#------------------------------------------------------------------------------
#$Date: 2019-11-17 08:53:57 +0200 (Sun, 17 Nov 2019) $
#$Revision: 228961 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/22/98/7229810.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_7229810
loop_
_publ_author_name
'You, Li-Xin'
'Zhao, Bai-Bei'
'Liu, Hui-Jie'
'Wang, Shu-Ju'
'Xiong, Gang'
'He, Yong-Ke'
'Ding, Fu'
'Joos, Jonas J.'
'Smet, Philippe F.'
'Sun, Ya-Guang'
_publ_section_title
;
 2D and 3D lanthanide metal--organic frameworks constructed from three
 benzenedicarboxylate ligands: synthesis, structure and luminescent
 properties
;
_journal_issue                   5
_journal_name_full               CrystEngComm
_journal_page_first              615
_journal_paper_doi               10.1039/C7CE01773A
_journal_volume                  20
_journal_year                    2018
_chemical_formula_moiety         'C26 H19 Dy N2 O10'
_chemical_formula_sum            'C26 H19 Dy N2 O10'
_chemical_formula_weight         681.93
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2ybc'
_space_group_name_H-M_alt        'P 1 21/c 1'
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     direct
_audit_block_doi                 10.5517/cc1j7mlz
_audit_creation_date             2017-12-04
_audit_creation_method
;
Olex2 1.2
(compiled 2016.09.09 svn.r3337 for OlexSys, GUI svn.r5227)
;
_audit_update_record
;
2015-06-18 deposited with the CCDC.
2017-12-27 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 104.47(3)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   14.708(3)
_cell_length_b                   16.437(3)
_cell_length_c                   10.219(2)
_cell_measurement_reflns_used    5790
_cell_measurement_temperature    293
_cell_measurement_theta_max      27.5
_cell_measurement_theta_min      3.0
_cell_volume                     2392.1(9)
_computing_cell_refinement
;
CrystalClear-SM Expert 2.0 r1 (Rigaku, 2009)
;
_computing_data_collection
;
CrystalClear-SM Expert 2.0 r1 (Rigaku, 2009)
;
_computing_data_reduction
;
CrystalClear-SM Expert 2.0 r1 (Rigaku, 2009)
;
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2015)'
_computing_structure_solution    'ShelXS (Sheldrick, 2008)'
_diffrn_ambient_temperature      293
_diffrn_detector                 CCD
_diffrn_detector_area_resol_mean 13.6612
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.994
_diffrn_measurement_details
;
scan:
    Number of images: 180
               Slice: -60.0000 - 120.0000
         Image width: 1.0000
            Exp time: 16.0000
       Rotation axis: Omega
               Omega: 0.0000
                 Chi: 54.0000
                 Phi: 0.0000
                 XTD: 50.1657
              2theta: 29.8527
scan:
    Number of images: 180
               Slice: -60.0000 - 120.0000
         Image width: 1.0000
            Exp time: 16.0000
       Rotation axis: Omega
               Omega: 0.0000
                 Chi: 54.0000
                 Phi: 120.0000
                 XTD: 50.1657
              2theta: 29.8527
scan:
    Number of images: 180
               Slice: -60.0000 - 120.0000
         Image width: 1.0000
            Exp time: 16.0000
       Rotation axis: Omega
               Omega: 0.0000
                 Chi: 54.0000
                 Phi: 240.0000
                 XTD: 50.1657
              2theta: 29.8527
;
_diffrn_measurement_device
;
XtaLABmini: Fixed Chi 2 circle
;
_diffrn_measurement_device_type  'Rigaku Mercury375R (2x2 bin mode)'
_diffrn_measurement_method       'profile data from ω-scans'
_diffrn_measurement_specimen_support Fiber
_diffrn_orient_matrix_type       d*Trek
_diffrn_orient_matrix_UB_11      0.044652
_diffrn_orient_matrix_UB_12      0.037262
_diffrn_orient_matrix_UB_13      0.082654
_diffrn_orient_matrix_UB_21      0.027506
_diffrn_orient_matrix_UB_22      0.042342
_diffrn_orient_matrix_UB_23      -0.033948
_diffrn_orient_matrix_UB_31      -0.044935
_diffrn_orient_matrix_UB_32      0.048369
