#------------------------------------------------------------------------------
#$Date: 2021-11-15 11:54:23 +0200 (Mon, 15 Nov 2021) $
#$Revision: 270649 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/56/52/1565215.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_1565215
loop_
_publ_author_name
'Chang, Yi-Xin'
'Gao, Ning'
'Wang, Mei-Ying'
'Wang, Wan-Ting'
'Fan, Zi-Wei'
'Ren, Duo-Duo'
'Wu, Zhi-Lei'
'Wang, Wen-Min'
_publ_section_title
;
 Two phenoxo-O bridged dinuclear Dy(III) complexes exhibiting distinct
 slow magnetic relaxation induced by different β-diketonate ligands
;
_journal_name_full               'Inorganica Chimica Acta'
_journal_page_first              119499
_journal_paper_doi               10.1016/j.ica.2020.119499
_journal_volume                  505
_journal_year                    2020
_chemical_formula_moiety         'C76 H54 Dy2 F12 N4 O10'
_chemical_formula_sum            'C76 H54 Dy2 F12 N4 O10'
_chemical_formula_weight         1736.23
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     iterative
_cell_angle_alpha                101.120(3)
_cell_angle_beta                 112.968(3)
_cell_angle_gamma                100.847(3)
_cell_formula_units_Z            1
_cell_length_a                   10.9464(7)
_cell_length_b                   12.8805(8)
_cell_length_c                   13.9048(9)
_cell_measurement_reflns_used    4615
_cell_measurement_temperature    150(2)
_cell_measurement_theta_max      23.468
_cell_measurement_theta_min      2.286
_cell_volume                     1694.2(2)
_computing_cell_refinement       'SAINT v8.37A (Bruker, 2015)'
_computing_data_reduction        'SAINT v8.37A (Bruker, 2015)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'XL (Sheldrick, 2008)'
_computing_structure_solution
;
Superflip (Palatinus & Chapuis, 2007;Palatinus & van der Lee, 2008;
Palatinus et al., 2012)
;
_diffrn_ambient_temperature      150.15
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.1104
_diffrn_reflns_av_unetI/netI     0.0846
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.999
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_number            27153
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.999
_diffrn_reflns_theta_full        25.009
_diffrn_reflns_theta_max         25.009
_diffrn_reflns_theta_min         2.112
_exptl_absorpt_coefficient_mu    2.286
_exptl_absorpt_correction_T_max  0.7452
_exptl_absorpt_correction_T_min  0.6542
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
SADABS-2016/2 (Bruker,2016/2) was used for absorption correction.
wR2(int) was 0.0741 before and 0.0655 after correction.
The Ratio of minimum to maximum transmission is 0.8779.
The λ/2 correction factor is Not present.
;
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.702
_exptl_crystal_description       block
_exptl_crystal_F_000             858
_exptl_crystal_size_max          0.36
_exptl_crystal_size_mid          0.25
_exptl_crystal_size_min          0.11
_refine_diff_density_max         1.768
_refine_diff_density_min         -0.992
_refine_diff_density_rms         0.189
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.056
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     468
_refine_ls_number_reflns         5970
_refine_ls_number_restraints     24
_refine_ls_restrained_S_all      1.065
_refine_ls_R_factor_all          0.0766
_refine_ls_R_factor_gt           0.0477
_refine_ls_shift/su_max          0.005
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0630P)²+0.2346P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1018
_refine_ls_wR_factor_ref         0.1199
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                4585
_reflns_number_total             5970
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            1.cif
_cod_data_source_block           1
_cod_original_cell_volume        1694.22(19)
_cod_database_code               1565215
_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_max   0.787
_shelx_estimated_absorpt_t_min   0.493
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2. Rigid bond restraints
 F4, C38, F5, F6
 with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.02
 C38, F5
 with sigma for 1-2 distances of 0.001 and sigma for 1-3 distances of 0.002
3. Uiso/Uaniso restraints and constraints
F5 \\sim F4 \\sim F6: within 2A with sigma of 0.01 and sigma for terminal atoms
of 0.02
Uanis(F5) \\sim Ueq, Uanis(F6) \\sim Ueq, Uanis(F4) \\sim Ueq: with sigma of
0.01 and sigma for terminal atoms of 0.02
Uanis(F5) \\sim Ueq: with sigma of 0.001 and sigma for terminal atoms of 0.002
Uanis(F5') = Uanis(F5) = Uanis(F4') = Uanis(F4) = Uanis(F6') = Uanis(F6)
4. Others
 Sof(F4')=Sof(F5')=Sof(F6')=1-FVAR(1)
 Sof(F6)=Sof(F5)=Sof(F4)=FVAR(1)
5.a Secondary CH2 refined with riding coordinates:
 C17(H17A,H17B)
5.b Aromatic/amide H refined with riding coordinates:
 C9(H9), C28(H28), C8(H8), C29(H29), C2(H2), C36(H36), C30(H30), C24(H24),
 C3(H3), C13(H13), C27(H27), C15(H15), C32(H32), C10(H10), C4(H4), C21(H21),
 C33(H33), C16(H16), C26(H26), C31(H31), C25(H25), C12(H12)
5.c Idealised Me refined as rotating group:
 C18(H18A,H18B,H18C)
;
_olex2_submission_special_instructions 'No special instructions were received'
loop_
_space_group_symop_operation_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_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 0.08983(4) 0.40982(3) 0.44098(3) 0.01817(12) Uani 1 1 d . . . . .
