabrice Pointillart'
'Boris Le Guennic'
'Stephane Golhen'
'Olivier Cador'
'Lahcene Ouahab'
_publ_section_title
;
 Slow magnetic relaxation in radical cation tetrathiafulvalene-based
 lanthanide(III) dinuclear complexes
;
_journal_name_full               Chem.Commun.
_journal_page_first              11632
_journal_paper_doi               10.1039/c3cc47087c
_journal_volume                  49
_journal_year                    2013
_chemical_formula_sum            'C33 H22 Cl2 Dy F18 N2 O12 S10'
_chemical_formula_weight         1534.6
_chemical_name_systematic
;
 ?
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                111.316(9)
_cell_angle_beta                 97.865(8)
_cell_angle_gamma                109.661(9)
_cell_formula_units_Z            2
_cell_length_a                   12.315(3)
_cell_length_b                   15.077(4)
_cell_length_c                   17.593(4)
_cell_measurement_reflns_used    11659
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      27.485
_cell_measurement_theta_min      0.998
_cell_volume                     2737.8(12)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.994
_diffrn_measured_fraction_theta_max 0.994
_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  0.0382
_diffrn_reflns_av_sigmaI/netI    0.0610
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            21939
_diffrn_reflns_theta_full        27.57
_diffrn_reflns_theta_max         27.57
_diffrn_reflns_theta_min         1.55
_exptl_absorpt_coefficient_mu    1.960
_exptl_absorpt_correction_T_max  0.663
_exptl_absorpt_correction_T_min  0.539
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            black
_exptl_crystal_density_diffrn    1.861
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1504
_exptl_crystal_size_max          0.32
_exptl_crystal_size_mid          0.27
_exptl_crystal_size_min          0.21
_refine_diff_density_max         2.073
_refine_diff_density_min         -2.383
_refine_diff_density_rms         0.243
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.029
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     713
_refine_ls_number_reflns         12575
_refine_ls_number_restraints     6
_refine_ls_restrained_S_all      1.032
_refine_ls_R_factor_all          0.1124
_refine_ls_R_factor_gt           0.0716
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.1535P)²+1.9677P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1897
_refine_ls_wR_factor_ref         0.2374
_reflns_number_gt                8468
_reflns_number_total             12575
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c3cc47087c.txt
_cod_data_source_block           importfpr517-2
_cod_original_sg_symbol_H-M      P-1
_cod_original_formula_sum        'C33 H22 Cl2 Dy1 F18 N2 O12 S10'
_cod_database_code               7110118
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
C1A C -0.024(6) -0.580(7) 0.281(4) 0.61(13) Uani 0.71(4) 1 d P A 1
H1AA H 0.0124 -0.5074 0.3213 0.908 Uiso 0.71(4) 1 calc PR A 1
H1AB H 0.0293 -0.5961 0.2494 0.908 Uiso 0.71(4) 1 calc PR A 1
H1AC H -0.0408 -0.6224 0.3119 0.908 Uiso 0.71(4) 1 calc PR A 1
C1B C -0.172(8) -0.517(5) 0.310(4) 0.15(3) Uani 0.29(4) 1 d P A 2
H1BA H -0.1057 -0.4489 0.3327 0.222 Uiso 0.29(4) 1 calc PR A 2
H1BB H -0.1720 -0.5432 0.3522 0.222 Uiso 0.29(4) 1 calc PR A 2
H1BC H -0.2464 -0.5107 0.2962 0.222 Uiso 0.29(4) 1 calc PR A 2
C2 C -0.3823(18) -0.4458(15) 0.1440(19) 0.208(13) Uani 1 1 d . . .
H2A H -0.3590 -0.4069 0.1117 0.312 Uiso 1 1 calc R . .
H2B H -0.3353 -0.4034 0.2029 0.312 Uiso 1 1 calc R . .
H2C H -0.4664 -0.4647 0.1395 0.312 Uiso 1 1 calc R . .
C3 C -0.2032(9) -0.5104(7) 0.1165(8) 0.082(3) Uani 1 1 d . . .
C4 C -0.1231(10) -0.5313(7) 0.1584(7) 0.083(3) Uani 1 1 d . A .