_diffrn_orient_matrix_UB_33      0.023921
_diffrn_radiation_monochromator  'Graphite Monochromator'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0852
_diffrn_reflns_av_unetI/netI     0.0638
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.994
_diffrn_reflns_limit_h_max       19
_diffrn_reflns_limit_h_min       -19
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_k_min       -21
_diffrn_reflns_limit_l_max       13
_diffrn_reflns_limit_l_min       -13
_diffrn_reflns_number            24280
_diffrn_reflns_point_group_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.994
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         27.523
_diffrn_reflns_theta_min         3.048
_diffrn_source                   'Sealed Tube'
_diffrn_source_current           12.0
_diffrn_source_power             0.6
_diffrn_source_voltage           50.0
_exptl_absorpt_coefficient_mu    3.190
_exptl_absorpt_correction_T_max  0.998
_exptl_absorpt_correction_T_min  0.993
_exptl_absorpt_correction_type   numerical
_exptl_crystal_colour            Colorless
_exptl_crystal_density_diffrn    1.893
_exptl_crystal_description       Prism
_exptl_crystal_F_000             1340
_exptl_crystal_size_max          0.2
_exptl_crystal_size_mid          0.2
_exptl_crystal_size_min          0.2
_refine_diff_density_max         1.066
_refine_diff_density_min         -1.781
_refine_diff_density_rms         0.146
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.115
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     363
_refine_ls_number_reflns         5480
_refine_ls_number_restraints     7
_refine_ls_restrained_S_all      1.116
_refine_ls_R_factor_all          0.0569
_refine_ls_R_factor_gt           0.0435
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0342P)²+2.1087P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0954
_refine_ls_wR_factor_ref         0.1018
_reflns_Friedel_coverage         0.000
_reflns_number_gt                4595
_reflns_number_total             5480
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            c7ce01773a2.cif
_cod_data_source_block           434343
_cod_depositor_comments
;
The following automatic conversions were performed:

'_exptl_absorpt_correction_type' value 'Numerical' changed to
'numerical' according to
/home/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 4973 2017-02-22 13:04:09Z antanas 

 Adding full bibliography for 7229803--7229819.cif.
;
_cod_database_code               7229810
_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.
;
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups
 At 1.5 times of:
  All O(H) groups, All O(H,H,H,H) groups
2. Restrained distances
 O9-H9A
 0.85 with sigma of 0.01
 H10B-O10
 0.85 with sigma of 0.01
 H10A-O10
 0.85 with sigma of 0.01
 H10B-H10A
 1.39 with sigma of 0.01
 H9B-H9A
 1.39 with sigma of 0.01
 O9-H9B
 0.85 with sigma of 0.01
3. Rigid bond restraints
 N2, C1
 with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.01
4.a Rotating group:
 O10(H10A)
4.b Aromatic/amide H refined with riding coordinates:
 C7(H7), C9(H9), C16(H16), C20(H20), C11(H11), C18(H18), C25(H25), C24(H24),
 C26(H26), C23(H23), C2(H2), C4(H4), C1(H1), C5(H5)
4.c Idealised tetrahedral OH refined as rotating group:
 O5(H5A)
;
_shelx_shelxl_version_number     2016/6
_olex2_submission_special_instructions 'No special instructions were received'
loop_
_space_group_symop_operation_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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
C7 C 0.3637(4) 0.4585(3) 0.5522(5) 0.0248(11) Uani 1 1 d . .
H7 H 0.322286 0.494744 0.497969 0.030 Uiso 1 1 calc R .
C8 C 0.3956(4) 0.4730(3) 0.6911(5) 0.0220(11) Uani 1 1 d . .
O7 O 0.8050(2) 0.2577(2) 0.3126(4) 0.0241(8) Uani 1 1 d . .
Dy1 Dy 0.70032(2) 0.18689(2) 0.63314(2) 0.01789(8) Uani 1 1 d . .
O4 O 0.5918(3) 0.2380(2) 0.7410(4) 0.0267(8) Uani 1 1 d . .
O8 O 0.8164(3) 0.2281(3) 0.5292(4) 0.0359(10) Uani 1 1 d . .