O5 O 0.1421(5) 0.2831(4) 0.5384(4) 0.0202(11) Uani 1 1 d . . . . .
O4 O 0.2685(5) 0.5032(4) 0.6188(4) 0.0214(11) Uani 1 1 d . . . . .
F6 F 0.1821(12) 0.1816(8) 0.7583(9) 0.0590(13) Uani 0.546(6) 1 d . U P A 1
O2 O -0.0530(5) 0.2464(4) 0.3056(4) 0.0269(12) Uani 1 1 d . . . . .
N1 N 0.2670(6) 0.5464(4) 0.4281(5) 0.0178(13) Uani 1 1 d . . . . .
F2 F -0.2861(6) 0.0645(4) 0.0488(4) 0.0555(15) Uani 1 1 d . . . . .
O3 O -0.0132(5) 0.4504(4) 0.2768(4) 0.0253(12) Uani 1 1 d . . . . .
F3 F -0.2567(8) 0.0528(4) 0.2054(5) 0.087(2) Uani 1 1 d . . . . .
C9 C 0.4711(8) 0.7100(6) 0.4267(6) 0.0272(18) Uani 1 1 d . . . . .
H9 H 0.540658 0.764969 0.424789 0.033 Uiso 1 1 calc R . . . .
F1 F -0.1021(6) 0.0378(4) 0.1527(7) 0.103(3) Uani 1 1 d . . . . .
C28 C -0.0723(9) 0.5839(7) 0.1439(7) 0.038(2) Uani 1 1 d . . . . .
H28 H -0.024479 0.616014 0.220930 0.046 Uiso 1 1 calc R . . . .
C8 C 0.4605(7) 0.6005(6) 0.3908(6) 0.0277(18) Uani 1 1 d . . . . .
H8 H 0.523245 0.579196 0.364920 0.033 Uiso 1 1 calc R . . . .
C18 C 0.3833(10) -0.1259(8) 0.2239(9) 0.053(3) Uani 1 1 d . . . . .
H18A H 0.415932 -0.084027 0.182328 0.080 Uiso 1 1 calc GR . . . .
H18B H 0.382445 -0.202957 0.200809 0.080 Uiso 1 1 calc GR . . . .
H18C H 0.445585 -0.093299 0.302064 0.080 Uiso 1 1 calc GR . . . .
C1 C 0.1732(7) 0.6788(5) 0.4998(6) 0.0185(16) Uani 1 1 d . . . . .
C7 C 0.3562(7) 0.5203(6) 0.3926(6) 0.0218(16) Uani 1 1 d . . . . .
N2 N 0.2477(6) 0.3293(5) 0.3584(5) 0.0222(14) Uani 1 1 d . . . . .
C6 C 0.2749(7) 0.6546(5) 0.4640(6) 0.0190(15) Uani 1 1 d . . . . .
C5 C 0.3798(7) 0.7414(6) 0.4663(6) 0.0241(17) Uani 1 1 d . . . . .
F5 F 0.0757(11) 0.0987(8) 0.5865(9) 0.0590(13) Uani 0.546(6) 1 d . U P A 1
C37 C 0.1978(7) 0.2904(6) 0.6383(6) 0.0208(16) Uani 1 1 d . . . . .