C5 C -0.0015(8) -0.4143(6) 0.0959(6) 0.065(2) Uani 1 1 d . A .
C6 C 0.0900(8) -0.3512(6) 0.0778(5) 0.0617(18) Uani 1 1 d . . .
C7 C 0.2117(8) -0.2231(7) 0.0242(5) 0.0615(18) Uani 1 1 d . . .
C8 C 0.2947(7) -0.2436(6) 0.0680(5) 0.0556(17) Uani 1 1 d . . .
C9 C 0.2401(12) -0.0252(8) 0.0461(6) 0.088(3) Uani 1 1 d . . .
H9A H 0.2349 0.0184 0.0178 0.106 Uiso 1 1 calc R . .
H9B H 0.1701 -0.0422 0.0664 0.106 Uiso 1 1 calc R . .
C10 C 0.3519(10) 0.0334(7) 0.1197(6) 0.073(2) Uani 1 1 d . . .
C11 C 0.3539(9) 0.0127(7) 0.1887(6) 0.066(2) Uani 1 1 d . . .
H11 H 0.2825 -0.0303 0.1927 0.079 Uiso 1 1 calc R . .
C12 C 0.4586(13) 0.1023(9) 0.1170(7) 0.101(4) Uani 1 1 d . . .
H12 H 0.4592 0.1183 0.0708 0.121 Uiso 1 1 calc R . .
C13 C 0.5624(12) 0.1463(11) 0.1826(8) 0.115(5) Uani 1 1 d . . .
H13 H 0.6323 0.1951 0.1821 0.138 Uiso 1 1 calc R . .
C14 C 0.5646(11) 0.1189(9) 0.2504(6) 0.094(3) Uani 1 1 d . . .
H14 H 0.6362 0.1443 0.2928 0.113 Uiso 1 1 calc R . .
C15 C 0.5180(8) -0.2358(7) 0.1453(5) 0.0625(19) Uani 1 1 d . . .
H15A H 0.4547 -0.2934 0.1475 0.075 Uiso 1 1 calc R . .
H15B H 0.5702 -0.2633 0.1175 0.075 Uiso 1 1 calc R . .
C16 C 0.5908(7) -0.1541(6) 0.2356(5) 0.0549(17) Uani 1 1 d . . .
C17 C 0.5340(6) -0.1319(6) 0.2991(4) 0.0490(15) Uani 1 1 d . . .
H17 H 0.4509 -0.1672 0.2861 0.059 Uiso 1 1 calc R . .
C18 C 0.7141(8) -0.1012(8) 0.2573(6) 0.073(2) Uani 1 1 d . . .
H18 H 0.7539 -0.1145 0.2160 0.088 Uiso 1 1 calc R . .
C19 C 0.7778(8) -0.0295(9) 0.3393(6) 0.077(3) Uani 1 1 d . . .
H19 H 0.8613 0.0052 0.3538 0.092 Uiso 1 1 calc R . .
C20 C 0.7205(8) -0.0076(8) 0.4010(6) 0.067(2) Uani 1 1 d . . .
H20 H 0.7641 0.0420 0.4568 0.080 Uiso 1 1 calc R . .
C21 C 0.8400(16) 0.3261(12) 0.4723(11) 0.117(5) Uani 1 1 d . . .
C22 C 0.7309(9) 0.2864(8) 0.5046(6) 0.079(3) Uani 1 1 d . . .
C23 C 0.7221(10) 0.3614(7) 0.5755(7) 0.082(3) Uani 1 1 d . . .
H23 H 0.7773 0.4311 0.5987 0.098 Uiso 1 1 calc R . .
C24 C 0.6320(9) 0.3321(6) 0.6109(6) 0.068(2) Uani 1 1 d . . .
C25 C 0.6332(12) 0.4145(8) 0.6938(7) 0.089(3) Uani 1 1 d . . .
C26 C 0.436(3) 0.352(3) 0.3816(13) 0.184(12) Uani 1 1 d . . .
C27 C 0.4048(12) 0.2791(8) 0.4195(6) 0.088(3) Uani 1 1 d . . .
C28 C 0.3258(14) 0.2870(11) 0.4664(9) 0.111(4) Uani 1 1 d . . .