C15 C 0.9374(4) 0.3076(3) 0.4766(5) 0.0226(11) Uani 1 1 d . .
C10 C 0.4896(4) 0.3520(3) 0.7162(5) 0.0208(10) Uani 1 1 d . .
C13 C 0.5649(4) 0.2966(3) 0.8000(5) 0.0223(11) Uani 1 1 d . .
C14 C 0.8458(4) 0.2615(3) 0.4369(5) 0.0204(10) Uani 1 1 d . .
C9 C 0.4585(4) 0.4199(3) 0.7728(5) 0.0242(11) Uani 1 1 d . .
H9 H 0.479737 0.429841 0.865009 0.029 Uiso 1 1 calc R .
C16 C 0.9928(4) 0.3062(3) 0.6093(5) 0.0246(11) Uani 1 1 d . .
H16 H 0.974301 0.275769 0.674895 0.030 Uiso 1 1 calc R .
C20 C 0.9671(4) 0.3522(3) 0.3788(5) 0.0243(11) Uani 1 1 d . .
H20 H 0.931269 0.351458 0.289867 0.029 Uiso 1 1 calc R .
C11 C 0.4555(4) 0.3361(3) 0.5775(5) 0.0250(11) Uani 1 1 d . .
H11 H 0.474573 0.289287 0.540712 0.030 Uiso 1 1 calc R .
C22 C 1.0812(4) 0.4442(3) 0.3059(6) 0.0273(11) Uani 1 1 d . .
C3 C 0.3631(4) 0.3769(4) 0.3450(6) 0.0309(13) Uani 1 1 d . .
C18 C 1.1042(4) 0.3967(4) 0.5458(6) 0.0309(13) Uani 1 1 d . .
H18 H 1.159276 0.426961 0.569601 0.037 Uiso 1 1 calc R .
O6 O 1.1231(4) 0.2957(3) 0.8656(5) 0.0715(18) Uani 1 1 d . .
C17 C 1.0763(4) 0.3509(3) 0.6426(5) 0.0287(12) Uani 1 1 d . .
N1 N 1.1360(4) 0.5308(3) 0.1020(6) 0.0428(13) Uani 1 1 d . .
C6 C 0.3940(4) 0.3893(3) 0.4948(5) 0.0247(11) Uani 1 1 d . .
C19 C 1.0496(4) 0.3977(3) 0.4121(5) 0.0248(11) Uani 1 1 d . .
C25 C 1.0964(5) 0.4578(4) 0.0791(7) 0.0488(18) Uani 1 1 d . .
H25 H 1.087866 0.435552 -0.006790 0.059 Uiso 1 1 calc R .
C21 C 1.1380(5) 0.3450(4) 0.7839(6) 0.0436(16) Uani 1 1 d . .
C24 C 1.1488(5) 0.5605(4) 0.2261(7) 0.0451(16) Uani 1 1 d . .
H24 H 1.176022 0.611736 0.243782 0.054 Uiso 1 1 calc R .
C26 C 1.0673(5) 0.4132(4) 0.1752(6) 0.0430(16) Uani 1 1 d . .
H26 H 1.038730 0.362842 0.153237 0.052 Uiso 1 1 calc R .
C23 C 1.1239(4) 0.5199(4) 0.3304(6) 0.0368(14) Uani 1 1 d . .
H23 H 1.135685 0.543016 0.416074 0.044 Uiso 1 1 calc R .
O2 O 0.3966(3) 0.5662(2) 0.8713(4) 0.0298(9) Uani 1 1 d . .
O3 O 0.5954(3) 0.3143(2) 0.9231(4) 0.0353(10) Uani 1 1 d . .
O1 O 0.2964(3) 0.5906(2) 0.6751(4) 0.0254(8) Uani 1 1 d . .
O10 O 0.7978(3) 0.0748(2) 0.6111(4) 0.0374(10) Uani 1 1 d D .
H10A H 0.809613 0.075118 0.531377 0.056 Uiso 1 1 d DGR .
O9 O 0.6758(3) 0.3342(3) 0.5648(4) 0.0363(10) Uani 1 1 d D .
C12 C 0.3614(4) 0.5476(3) 0.7492(5) 0.0232(11) Uani 1 1 d . .