C29 C 0.4124(9) 0.6926(6) 0.7919(7) 0.034(2) Uani 1 1 d . . . . .
H29 H 0.382533 0.697410 0.719308 0.041 Uiso 1 1 calc R . . . .
C35 C 0.3052(7) 0.4894(6) 0.7118(6) 0.0206(16) Uani 1 1 d . . . . .
C23 C -0.1087(8) 0.4708(7) 0.1007(7) 0.035(2) Uani 1 1 d . . . . .
C22 C -0.0808(8) 0.4012(6) 0.1764(7) 0.0282(18) Uani 1 1 d . . . . .
C2 C 0.1849(8) 0.7891(5) 0.5382(6) 0.0244(17) Uani 1 1 d . . . . .
H2 H 0.119262 0.808347 0.561671 0.029 Uiso 1 1 calc R . . . .
C36 C 0.2731(8) 0.3839(6) 0.7262(6) 0.0260(17) Uani 1 1 d . . . . .
H36 H 0.304033 0.377178 0.798090 0.031 Uiso 1 1 calc R . . . .
C34 C 0.3843(8) 0.5901(6) 0.8077(6) 0.0279(18) Uani 1 1 d . . . . .
C30 C 0.4820(10) 0.7878(7) 0.8772(8) 0.044(2) Uani 1 1 d . . . . .
H30 H 0.499631 0.857238 0.863482 0.052 Uiso 1 1 calc R . . . .
C24 C -0.1723(11) 0.4266(8) -0.0126(8) 0.055(3) Uani 1 1 d . . . . .
H24 H -0.194629 0.349077 -0.043810 0.066 Uiso 1 1 calc R . . . .
C3 C 0.2901(8) 0.8727(6) 0.5434(7) 0.032(2) Uani 1 1 d . . . . .
H3 H 0.295972 0.947468 0.572538 0.038 Uiso 1 1 calc R . . . .
C13 C 0.2552(10) 0.0709(7) 0.1860(8) 0.047(2) Uani 1 1 d . . . . .
H13 H 0.268018 0.047588 0.122382 0.056 Uiso 1 1 calc R . . . .
C27 C -0.1036(11) 0.6507(8) 0.0780(10) 0.059(3) Uani 1 1 d . . . . .
H27 H -0.080447 0.728231 0.109224 0.071 Uiso 1 1 calc R . . . .
C15 C 0.2032(8) 0.0298(6) 0.3265(7) 0.033(2) Uani 1 1 d . . . . .
H15 H 0.181727 -0.022037 0.361980 0.040 Uiso 1 1 calc R . . . .
C32 C 0.4962(10) 0.6829(7) 1.0016(8) 0.052(3) Uani 1 1 d . . . . .
H32 H 0.523955 0.679520 1.074448 0.063 Uiso 1 1 calc R . . . .
C17 C 0.2387(10) -0.1217(7) 0.2031(8) 0.048(2) Uani 1 1 d . . . . .
H17A H 0.204595 -0.167169 0.242306 0.057 Uiso 1 1 calc R . . . .
H17B H 0.176463 -0.154352 0.123934 0.057 Uiso 1 1 calc R . . . .
C10 C 0.3427(8) 0.4039(6) 0.3554(6) 0.0245(17) Uani 1 1 d . . . . .
H10 H 0.404249 0.381888 0.328549 0.029 Uiso 1 1 calc R . . . .
C4 C 0.3854(8) 0.8511(6) 0.5081(7) 0.033(2) Uani 1 1 d . . . . .
H4 H 0.455173 0.910257 0.511765 0.039 Uiso 1 1 calc R . . . .
C38 C 0.1798(9) 0.1802(7) 0.6617(7) 0.0354(17) Uani 1 1 d . U . . .
C21 C -0.1326(9) 0.2836(6) 0.1342(7) 0.036(2) Uani 1 1 d . . . . .
H21 H -0.177455 0.250020 0.057313 0.043 Uiso 1 1 calc R . . . .
C33 C 0.4260(9) 0.5874(7) 0.9155(7) 0.042(2) Uani 1 1 d . . . . .
H33 H 0.405610 0.518594 0.929657 0.050 Uiso 1 1 calc R . . . .
C16 C 0.2053(8) 0.1375(6) 0.3629(7) 0.0290(18) Uani 1 1 d . . . . .
