# Electronic Supplementary Material (ESI) for Inorganic Chemistry Frontiers.
# This journal is © the Partner Organisations 2018

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
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data_111
_database_code_depnum_ccdc_archive 'CCDC 1824966'
_audit_update_record             
;
2018-02-21 deposited with the CCDC.
2018-05-03 downloaded from the CCDC.
;
_audit_creation_date             2018-02-21
_audit_creation_method           
;
Olex2 1.2
(compiled 2017.08.10 svn.r3458 for OlexSys, GUI svn.r5381)
;
_shelx_SHELXL_version_number     2016/6
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C116 H180 Dy4 N8 O24, 2(C O)'
_chemical_formula_sum            'C118 H180 Dy4 N8 O26'
_chemical_formula_weight         2776.69
_chemical_melting_point          ?
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'

_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.
;
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   12.2174(4)
_cell_length_b                   15.9283(6)
_cell_length_c                   19.3779(7)
_cell_angle_alpha                77.6670(10)
_cell_angle_beta                 77.7820(10)
_cell_angle_gamma                68.5510(10)
_cell_volume                     3391.7(2)
_cell_formula_units_Z            1
_cell_measurement_reflns_used    16524
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      27.1
_cell_measurement_theta_min      3.1
_shelx_estimated_absorpt_T_max   0.775
_shelx_estimated_absorpt_T_min   0.534
_exptl_absorpt_coefficient_mu    2.243
_exptl_absorpt_correction_T_max  0.8723
_exptl_absorpt_correction_T_min  0.6722
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   ?
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.359
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       block
_exptl_crystal_F_000             1416
_exptl_crystal_size_max          0.32
_exptl_crystal_size_mid          0.25
_exptl_crystal_size_min          0.12
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0417
_diffrn_reflns_av_unetI/netI     0.0269
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.998
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_l_max       23
_diffrn_reflns_limit_l_min       -23
_diffrn_reflns_number            75493
_diffrn_reflns_point_group_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.998
_diffrn_reflns_theta_full        25.008
_diffrn_reflns_theta_max         25.008
_diffrn_reflns_theta_min         3.028
_diffrn_ambient_temperature      293(2)
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_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_source                   ?
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                9398
_reflns_number_total             11939
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       ?
_computing_data_collection       ?
_computing_data_reduction        ?
_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)
;
_refine_diff_density_max         2.116
_refine_diff_density_min         -0.889
_refine_diff_density_rms         0.116
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.080
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     733
_refine_ls_number_reflns         11939
_refine_ls_number_restraints     148
_refine_ls_R_factor_all          0.0721
_refine_ls_R_factor_gt           0.0527
_refine_ls_restrained_S_all      1.117
_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)+(0.0468P)²+21.3952P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1226