C2 C 0.3255(5) 0.3044(5) 0.2882(7) 0.0513(19) Uani 1 1 d . .
H2 H 0.321266 0.258978 0.340538 0.062 Uiso 1 1 calc R .
N2 N 0.3058(5) 0.3664(5) 0.0655(6) 0.0644(19) Uani 1 1 d . U
C4 C 0.3725(5) 0.4402(5) 0.2580(6) 0.0540(19) Uani 1 1 d . .
H4 H 0.397092 0.489693 0.294678 0.065 Uiso 1 1 calc R .
C1 C 0.2928(6) 0.3031(5) 0.1416(8) 0.062(2) Uani 1 1 d . U
H1 H 0.262035 0.257070 0.099454 0.075 Uiso 1 1 calc R .
C5 C 0.3470(7) 0.4317(6) 0.1222(8) 0.071(2) Uani 1 1 d . .
H5 H 0.359323 0.473661 0.068137 0.086 Uiso 1 1 calc R .
O5 O 1.2088(3) 0.3949(3) 0.8118(5) 0.0570(14) Uani 1 1 d . .
H5A H 1.238258 0.388634 0.890608 0.086 Uiso 1 1 calc GR .
H9A H 0.689(5) 0.353(5) 0.494(4) 0.086 Uiso 1 1 d DR .
H10B H 0.794(6) 0.0258(11) 0.634(5) 0.086 Uiso 1 1 d DR .
H9B H 0.6166(11) 0.330(5) 0.551(7) 0.086 Uiso 1 1 d DR .
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'
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
C8 C7 C6 120.1(5) . .
C7 C8 C12 118.6(4) . .
C9 C8 C7 120.4(5) . .
C9 C8 C12 120.9(5) . .
C14 O7 Dy1 148.0(3) . 4_565
O7 Dy1 O4 83.02(13) 4_566 .
O7 Dy1 O8 79.93(14) 4_566 .
O7 Dy1 O2 128.11(13) 4_566 2_646
O7 Dy1 O3 156.23(13) 4_566 4_565
O7 Dy1 O1 75.26(12) 4_566 2_646
O7 Dy1 O10 94.83(15) 4_566 .
O7 Dy1 O9 81.94(14) 4_566 .
O7 Dy1 C12 101.86(14) 4_566 2_646
O4 Dy1 O8 141.73(15) . .
O4 Dy1 O2 80.47(13) . 2_646
O4 Dy1 O1 74.78(12) . 2_646
O4 Dy1 O10 146.11(14) . .
O4 Dy1 O9 73.46(14) . .
O4 Dy1 C12 76.07(14) . 2_646
O8 Dy1 O2 136.15(14) . 2_646
O8 Dy1 O1 131.85(14) . 2_646
O8 Dy1 O10 69.74(15) . .
O8 Dy1 O9 70.40(15) . .
O8 Dy1 C12 141.00(15) . 2_646
O2 Dy1 O1 52.99(12) 2_646 2_646
O2 Dy1 O9 137.24(14) 2_646 .
O2 Dy1 C12 26.32(13) 2_646 2_646
O3 Dy1 O4 93.77(15) 4_565 .
O3 Dy1 O8 88.53(14) 4_565 .
O3 Dy1 O2 73.96(13) 4_565 2_646
O3 Dy1 O1 126.73(12) 4_565 2_646
O3 Dy1 O10 100.59(16) 4_565 .
O3 Dy1 O9 74.60(14) 4_565 .
O3 Dy1 C12 100.17(14) 4_565 2_646
O1 Dy1 O9 142.71(13) 2_646 .
O1 Dy1 C12 26.67(13) 2_646 2_646
O10 Dy1 O2 74.40(15) . 2_646
O10 Dy1 O1 72.01(13) . 2_646
O10 Dy1 O9 139.96(15) . .
O10 Dy1 C12 71.29(15) . 2_646
O9 Dy1 C12 148.58(15) . 2_646
C13 O4 Dy1 148.0(4) . .
C14 O8 Dy1 154.0(4) . .
C16 C15 C14 121.1(5) . .
C20 C15 C14 119.3(5) . .
C20 C15 C16 119.6(5) . .