H28 H 0.3010 0.3412 0.4775 0.133 Uiso 1 1 calc R . .
C29 C 0.2839(9) 0.2150(9) 0.4966(7) 0.085(3) Uani 1 1 d . . .
C30 C 0.1829(18) 0.2211(16) 0.5428(14) 0.127(6) Uani 1 1 d . . .
C31 C 0.0599(12) -0.1787(15) 0.3368(15) 0.174(10) Uani 1 1 d . . .
C32 C 0.2587(17) 0.2807(17) 1.0712(12) 0.217(14) Uani 1 1 d D . .
C33 C 1.013(3) 0.138(6) 0.189(3) 0.55(6) Uani 1 1 d . . .
H33A H 1.0634 0.2089 0.2001 0.660 Uiso 1 1 calc R . .
H33B H 0.9832 0.0941 0.1276 0.660 Uiso 1 1 calc R . .
N1 N 0.4582(7) 0.0536(6) 0.2520(5) 0.0668(18) Uani 1 1 d . . .
N2 N 0.5997(6) -0.0598(5) 0.3784(4) 0.0513(13) Uani 1 1 d . . .
O1 O 0.4586(6) 0.0248(5) 0.3143(3) 0.0718(16) Uani 1 1 d . . .
O2 O 0.5431(4) -0.0336(4) 0.4387(3) 0.0493(10) Uani 1 1 d . . .
O3 O 0.6653(6) 0.1931(5) 0.4636(4) 0.0708(15) Uani 1 1 d . . .
O4 O 0.5466(6) 0.2453(4) 0.5849(4) 0.0656(14) Uani 1 1 d . . .
O5 O 0.4548(7) 0.2166(5) 0.4042(4) 0.0784(18) Uani 1 1 d . . .
O6 O 0.3075(6) 0.1410(5) 0.4939(4) 0.0747(16) Uani 1 1 d . . .
O7 O 0.2789(6) -0.0577(5) 0.3899(4) 0.0791(18) Uani 1 1 d . . .
O8 O 0.1604(14) -0.1392(8) 0.2354(6) 0.167(5) Uani 1 1 d . . .
O9 O 0.2219(8) -0.2400(7) 0.2982(6) 0.110(3) Uani 1 1 d . . .
O10 O 0.2909(9) 0.1438(8) 0.9572(6) 0.118(3) Uani 1 1 d D . .
O11 O 0.201(2) 0.2420(17) 0.9200(11) 0.262(12) Uani 1 1 d D . .
O12 O 0.0985(13) 0.1419(15) 0.9727(17) 0.38(2) Uani 1 1 d D . .
F1 F 0.9258(13) 0.4027(12) 0.5179(10) 0.283(11) Uani 1 1 d . . .
F2 F 0.8073(12) 0.3265(14) 0.4013(10) 0.223(7) Uani 1 1 d . . .
F3 F 0.8840(12) 0.2573(13) 0.4453(11) 0.213(6) Uani 1 1 d . . .
F4 F 0.7248(10) 0.5071(6) 0.7226(6) 0.151(4) Uani 1 1 d . . .
F5 F 0.6340(9) 0.3856(5) 0.7544(4) 0.125(3) Uani 1 1 d . . .
F6 F 0.5376(9) 0.4338(7) 0.6829(5) 0.132(3) Uani 1 1 d . . .
F7 F 0.5615(17) 0.4099(11) 0.4098(12) 0.220(7) Uani 1 1 d . . .
F8 F 0.3977(18) 0.4252(11) 0.3995(11) 0.250(8) Uani 1 1 d . . .
F9 F 0.4140(18) 0.3086(10) 0.3003(7) 0.240(8) Uani 1 1 d . . .
F10 F 0.1565(14) 0.2968(13) 0.5504(12) 0.240(8) Uani 1 1 d . . .
F11 F 0.2144(14) 0.2300(13) 0.6162(10) 0.205(6) Uani 1 1 d . . .
F12 F 0.0861(12) 0.1368(14) 0.5042(13) 0.289(12) Uani 1 1 d . . .