H16 H 0.180480 0.157922 0.420631 0.035 Uiso 1 1 calc R . . . .
C20 C -0.1186(8) 0.2176(6) 0.2031(7) 0.0318(19) Uani 1 1 d . . . . .
C14 C 0.2317(9) -0.0042(7) 0.2398(8) 0.040(2) Uani 1 1 d . . . . .
C26 C -0.1699(13) 0.6045(10) -0.0356(10) 0.074(4) Uani 1 1 d . . . . .
H26 H -0.191661 0.650627 -0.081738 0.089 Uiso 1 1 calc R . . . .
C19 C -0.1884(10) 0.0922(7) 0.1524(7) 0.041(2) Uani 1 1 d . . . . .
C11 C 0.2434(7) 0.2179(5) 0.3164(6) 0.0178(15) Uani 1 1 d . . . . .
O1 O 0.0775(5) 0.5941(3) 0.4959(4) 0.0202(11) Uani 1 1 d . . . . .
C31 C 0.5260(10) 0.7829(7) 0.9822(8) 0.050(3) Uani 1 1 d . . . . .
H31 H 0.577212 0.848503 1.041705 0.060 Uiso 1 1 calc R . . . .
F4 F 0.2923(11) 0.1438(8) 0.6698(9) 0.0590(13) Uani 0.546(6) 1 d . U P A 1
C25 C -0.2034(13) 0.4922(9) -0.0802(9) 0.072(3) Uani 1 1 d . . . . .
H25 H -0.247702 0.460356 -0.157330 0.086 Uiso 1 1 calc R . . . .
C12 C 0.2604(11) 0.1803(7) 0.2236(8) 0.047(2) Uani 1 1 d . . . . .
H12 H 0.276042 0.230465 0.184853 0.056 Uiso 1 1 calc R . . . .
F4' F 0.2008(14) 0.1050(10) 0.5952(11) 0.0590(13) Uani 0.454(6) 1 d . . P A 2
F5' F 0.0500(14) 0.1394(10) 0.6474(11) 0.0590(13) Uani 0.454(6) 1 d . . P A 2
F6' F 0.2659(15) 0.1798(10) 0.7615(11) 0.0590(13) Uani 0.454(6) 1 d . . P A 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'
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
O5 Dy1 Dy1 109.38(11) . 2_566
O5 Dy1 O4 70.31(16) . .
O5 Dy1 N1 122.91(17) . .
O5 Dy1 O3 150.89(17) . .
O5 Dy1 N2 80.55(17) . .
O5 Dy1 O1 131.45(16) . .
O4 Dy1 Dy1 78.86(11) . 2_566
O4 Dy1 N1 71.35(17) . .
O4 Dy1 N2 96.78(17) . .
O4 Dy1 O1 70.65(16) . .
O2 Dy1 Dy1 116.31(13) . 2_566
O2 Dy1 O5 79.91(17) . .
O2 Dy1 O4 149.91(17) . .
O2 Dy1 N1 124.78(18) . .
O2 Dy1 O3 71.53(17) . .
O2 Dy1 N2 73.57(18) . .
O2 Dy1 O1 136.81(17) . .
O2 Dy1 O1 88.87(17) . 2_566
N1 Dy1 Dy1 102.74(13) . 2_566
N1 Dy1 N2 63.89(18) . .
O3 Dy1 Dy1 88.72(12) . 2_566
O3 Dy1 O4 137.35(16) . .
O3 Dy1 N1 71.99(17) . .
O3 Dy1 N2 86.01(18) . .
O3 Dy1 O1 76.01(17) . .
N2 Dy1 Dy1 166.58(12) . 2_566
O1 Dy1 Dy1 34.78(10) . 2_566
O1 Dy1 Dy1 36.16(10) 2_566 2_566
O1 Dy1 O5 82.26(16) 2_566 .
O1 Dy1 O4 91.30(16) 2_566 .
O1 Dy1 N1 138.75(17) 2_566 .
O1 Dy1 N1 68.05(16) . .
O1 Dy1 O3 102.30(17) 2_566 .
O1 Dy1 N2 157.26(17) 2_566 .
O1 Dy1 N2 131.80(16) . .
O1 Dy1 O1 70.93(16) 2_566 .
C37 O5 Dy1 134.1(4) . .
C35 O4 Dy1 136.6(4) . .