C9 C10 C13 121.1(4) . .
C9 C10 C11 120.0(5) . .
C11 C10 C13 118.8(4) . .
O4 C13 C10 117.6(4) . .
O4 C13 O3 125.6(5) . .
O3 C13 C10 116.8(5) . .
O7 C14 C15 117.6(4) . .
O8 C14 O7 124.4(5) . .
O8 C14 C15 118.0(5) . .
C10 C9 C8 119.6(5) . .
C15 C16 C17 119.4(5) . .
C19 C20 C15 121.1(5) . .
C6 C11 C10 120.8(5) . .
C26 C22 C19 120.8(5) . .
C23 C22 C19 122.4(5) . .
C23 C22 C26 116.8(5) . .
C2 C3 C6 122.4(6) . .
C2 C3 C4 117.9(6) . .
C4 C3 C6 119.7(6) . .
C17 C18 C19 120.2(5) . .
C16 C17 C21 118.8(5) . .
C18 C17 C16 120.7(5) . .
C18 C17 C21 120.4(5) . .
C24 N1 C25 116.9(5) . .
C7 C6 C3 119.4(5) . .
C11 C6 C7 119.0(5) . .
C11 C6 C3 121.5(5) . .
C20 C19 C22 120.5(5) . .
C20 C19 C18 118.9(5) . .
C18 C19 C22 120.5(5) . .
N1 C25 C26 123.8(6) . .
O6 C21 C17 122.0(6) . .
O6 C21 O5 122.7(6) . .
O5 C21 C17 115.3(6) . .
N1 C24 C23 123.8(6) . .
C25 C26 C22 119.4(6) . .
C24 C23 C22 119.3(6) . .
C12 O2 Dy1 94.9(3) . 2_656
C13 O3 Dy1 156.1(4) . 4_566
C12 O1 Dy1 91.2(3) . 2_656
C8 C12 Dy1 178.3(4) . 2_656
O2 C12 C8 119.5(5) . .
O2 C12 Dy1 58.8(3) . 2_656
O2 C12 O1 120.9(5) . .
O1 C12 C8 119.5(4) . .
O1 C12 Dy1 62.1(3) . 2_656
C3 C2 C1 116.2(7) . .
C5 N2 C1 120.1(7) . .
C5 C4 C3 122.0(8) . .
N2 C1 C2 121.8(7) . .
N2 C5 C4 121.6(9) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C7 C8 1.399(7) .
C7 C6 1.402(7) .
C8 C9 1.389(7) .
C8 C12 1.503(7) .
O7 Dy1 2.269(3) 4_565
O7 C14 1.264(6) .
Dy1 O4 2.312(4) .
Dy1 O8 2.326(4) .
Dy1 O2 2.436(4) 2_646
Dy1 O3 2.310(4) 4_565
Dy1 O1 2.510(4) 2_646
Dy1 O10 2.379(4) .
Dy1 O9 2.520(4) .
Dy1 C12 2.838(5) 2_646
O4 C13 1.251(6) .
O8 C14 1.258(6) .
C15 C14 1.510(7) .
C15 C16 1.397(7) .
C15 C20 1.394(7) .
C10 C13 1.522(7) .
C10 C9 1.386(7) .
C10 C11 1.405(7) .
C13 O3 1.260(6) .
C16 C17 1.399(7) .
C20 C19 1.393(7) .
C11 C6 1.384(7) .
C22 C19 1.493(7) .
C22 C26 1.396(8) .
C22 C23 1.388(8) .
C3 C6 1.498(7) .
C3 C2 1.379(9) .
C3 C4 1.399(9) .
C18 C17 1.384(8) .
C18 C19 1.401(7) .
O6 C21 1.222(8) .
C17 C21 1.504(8) .
N1 C25 1.328(8) .
N1 C24 1.328(8) .
C25 C26 1.376(8) .
C21 O5 1.300(8) .
C24 C23 1.383(8) .
O2 C12 1.263(6) .
O1 C12 1.274(6) .
C2 C1 1.454(10) .
N2 C1 1.341(10) .
N2 C5 1.295(11) .
C4 C5 1.351(9) .
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
C7 C8 C9 C10 -0.2(8) . .