_refine_ls_wR_factor_ref         0.1393
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups
 At 1.5 times of:
  All C(H,H,H) groups, All O(H) groups
2. Restrained distances
 O12-H12
 0.85 with sigma of 0.01
 C58-H12
 1.853504 with sigma of 0.02
3. Rigid bond restraints
 C58, O12
 with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.02
 C55, C54
 with sigma for 1-2 distances of 0.001 and sigma for 1-3 distances of 0.002
 C28, C27, C26, C25
 with sigma for 1-2 distances of 0.001 and sigma for 1-3 distances of 0.002
 C26, C28, C25, C27
 with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.02
 C32, C33, C35, C34
 with sigma for 1-2 distances of 0.001 and sigma for 1-3 distances of 0.002
4. Uiso/Uaniso restraints and constraints
Uanis(C58) \\sim Ueq, Uanis(O12) \\sim Ueq: with sigma of 0.01 and sigma for
terminal atoms of 0.02
Uanis(C55) \\sim Ueq, Uanis(C56) \\sim Ueq, Uanis(C57) \\sim Ueq, Uanis(C15)
\\sim Ueq, Uanis(C14) \\sim Ueq, Uanis(C26) \\sim Ueq, Uanis(C25) \\sim Ueq,
Uanis(C27) \\sim Ueq, Uanis(C22) \\sim Ueq, Uanis(C23) \\sim Ueq, Uanis(C47)
\\sim Ueq, Uanis(C49) \\sim Ueq, Uanis(C37) \\sim Ueq, Uanis(C36) \\sim Ueq:
with sigma of 0.01 and sigma for terminal atoms of 0.02
Uanis(C34) \\sim Ueq, Uanis(C33) \\sim Ueq, Uanis(C35) \\sim Ueq: with sigma of
0.01 and sigma for terminal atoms of 0.02
Uanis(O0AA) \\sim Ueq, Uanis(C0AA) \\sim Ueq: with sigma of 0.01 and sigma for
terminal atoms of 0.02
Uanis(C54) \\sim Ueq: with sigma of 0.01 and sigma for terminal atoms of 0.02
5.a Aromatic/amide H refined with riding coordinates:
 C52(H52), C8(H8), C10(H10), C9(H9), C4(H4), C3(H3A), C2(H2), C19(H19),
 C41(H41), C30(H30)
5.b Idealised Me refined as rotating group:
 C46(H46A,H46B,H46C), C16(H16A,H16B,H16C), C34(H34A,H34B,H34C), C37(H37A,H37B,
 H37C), C49(H49A,H49B,H49C), C24(H24A,H24B,H24C), C35(H35A,H35B,H35C), C48(H48A,
 H48B,H48C), C44(H44A,H44B,H44C), C22(H22A,H22B,H22C), C36(H36A,H36B,H36C),
 C23(H23A,H23B,H23C), C14(H14A,H14B,H14C), C26(H26A,H26B,H26C), C38(H38A,H38B,
 H38C), C27(H27A,H27B,H27C), C25(H25A,H25B,H25C), C55(H55A,H55B,H55C), C13(H13A,
 H13B,H13C), C33(H33A,H33B,H33C), C57(H57A,H57B,H57C), C45(H45A,H45B,H45C),
 C56(H56A,H56B,H56C), C15(H15A,H15B,H15C), C47(H47A,H47B,H47C), C58(H58A,H58B,
 H58C)
5.c Idealised tetrahedral OH refined as rotating group:
 O3(H3)
;
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     iterative
_atom_sites_solution_secondary   ?
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 0.77831(3) 0.29588(2) 0.30617(2) 0.04312(11) Uani 1 1 d . . . . .
Dy2 Dy 0.93654(3) 0.03412(3) 0.09401(2) 0.05233(13) Uani 1 1 d . . . . .
O4 O 1.0508(5) -0.1140(4) 0.1278(4) 0.0768(18) Uani 1 1 d . . . . .
O2 O 1.0228(5) 0.0543(4) 0.1823(3) 0.0617(15) Uani 1 1 d . . . . .
O11 O 0.9159(5) 0.3608(4) 0.2377(3) 0.0667(16) Uani 1 1 d . . . . .
O7 O 0.5949(4) 0.2770(4) 0.3196(3) 0.0532(13) Uani 1 1 d . . . . .
O3 O 1.0522(5) 0.1897(5) 0.3610(3) 0.0713(17) Uani 1 1 d . . . . .
H3 H 1.014902 0.235506 0.379735 0.107 Uiso 1 1 calc GR . . . .
O9 O 0.6611(5) 0.4351(4) 0.3405(3) 0.0668(16) Uani 1 1 d . . . . .
O5 O 0.8163(5) -0.0392(4) 0.1708(3) 0.0632(14) Uani 1 1 d . . . . .
O1 O 0.8907(5) -0.0025(4) -0.0058(3) 0.0627(15) Uani 1 1 d . . . . .
O8 O 0.8619(4) 0.3226(4) 0.3972(3) 0.0552(13) Uani 1 1 d . . . . .
O10 O 0.7066(5) 0.3772(4) 0.1997(3) 0.0560(13) Uani 1 1 d . . . . .
O6 O 0.7696(5) 0.1794(4) 0.3996(3) 0.0607(14) Uani 1 1 d . . . . .