C20 O2 Dy1 135.6(5) . .
C7 N1 Dy1 123.5(5) . .
C7 N1 C6 119.6(6) . .
C6 N1 Dy1 116.8(4) . .
C22 O3 Dy1 139.3(5) . .
C8 C9 C5 120.3(7) . .
C27 C28 C23 121.2(9) . .
C9 C8 C7 119.3(7) . .
C2 C1 C6 116.7(6) . .
O1 C1 C6 118.4(6) . .
O1 C1 C2 124.9(6) . .
N1 C7 C8 122.3(7) . .
N1 C7 C10 117.2(6) . .
C8 C7 C10 120.5(6) . .
C10 N2 Dy1 114.5(5) . .
C10 N2 C11 115.0(6) . .
C11 N2 Dy1 130.5(4) . .
N1 C6 C1 117.5(6) . .
N1 C6 C5 121.4(6) . .
C5 C6 C1 121.0(6) . .
C9 C5 C6 117.1(6) . .
C9 C5 C4 124.4(7) . .
C4 C5 C6 118.5(7) . .
O5 C37 C36 128.5(7) . .
O5 C37 C38 113.9(6) . .
C36 C37 C38 117.5(7) . .
C30 C29 C34 122.2(8) . .
O4 C35 C36 122.1(7) . .
O4 C35 C34 117.0(6) . .
C36 C35 C34 120.9(7) . .
C28 C23 C22 119.0(8) . .
C28 C23 C24 118.0(8) . .
C24 C23 C22 122.9(8) . .
O3 C22 C23 117.3(7) . .
O3 C22 C21 122.6(7) . .
C21 C22 C23 120.1(7) . .
C1 C2 C3 121.7(7) . .
C37 C36 C35 121.5(7) . .
C29 C34 C35 120.0(7) . .
C29 C34 C33 116.9(7) . .
C33 C34 C35 123.1(7) . .
C31 C30 C29 119.9(8) . .
C25 C24 C23 121.6(10) . .
C4 C3 C2 122.3(7) . .
C14 C13 C12 120.8(8) . .
C28 C27 C26 119.8(10) . .
C14 C15 C16 121.1(7) . .
C31 C32 C33 120.0(9) . .
C18 C17 C14 112.8(7) . .
N2 C10 C7 120.9(6) . .
C3 C4 C5 119.7(7) . .
F6 C38 C37 116.0(8) . .
F6 C38 F4 101.2(9) . .
F5 C38 F6 108.9(9) . .
F5 C38 C37 116.5(8) . .
F5 C38 F4 103.2(9) . .
F4 C38 C37 109.3(7) . .
F4' C38 C37 112.4(8) . .
F4' C38 F5' 106.2(10) . .
F4' C38 F6' 103.6(10) . .
F5' C38 C37 110.4(8) . .
F5' C38 F6' 107.3(10) . .
F6' C38 C37 116.2(9) . .
C20 C21 C22 121.2(7) . .
C32 C33 C34 121.1(8) . .
C15 C16 C11 121.2(7) . .
O2 C20 C21 128.3(7) . .
O2 C20 C19 113.2(7) . .
C21 C20 C19 118.6(7) . .
C13 C14 C17 120.1(8) . .
C15 C14 C13 118.3(8) . .
C15 C14 C17 121.6(8) . .
C25 C26 C27 119.8(10) . .
F2 C19 C20 113.1(7) . .
F3 C19 F2 104.1(7) . .
F3 C19 C20 111.2(7) . .
F1 C19 F2 107.1(8) . .
F1 C19 F3 108.1(8) . .
F1 C19 C20 112.8(7) . .
C16 C11 N2 119.5(6) . .
C12 C11 N2 123.7(6) . .
C12 C11 C16 116.5(7) . .
Dy1 O1 Dy1 109.06(16) 2_566 .
C1 O1 Dy1 119.0(4) . .
C1 O1 Dy1 131.2(4) . 2_566
C30 C31 C32 119.8(9) . .
C24 C25 C26 119.5(11) . .
C11 C12 C13 121.5(8) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Dy1 Dy1 3.8374(7) 2_566
Dy1 O5 2.329(5) .
Dy1 O4 2.362(5) .
Dy1 O2 2.314(5) .
Dy1 N1 2.448(5) .
Dy1 O3 2.330(5) .