C7 C8 C12 O2 -172.8(5) . .
C7 C8 C12 O1 8.1(7) . .
C8 C7 C6 C11 0.1(8) . .
C8 C7 C6 C3 -176.9(5) . .
Dy1 O7 C14 O8 91.4(8) 4_565 .
Dy1 O7 C14 C15 -90.3(7) 4_565 .
Dy1 O4 C13 C10 95.9(7) . .
Dy1 O4 C13 O3 -83.4(8) . .
Dy1 O8 C14 O7 -38.7(12) . .
Dy1 O8 C14 C15 143.1(7) . .
Dy1 O2 C12 C8 -179.6(4) 2_656 .
Dy1 O2 C12 O1 -0.5(5) 2_656 .
Dy1 O1 C12 C8 179.6(4) 2_656 .
Dy1 O1 C12 O2 0.5(5) 2_656 .
O4 C13 O3 Dy1 19.3(13) . 4_566
C15 C16 C17 C18 0.4(9) . .
C15 C16 C17 C21 -176.5(5) . .
C15 C20 C19 C22 179.1(5) . .
C15 C20 C19 C18 1.6(8) . .
C10 C13 O3 Dy1 -160.0(7) . 4_566
C10 C11 C6 C7 -1.9(8) . .
C10 C11 C6 C3 175.0(5) . .
C13 C10 C9 C8 174.6(5) . .
C13 C10 C11 C6 -173.6(5) . .
C14 C15 C16 C17 -178.8(5) . .
C14 C15 C20 C19 177.8(5) . .
C9 C8 C12 O2 6.4(8) . .
C9 C8 C12 O1 -172.7(5) . .
C9 C10 C13 O4 -177.6(5) . .
C9 C10 C13 O3 1.8(8) . .
C9 C10 C11 C6 2.7(8) . .
C16 C15 C14 O7 -171.9(5) . .
C16 C15 C14 O8 6.5(8) . .
C16 C15 C20 C19 -2.3(8) . .
C16 C17 C21 O6 8.5(10) . .
C16 C17 C21 O5 -172.6(6) . .
C20 C15 C14 O7 8.1(7) . .
C20 C15 C14 O8 -173.6(5) . .
C20 C15 C16 C17 1.3(8) . .
C11 C10 C13 O4 -1.3(8) . .
C11 C10 C13 O3 178.0(5) . .
C11 C10 C9 C8 -1.6(8) . .
C3 C2 C1 N2 5.5(12) . .
C3 C4 C5 N2 5.4(14) . .
C18 C17 C21 O6 -168.5(7) . .
C18 C17 C21 O5 10.4(9) . .
C17 C18 C19 C20 0.2(9) . .
C17 C18 C19 C22 -177.4(5) . .
N1 C25 C26 C22 -1.4(12) . .
N1 C24 C23 C22 -1.4(11) . .
C6 C7 C8 C9 1.0(8) . .
C6 C7 C8 C12 -179.8(5) . .
C6 C3 C2 C1 176.0(6) . .
C6 C3 C4 C5 179.0(7) . .
C19 C22 C26 C25 179.3(6) . .
C19 C22 C23 C24 -178.0(6) . .
C19 C18 C17 C16 -1.1(9) . .
C19 C18 C17 C21 175.8(6) . .
C25 N1 C24 C23 0.4(11) . .
C24 N1 C25 C26 1.0(11) . .
C26 C22 C19 C20 -35.9(8) . .
C26 C22 C19 C18 141.6(6) . .
C26 C22 C23 C24 1.0(9) . .
C23 C22 C19 C20 143.0(6) . .
C23 C22 C19 C18 -39.5(8) . .
C23 C22 C26 C25 0.3(10) . .
C12 C8 C9 C10 -179.4(5) . .
C2 C3 C6 C7 -130.5(6) . .
C2 C3 C6 C11 52.6(8) . .
C2 C3 C4 C5 -0.7(11) . .
C4 C3 C6 C7 49.9(8) . .
C4 C3 C6 C11 -127.0(7) . .
C4 C3 C2 C1 -4.3(10) . .
C1 N2 C5 C4 -4.3(14) . .
C5 N2 C1 C2 -1.2(13) . .