N2 N 0.8095(5) 0.1530(4) 0.1732(3) 0.0437(13) Uani 1 1 d . . . . .
N1 N 0.7297(6) 0.1195(5) 0.0710(3) 0.0569(17) Uani 1 1 d . . . . .
N4 N 0.9877(5) 0.1823(4) 0.3133(3) 0.0492(15) Uani 1 1 d . . . . .
N3 N 0.8588(5) 0.1698(4) 0.2253(3) 0.0459(14) Uani 1 1 d . . . . .
C11 C 0.9717(6) 0.1138(5) 0.2234(4) 0.0503(18) Uani 1 1 d . . . . .
C52 C 0.8244(11) 0.4645(10) 0.1464(7) 0.122(5) Uani 1 1 d . . . . .
H52 H 0.830531 0.513137 0.111178 0.146 Uiso 1 1 calc R . . . .
C28 C 0.7286(12) 0.0795(10) 0.5063(8) 0.118(4) Uani 1 1 d . U . . .
C17 C 1.1643(11) -0.2492(9) 0.1952(8) 0.114(4) Uani 1 1 d . . . . .
C46 C 0.4477(11) 0.5718(9) 0.3645(10) 0.147(7) Uani 1 1 d . . . . .
H46A H 0.407281 0.557392 0.411288 0.221 Uiso 1 1 calc GR . . . .
H46B H 0.464576 0.523397 0.337500 0.221 Uiso 1 1 calc GR . . . .
H46C H 0.398077 0.627664 0.340654 0.221 Uiso 1 1 calc GR . . . .
C21 C 0.7238(13) -0.1027(9) 0.2793(9) 0.133(6) Uani 1 1 d . . . . .
C16 C 1.1543(12) -0.3262(8) 0.2513(8) 0.129(5) Uani 1 1 d . . . . .
H16A H 1.099721 -0.350818 0.240808 0.194 Uiso 1 1 calc GR . . . .
H16B H 1.125642 -0.305026 0.296713 0.194 Uiso 1 1 calc GR . . . .
H16C H 1.230917 -0.372710 0.252724 0.194 Uiso 1 1 calc GR . . . .
C34 C 0.3461(10) 0.3593(9) 0.3576(10) 0.145(5) Uani 1 1 d . U . . .
H34A H 0.358507 0.391296 0.310240 0.217 Uiso 1 1 calc GR . . . .
H34B H 0.378400 0.379282 0.389575 0.217 Uiso 1 1 calc GR . . . .
H34C H 0.262439 0.371707 0.373059 0.217 Uiso 1 1 calc GR . . . .
C54 C 1.0393(15) 0.4394(13) 0.1690(10) 0.140(5) Uani 1 1 d . U . . .
C37 C 0.9281(16) 0.2741(11) 0.5342(8) 0.158(7) Uani 1 1 d . U . . .
H37A H 0.970389 0.229490 0.502903 0.237 Uiso 1 1 calc GR . . . .
H37B H 0.850882 0.269320 0.552843 0.237 Uiso 1 1 calc GR . . . .
H37C H 0.971535 0.263384 0.572895 0.237 Uiso 1 1 calc GR . . . .
C49 C 0.6176(15) 0.5861(11) 0.0791(10) 0.168(7) Uani 1 1 d . U . . .
H49A H 0.691357 0.591044 0.052432 0.253 Uiso 1 1 calc GR . . . .
H49B H 0.596067 0.617942 0.119432 0.253 Uiso 1 1 calc GR . . . .
H49C H 0.556546 0.612496 0.049103 0.253 Uiso 1 1 calc GR . . . .
C24 C 0.7413(15) -0.1773(11) 0.3399(9) 0.172(8) Uani 1 1 d . . . . .
H24A H 0.798375 -0.174589 0.365935 0.258 Uiso 1 1 calc GR . . . .
H24B H 0.769883 -0.234736 0.322551 0.258 Uiso 1 1 calc GR . . . .
H24C H 0.667089 -0.171136 0.370881 0.258 Uiso 1 1 calc GR . . . .