F13 F 0.0287(8) -0.0940(9) 0.3504(8) 0.173(5) Uani 1 1 d . . .
F14 F 0.0849(12) -0.1958(11) 0.4105(7) 0.195(6) Uani 1 1 d . . .
F15 F -0.0315(7) -0.2568(8) 0.2734(7) 0.187(5) Uani 1 1 d . . .
F16 F 0.3697(15) 0.3479(17) 1.076(3) 0.56(3) Uani 1 1 d D . .
F17 F 0.278(2) 0.246(2) 1.1270(8) 0.340(16) Uani 1 1 d D . .
F18 F 0.2019(10) 0.3406(10) 1.0989(6) 0.186(5) Uani 1 1 d D . .
S1 S -0.1553(4) -0.6067(3) 0.2137(3) 0.1187(12) Uani 1 1 d . . .
S2 S -0.3571(3) -0.5605(3) 0.1034(3) 0.1216(13) Uani 1 1 d . . .
S3 S -0.1486(2) -0.4324(2) 0.0651(2) 0.0800(7) Uani 1 1 d . . .
S4 S 0.0250(2) -0.48025(18) 0.15399(16) 0.0732(6) Uani 1 1 d . . .
S5 S 0.23761(19) -0.33198(17) 0.10876(14) 0.0620(5) Uani 1 1 d . . .
S6 S 0.0634(2) -0.28684(18) 0.01918(15) 0.0690(5) Uani 1 1 d . . .
S7 S 0.2409(3) -0.1464(2) -0.03014(15) 0.0782(6) Uani 1 1 d . . .
S8 S 0.4492(2) -0.18511(19) 0.08067(14) 0.0675(5) Uani 1 1 d . . .
S9 S 0.1968(3) -0.1539(2) 0.3188(2) 0.0969(9) Uani 1 1 d . . .
S10 S 0.2202(5) 0.2013(4) 0.9719(2) 0.1237(15) Uani 1 1 d D . .
Dy1 Dy 0.46236(3) 0.09493(3) 0.45316(2) 0.05195(15) Uani 1 1 d . . .
Cl1 Cl 0.9043(13) 0.1337(11) 0.2294(9) 0.337(7) Uani 1 1 d . . .
Cl2 Cl 1.0946(14) 0.0872(14) 0.2421(9) 0.405(9) 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'
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'
F F 0.0171 0.0103 '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'
Cl Cl 0.1484 0.1585 '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
C4 C3 S2 125.6(9) . .
C4 C3 S3 116.8(8) . .
S2 C3 S3 117.5(7) . .
C3 C4 S1 125.4(8) . .
C3 C4 S4 116.6(8) . .
S1 C4 S4 118.0(7) . .
C6 C5 S3 123.2(7) . .
C6 C5 S4 121.6(7) . .
S3 C5 S4 115.2(5) . .
C5 C6 S5 123.6(7) . .
C5 C6 S6 121.6(7) . .
S5 C6 S6 114.8(5) . .
C8 C7 S6 115.7(6) . .
C8 C7 S7 126.5(7) . .
S6 C7 S7 117.7(5) . .
C7 C8 S5 116.3(6) . .
C7 C8 S8 122.1(6) . .
S5 C8 S8 121.5(5) . .
C10 C9 S7 110.4(7) . .
C11 C10 C12 118.5(10) . .
C11 C10 C9 119.4(9) . .
C12 C10 C9 121.8(9) . .
C10 C11 N1 121.3(9) . .
C13 C12 C10 119.9(9) . .
C12 C13 C14 120.9(10) . .
N1 C14 C13 117.5(11) . .
C16 C15 S8 113.5(6) . .
C18 C16 C17 118.6(7) . .
C18 C16 C15 121.0(7) . .
C17 C16 C15 120.4(7) . .
N2 C17 C16 119.6(7) . .
C19 C18 C16 119.8(7) . .
C18 C19 C20 121.0(9) . .
N2 C20 C19 118.3(8) . .
F1 C21 F2 110.6(16) . .
F1 C21 F3 103(2) . .
F2 C21 F3 96.1(15) . .
F1 C21 C22 120.5(14) . .
F2 C21 C22 111.7(15) . .
F3 C21 C22 112.1(12) . .