Dy1 N2 2.673(6) .
Dy1 O1 2.395(4) .
Dy1 O1 2.316(4) 2_566
O5 C37 1.256(8) .
O4 C35 1.256(8) .
F6 C38 1.331(13) .
O2 C20 1.258(9) .
N1 C7 1.321(9) .
N1 C6 1.360(8) .
F2 C19 1.343(10) .
O3 C22 1.254(9) .
F3 C19 1.338(10) .
C9 C8 1.369(11) .
C9 C5 1.400(10) .
F1 C19 1.277(10) .
C28 C23 1.378(11) .
C28 C27 1.367(13) .
C8 C7 1.400(10) .
C18 C17 1.508(12) .
C1 C6 1.446(9) .
C1 C2 1.380(9) .
C1 O1 1.339(8) .
C7 C10 1.448(10) .
N2 C10 1.295(9) .
N2 C11 1.425(8) .
C6 C5 1.429(9) .
C5 C4 1.401(10) .
F5 C38 1.300(13) .
C37 C36 1.377(10) .
C37 C38 1.510(10) .
C29 C34 1.379(10) .
C29 C30 1.369(11) .
C35 C36 1.410(10) .
C35 C34 1.489(10) .
C23 C22 1.491(11) .
C23 C24 1.393(12) .
C22 C21 1.426(11) .
C2 C3 1.389(10) .
C34 C33 1.395(11) .
C30 C31 1.366(13) .
C24 C25 1.371(13) .
C3 C4 1.364(11) .
C13 C14 1.377(12) .
C13 C12 1.387(11) .
C27 C26 1.398(15) .
C15 C16 1.375(10) .
C15 C14 1.373(11) .
C32 C33 1.376(12) .
C32 C31 1.372(12) .
C17 C14 1.527(11) .
C38 F4 1.371(13) .
C38 F4' 1.323(15) .
C38 F5' 1.339(15) .
C38 F6' 1.341(15) .
C21 C20 1.383(11) .
C16 C11 1.404(10) .
C20 C19 1.539(11) .
C26 C25 1.374(16) .
C11 C12 1.383(11) .
loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
Dy1 O5 C37 C36 -14.5(11) . . . .
Dy1 O5 C37 C38 166.8(5) . . . .
Dy1 O4 C35 C36 25.7(10) . . . .
Dy1 O4 C35 C34 -153.9(5) . . . .
Dy1 O2 C20 C21 -4.5(13) . . . .
Dy1 O2 C20 C19 174.6(5) . . . .
Dy1 N1 C7 C8 -177.0(5) . . . .
Dy1 N1 C7 C10 2.7(9) . . . .
Dy1 N1 C6 C1 -3.8(8) . . . .
Dy1 N1 C6 C5 176.2(5) . . . .
Dy1 O3 C22 C23 -172.3(5) . . . .
Dy1 O3 C22 C21 9.0(12) . . . .
Dy1 N2 C10 C7 -1.3(9) . . . .
Dy1 N2 C11 C16 -34.2(10) . . . .
Dy1 N2 C11 C12 138.7(7) . . . .
O5 C37 C36 C35 -4.2(12) . . . .
O5 C37 C38 F6 -152.8(9) . . . .
O5 C37 C38 F5 -22.7(11) . . . .
O5 C37 C38 F4 93.6(9) . . . .
O5 C37 C38 F4' 43.8(11) . . . .
O5 C37 C38 F5' -74.7(10) . . . .
O5 C37 C38 F6' 162.8(9) . . . .
O4 C35 C36 C37 -0.8(11) . . . .
O4 C35 C34 C29 0.8(10) . . . .
O4 C35 C34 C33 177.0(7) . . . .
O2 C20 C19 F2 163.8(7) . . . .
O2 C20 C19 F3 47.1(10) . . . .
O2 C20 C19 F1 -74.5(10) . . . .
N1 C7 C10 N2 -0.7(11) . . . .
N1 C6 C5 C9 2.1(11) . . . .
N1 C6 C5 C4 -177.6(7) . . . .
O3 C22 C21 C20 4.5(12) . . . .
C9 C8 C7 N1 -0.1(12) . . . .
C9 C8 C7 C10 -179.8(7) . . . .
C9 C5 C4 C3 179.2(8) . . . .
C28 C23 C22 O3 -6.5(11) . . . .