C35 C 0.3967(14) 0.2420(15) 0.2907(10) 0.186(6) Uani 1 1 d . U . . .
H35A H 0.314885 0.262021 0.283906 0.279 Uiso 1 1 calc GR . . . .
H35B H 0.430901 0.177185 0.291221 0.279 Uiso 1 1 calc GR . . . .
H35C H 0.439439 0.272038 0.252297 0.279 Uiso 1 1 calc GR . . . .
C48 C 0.6668(15) 0.4393(16) 0.0425(9) 0.203(11) Uani 1 1 d . . . . .
H48A H 0.608683 0.466687 0.010504 0.304 Uiso 1 1 calc GR . . . .
H48B H 0.671714 0.376971 0.059371 0.304 Uiso 1 1 calc GR . . . .
H48C H 0.742835 0.441307 0.017721 0.304 Uiso 1 1 calc GR . . . .
C44 C 0.5454(17) 0.6387(10) 0.4297(12) 0.212(11) Uani 1 1 d . . . . .
H44A H 0.496262 0.700471 0.416184 0.319 Uiso 1 1 calc GR . . . .
H44B H 0.621560 0.637888 0.436197 0.319 Uiso 1 1 calc GR . . . .
H44C H 0.508105 0.612973 0.473543 0.319 Uiso 1 1 calc GR . . . .
C22 C 0.6759(18) -0.0070(12) 0.3049(10) 0.204(9) Uani 1 1 d . U . . .
H22A H 0.609672 -0.004367 0.342246 0.306 Uiso 1 1 calc GR . . . .
H22B H 0.650974 0.039898 0.265510 0.306 Uiso 1 1 calc GR . . . .
H22C H 0.737905 0.002034 0.322561 0.306 Uiso 1 1 calc GR . . . .
C36 C 1.0333(13) 0.3684(14) 0.4517(10) 0.174(7) Uani 1 1 d . U . . .
H36A H 1.085414 0.363230 0.484356 0.261 Uiso 1 1 calc GR . . . .
H36B H 1.024794 0.423833 0.418547 0.261 Uiso 1 1 calc GR . . . .
H36C H 1.066055 0.317230 0.426151 0.261 Uiso 1 1 calc GR . . . .
C23 C 0.6333(18) -0.1051(17) 0.2445(12) 0.205(9) Uani 1 1 d . U . . .
H23A H 0.668836 -0.143913 0.208406 0.308 Uiso 1 1 calc GR . . . .
H23B H 0.591972 -0.044536 0.222906 0.308 Uiso 1 1 calc GR . . . .
H23C H 0.578279 -0.128381 0.278939 0.308 Uiso 1 1 calc GR . . . .
C14 C 1.2191(16) -0.2849(12) 0.1238(10) 0.200(9) Uani 1 1 d . U . . .
H14A H 1.288825 -0.337467 0.130344 0.299 Uiso 1 1 calc GR . . . .
H14B H 1.240346 -0.238182 0.089469 0.299 Uiso 1 1 calc GR . . . .
H14C H 1.162346 -0.301437 0.107021 0.299 Uiso 1 1 calc GR . . . .
C26 C 0.6334(17) 0.0537(15) 0.5554(11) 0.209(8) Uani 1 1 d . U . . .
H26A H 0.618677 0.006956 0.538534 0.313 Uiso 1 1 calc GR . . . .
H26B H 0.562333 0.106074 0.557965 0.313 Uiso 1 1 calc GR . . . .
H26C H 0.656719 0.031226 0.602059 0.313 Uiso 1 1 calc GR . . . .
C39 C 0.9143(10) 0.3701(10) 0.4924(7) 0.105(4) Uani 1 1 d . . . . .
C38 C 0.8713(11) 0.4332(11) 0.5442(8) 0.139(6) Uani 1 1 d . . . . .
H38A H 0.794662 0.432367 0.568889 0.209 Uiso 1 1 calc GR . . . .
H38B H 0.864805 0.493635 0.519989 0.209 Uiso 1 1 calc GR . . . .