O3 C22 C23 129.7(10) . .
O3 C22 C21 114.4(11) . .
C23 C22 C21 115.9(10) . .
C24 C23 C22 119.8(8) . .
O4 C24 C23 128.6(9) . .
O4 C24 C25 113.3(9) . .
C23 C24 C25 118.0(9) . .
F5 C25 F6 106.8(12) . .
F5 C25 F4 107.8(10) . .
F6 C25 F4 104.1(10) . .
F5 C25 C24 112.6(9) . .
F6 C25 C24 111.1(9) . .
F4 C25 C24 113.8(11) . .
F9 C26 F8 106.8(13) . .
F9 C26 F7 102.4(18) . .
F8 C26 F7 102(3) . .
F9 C26 C27 115(2) . .
F8 C26 C27 119.8(15) . .
F7 C26 C27 109.0(12) . .
O5 C27 C28 128.8(10) . .
O5 C27 C26 115.0(12) . .
C28 C27 C26 116.2(11) . .
C29 C28 C27 119.2(10) . .
O6 C29 C28 132.0(11) . .
O6 C29 C30 110.7(12) . .
C28 C29 C30 117.3(11) . .
F11 C30 F10 105.9(18) . .
F11 C30 F12 105(2) . .
F10 C30 F12 108.2(18) . .
F11 C30 C29 111.4(15) . .
F10 C30 C29 114.4(16) . .
F12 C30 C29 111.2(15) . .
F15 C31 F13 102.8(16) . .
F15 C31 F14 114(2) . .
F13 C31 F14 114.3(17) . .
F15 C31 S9 115.4(14) . .
F13 C31 S9 111.6(16) . .
F14 C31 S9 98.9(12) . .
F17 C32 F18 107.3(17) . .
F17 C32 F16 106(2) . .
F18 C32 F16 105.0(19) . .
F17 C32 S10 117.8(15) . .
F18 C32 S10 120.9(12) . .
F16 C32 S10 97.5(17) . .
Cl1 C33 Cl2 103(2) . .
O1 N1 C11 119.6(7) . .
O1 N1 C14 118.5(8) . .
C11 N1 C14 121.8(8) . .
C17 N2 C20 122.7(6) . .
C17 N2 O2 119.4(6) . .
C20 N2 O2 117.9(6) . .
N1 O1 Dy1 136.8(5) . .
N2 O2 Dy1 122.9(4) . 2_656
N2 O2 Dy1 121.1(4) . .
Dy1 O2 Dy1 115.61(18) 2_656 .
C22 O3 Dy1 130.9(7) . .
C24 O4 Dy1 132.8(6) . .
C27 O5 Dy1 133.5(7) . .
C29 O6 Dy1 130.7(7) . .
S9 O7 Dy1 151.1(4) . .
C1A S1 C4 108.6(12) . .
C1A S1 C1B 84(4) . .
C4 S1 C1B 101.5(16) . .
C3 S2 C2 102.4(7) . .
C5 S3 C3 95.9(5) . .
C5 S4 C4 95.4(5) . .
C6 S5 C8 96.4(4) . .
C6 S6 C7 96.7(4) . .
C7 S7 C9 101.1(4) . .
C8 S8 C15 104.4(4) . .
O9 S9 O7 119.3(5) . .
O9 S9 O8 109.8(7) . .
O7 S9 O8 112.6(5) . .
O9 S9 C31 111.3(9) . .
O7 S9 C31 105.6(6) . .
O8 S9 C31 95.7(11) . .
O11 S10 O10 118.5(8) . .
O11 S10 O12 103.8(15) . .
O10 S10 O12 114.0(10) . .
O11 S10 C32 114.0(11) . .
O10 S10 C32 111.1(7) . .
O12 S10 C32 92.2(12) . .
O1 Dy1 O5 74.2(2) . .
O1 Dy1 O4 146.3(2) . .
O5 Dy1 O4 81.4(2) . .
O1 Dy1 O6 121.7(2) . .
O5 Dy1 O6 73.4(2) . .
O4 Dy1 O6 71.1(2) . .
O1 Dy1 O7 77.2(2) . .