C28 C23 C22 C21 172.3(8) . . . .
C28 C23 C24 C25 -2.6(15) . . . .
C28 C27 C26 C25 0.1(17) . . . .
C8 C9 C5 C6 -1.9(11) . . . .
C8 C9 C5 C4 177.8(8) . . . .
C8 C7 C10 N2 179.0(7) . . . .
C18 C17 C14 C13 67.8(12) . . . .
C18 C17 C14 C15 -111.8(10) . . . .
C1 C6 C5 C9 -178.0(7) . . . .
C1 C6 C5 C4 2.3(11) . . . .
C1 C2 C3 C4 2.0(13) . . . .
C7 N1 C6 C1 178.7(6) . . . .
C7 N1 C6 C5 -1.3(10) . . . .
N2 C11 C12 C13 -179.9(8) . . . .
C6 N1 C7 C8 0.3(11) . . . .
C6 N1 C7 C10 -180.0(6) . . . .
C6 C1 C2 C3 -0.8(11) . . . .
C6 C1 O1 Dy1 173.0(5) . . . 2_566
C6 C1 O1 Dy1 3.8(8) . . . .
C6 C5 C4 C3 -1.2(12) . . . .
C5 C9 C8 C7 0.9(12) . . . .
C29 C34 C33 C32 -2.2(13) . . . .
C29 C30 C31 C32 -2.2(15) . . . .
C35 C34 C33 C32 -178.5(8) . . . .
C23 C28 C27 C26 -2.1(15) . . . .
C23 C22 C21 C20 -174.3(7) . . . .
C23 C24 C25 C26 0.7(18) . . . .
C22 C23 C24 C25 176.4(9) . . . .
C22 C21 C20 O2 -6.5(14) . . . .
C22 C21 C20 C19 174.5(8) . . . .
C2 C1 C6 N1 178.6(6) . . . .
C2 C1 C6 C5 -1.4(10) . . . .
C2 C1 O1 Dy1 -174.6(6) . . . .
C2 C1 O1 Dy1 -5.4(11) . . . 2_566
C2 C3 C4 C5 -1.0(13) . . . .
C36 C37 C38 F6 28.3(12) . . . .
C36 C37 C38 F5 158.4(9) . . . .
C36 C37 C38 F4 -85.2(10) . . . .
C36 C37 C38 F4' -135.1(10) . . . .
C36 C37 C38 F5' 106.5(10) . . . .
C36 C37 C38 F6' -16.0(12) . . . .
C36 C35 C34 C29 -178.8(7) . . . .
C36 C35 C34 C33 -2.6(12) . . . .
C34 C29 C30 C31 0.1(14) . . . .
C34 C35 C36 C37 178.7(7) . . . .
C30 C29 C34 C35 178.5(8) . . . .
C30 C29 C34 C33 2.1(13) . . . .
C24 C23 C22 O3 174.5(8) . . . .
C24 C23 C22 C21 -6.7(12) . . . .
C27 C28 C23 C22 -175.8(8) . . . .
C27 C28 C23 C24 3.3(13) . . . .
C27 C26 C25 C24 0.5(19) . . . .
C15 C16 C11 N2 -178.4(7) . . . .
C15 C16 C11 C12 8.3(12) . . . .
C10 N2 C11 C16 146.4(7) . . . .
C10 N2 C11 C12 -40.7(11) . . . .
C38 C37 C36 C35 174.5(7) . . . .
C21 C20 C19 F2 -17.1(11) . . . .
C21 C20 C19 F3 -133.7(9) . . . .
C21 C20 C19 F1 104.7(10) . . . .
C33 C32 C31 C30 2.1(16) . . . .
C16 C15 C14 C13 -3.4(14) . . . .
C16 C15 C14 C17 176.1(8) . . . .
C16 C11 C12 C13 -6.9(14) . . . .
C14 C13 C12 C11 0.5(16) . . . .
C14 C15 C16 C11 -3.3(13) . . . .
C11 N2 C10 C7 178.2(6) . . . .
O1 C1 C6 N1 0.1(10) . . . .
O1 C1 C6 C5 -179.9(7) . . . .
O1 C1 C2 C3 177.7(7) . . . .
C31 C32 C33 C34 0.1(15) . . . .
C12 C13 C14 C15 4.8(15) . . . .
C12 C13 C14 C17 -174.7(9) . . . .