H38C H 0.926000 0.415101 0.577977 0.209 Uiso 1 1 calc GR . . . .
C27 C 0.8214(19) 0.0069(12) 0.4792(11) 0.209(7) Uani 1 1 d . U . . .
H27A H 0.877810 -0.020621 0.512199 0.314 Uiso 1 1 calc GR . . . .
H27B H 0.860033 0.028940 0.434220 0.314 Uiso 1 1 calc GR . . . .
H27C H 0.790308 -0.037639 0.472491 0.314 Uiso 1 1 calc GR . . . .
C25 C 0.788(2) 0.1198(16) 0.5476(11) 0.205(7) Uani 1 1 d . U . . .
H25A H 0.727708 0.167333 0.571350 0.308 Uiso 1 1 calc GR . . . .
H25B H 0.843045 0.144468 0.514890 0.308 Uiso 1 1 calc GR . . . .
H25C H 0.828870 0.072680 0.582371 0.308 Uiso 1 1 calc GR . . . .
C55 C 1.1363(17) 0.3475(17) 0.1517(13) 0.226(9) Uani 1 1 d . U . . .
H55A H 1.213309 0.354163 0.142403 0.339 Uiso 1 1 calc GR . . . .
H55B H 1.121725 0.331439 0.110283 0.339 Uiso 1 1 calc GR . . . .
H55C H 1.133576 0.300430 0.191563 0.339 Uiso 1 1 calc GR . . . .
C8 C 0.5325(8) 0.2193(7) 0.1017(5) 0.069(2) Uani 1 1 d . . . . .
H8 H 0.480386 0.261966 0.130097 0.083 Uiso 1 1 calc R . . . .
C10 C 0.7002(7) 0.1982(5) 0.1673(4) 0.0514(18) Uani 1 1 d . . . . .
H10 H 0.653570 0.240760 0.197199 0.062 Uiso 1 1 calc R . . . .
C9 C 0.4927(8) 0.1956(7) 0.0510(5) 0.079(3) Uani 1 1 d . . . . .
H9 H 0.413285 0.222307 0.044552 0.094 Uiso 1 1 calc R . . . .
C12 C 1.0422(7) 0.1216(6) 0.2740(4) 0.059(2) Uani 1 1 d . . . . .
C29 C 0.6923(9) 0.1484(7) 0.4374(6) 0.085(3) Uani 1 1 d . . . . .
C7 C 0.6522(7) 0.1794(6) 0.1111(4) 0.056(2) Uani 1 1 d . . . . .
C13 C 1.1699(8) 0.0612(8) 0.2735(6) 0.103(4) Uani 1 1 d . . . . .
H13A H 1.217351 0.080922 0.231460 0.155 Uiso 1 1 calc GR . . . .
H13B H 1.176175 -0.000687 0.273425 0.155 Uiso 1 1 calc GR . . . .
H13C H 1.197769 0.064638 0.315177 0.155 Uiso 1 1 calc GR . . . .
C6 C 0.6920(7) 0.0945(6) 0.0200(4) 0.060(2) Uani 1 1 d . . . . .
C5 C 0.5713(8) 0.1307(8) 0.0079(5) 0.073(3) Uani 1 1 d . . . . .
C18 C 1.0472(8) -0.1725(7) 0.1830(5) 0.073(2) Uani 1 1 d . . . . .
C43 C 0.5618(11) 0.5826(8) 0.3710(8) 0.106(4) Uani 1 1 d . . . . .
C4 C 0.5392(9) 0.0985(10) -0.0450(6) 0.098(4) Uani 1 1 d . . . . .
H4 H 0.461302 0.122281 -0.054695 0.117 Uiso 1 1 calc R . . . .
C51 C 0.7246(8) 0.4408(7) 0.1547(5) 0.071(2) Uani 1 1 d . . . . .
C32 C 0.4038(7) 0.2639(7) 0.3573(6) 0.077(2) Uani 1 1 d . U . . .
C3 C 0.6204(10) 0.0338(10) -0.0814(6) 0.099(4) Uani 1 1 d . . . . .