O5 Dy1 O7 111.3(3) . .
O4 Dy1 O7 134.3(2) . .
O6 Dy1 O7 71.4(2) . .
O1 Dy1 O3 79.3(2) . .
O5 Dy1 O3 74.6(2) . .
O4 Dy1 O3 71.9(2) . .
O6 Dy1 O3 133.7(2) . .
O7 Dy1 O3 152.9(2) . .
O1 Dy1 O2 134.39(18) . 2_656
O5 Dy1 O2 151.1(2) . 2_656
O4 Dy1 O2 73.71(18) . 2_656
O6 Dy1 O2 84.56(19) . 2_656
O7 Dy1 O2 77.8(2) . 2_656
O3 Dy1 O2 110.4(2) . 2_656
O1 Dy1 O2 74.52(18) . .
O5 Dy1 O2 142.45(19) . .
O4 Dy1 O2 115.81(18) . .
O6 Dy1 O2 142.39(19) . .
O7 Dy1 O2 81.2(2) . .
O3 Dy1 O2 79.64(19) . .
O2 Dy1 O2 64.39(18) 2_656 .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C1A S1 1.69(6) .
C1B S1 1.84(5) .
C2 S2 1.766(18) .
C3 C4 1.340(16) .
C3 S2 1.734(10) .
C3 S3 1.748(11) .
C4 S1 1.734(11) .
C4 S4 1.750(11) .
C5 C6 1.368(12) .
C5 S3 1.715(9) .
C5 S4 1.734(9) .
C6 S5 1.717(9) .
C6 S6 1.721(9) .
C7 C8 1.381(11) .
C7 S6 1.726(9) .
C7 S7 1.732(8) .
C8 S5 1.728(8) .
C8 S8 1.749(8) .
C9 C10 1.489(15) .
C9 S7 1.836(10) .
C10 C11 1.357(11) .
C10 C12 1.393(15) .
C11 N1 1.359(12) .
C12 C13 1.369(18) .
C13 C14 1.396(15) .
C14 N1 1.361(13) .
C15 C16 1.512(11) .
C15 S8 1.845(9) .
C16 C18 1.375(12) .
C16 C17 1.396(9) .
C17 N2 1.334(9) .
C18 C19 1.361(13) .
C19 C20 1.374(12) .
C20 N2 1.347(11) .
C21 F1 1.169(18) .
C21 F2 1.261(19) .
C21 F3 1.30(2) .
C21 C22 1.550(17) .
C22 O3 1.221(11) .
C22 C23 1.391(15) .
C23 C24 1.369(15) .
C24 O4 1.239(10) .
C24 C25 1.529(14) .
C25 F5 1.290(13) .
C25 F6 1.309(15) .
C25 F4 1.322(14) .
C26 F9 1.28(2) .
C26 F8 1.29(2) .
C26 F7 1.40(3) .
C26 C27 1.46(2) .
C27 O5 1.261(12) .
C27 C28 1.366(18) .
C28 C29 1.358(18) .
C29 O6 1.232(12) .
C29 C30 1.586(17) .
C30 F11 1.24(2) .
C30 F10 1.255(19) .
C30 F12 1.28(2) .
C31 F15 1.306(16) .
C31 F13 1.40(2) .
C31 F14 1.43(3) .
C31 S9 1.700(17) .
C32 F17 1.300(16) .
C32 F18 1.319(14) .
C32 F16 1.369(18) .
C32 S10 1.607(19) .
C33 Cl1 1.59(4) .
C33 Cl2 1.80(4) .
N1 O1 1.317(8) .
N2 O2 1.360(7) .
O1 Dy1 2.269(5) .
O2 Dy1 2.398(4) 2_656
O2 Dy1 2.412(5) .
O3 Dy1 2.378(6) .
O4 Dy1 2.351(6) .
O5 Dy1 2.315(5) .
O6 Dy1 2.353(6) .
O7 S9 1.428(7) .
O7 Dy1 2.364(6) .
O8 S9 1.589(11) .
O9 S9 1.368(9) .
O10 S10 1.409(7) .
O11 S10 1.307(11) .
O12 S10 1.469(17) .
Dy1 O2 2.398(4) 2_656