H3A H 0.597537 0.012161 -0.114985 0.119 Uiso 1 1 calc R . . . .
C2 C 0.7401(9) -0.0019(9) -0.0692(5) 0.087(3) Uani 1 1 d . . . . .
H2 H 0.794381 -0.046489 -0.095138 0.105 Uiso 1 1 calc R . . . .
C40 C 0.8318(7) 0.3834(7) 0.4377(5) 0.070(2) Uani 1 1 d . . . . .
C1 C 0.7784(8) 0.0277(7) -0.0201(4) 0.068(2) Uani 1 1 d . . . . .
C33 C 0.3373(13) 0.2093(13) 0.4109(11) 0.188(6) Uani 1 1 d . U . . .
H33A H 0.329157 0.224223 0.457581 0.283 Uiso 1 1 calc GR . . . .
H33B H 0.380539 0.145382 0.410904 0.283 Uiso 1 1 calc GR . . . .
H33C H 0.259971 0.223418 0.398336 0.283 Uiso 1 1 calc GR . . . .
C50 C 0.6313(10) 0.4901(8) 0.1039(6) 0.093(4) Uani 1 1 d . . . . .
C57 C 1.0543(19) 0.4670(14) 0.2319(13) 0.203(9) Uani 1 1 d . U . . .
H57A H 1.051473 0.420353 0.272122 0.305 Uiso 1 1 calc GR . . . .
H57B H 0.991650 0.522905 0.241072 0.305 Uiso 1 1 calc GR . . . .
H57C H 1.129667 0.476111 0.224146 0.305 Uiso 1 1 calc GR . . . .
C20 C 0.8333(9) -0.1020(6) 0.2227(6) 0.075(3) Uani 1 1 d . . . . .
C31 C 0.5347(7) 0.2378(6) 0.3652(4) 0.057(2) Uani 1 1 d . . . . .
C45 C 0.6054(18) 0.6307(10) 0.2971(11) 0.189(9) Uani 1 1 d . . . . .
H45A H 0.605135 0.599252 0.260108 0.283 Uiso 1 1 calc GR . . . .
H45B H 0.684694 0.629761 0.296434 0.283 Uiso 1 1 calc GR . . . .
H45C H 0.553378 0.692771 0.289271 0.283 Uiso 1 1 calc GR . . . .
C19 C 0.9436(9) -0.1678(7) 0.2320(6) 0.082(3) Uani 1 1 d . . . . .
H19 H 0.948783 -0.211004 0.273032 0.098 Uiso 1 1 calc R . . . .
C56 C 1.0370(18) 0.5180(15) 0.1081(12) 0.224(10) Uani 1 1 d . U . . .
H56A H 1.113585 0.525518 0.096892 0.336 Uiso 1 1 calc GR . . . .
H56B H 0.977938 0.573080 0.122214 0.336 Uiso 1 1 calc GR . . . .
H56C H 1.018112 0.504863 0.066850 0.336 Uiso 1 1 calc GR . . . .
C15 C 1.2438(16) -0.2085(15) 0.2112(13) 0.205(9) Uani 1 1 d . U . . .
H15A H 1.211927 -0.185017 0.255647 0.307 Uiso 1 1 calc GR . . . .
H15B H 1.251041 -0.159723 0.173718 0.307 Uiso 1 1 calc GR . . . .
H15C H 1.320734 -0.254029 0.214871 0.307 Uiso 1 1 calc GR . . . .
C41 C 0.7361(8) 0.4645(7) 0.4310(6) 0.082(3) Uani 1 1 d . . . . .
H41 H 0.722983 0.506090 0.461537 0.098 Uiso 1 1 calc R . . . .
C30 C 0.5756(9) 0.1747(8) 0.4240(6) 0.092(4) Uani 1 1 d . . . . .
H30 H 0.523339 0.149103 0.455458 0.110 Uiso 1 1 calc R . . . .
C42 C 0.6578(8) 0.4872(6) 0.3804(6) 0.072(3) Uani 1 1 d . . . . .
C47 C 0.5133(10) 0.4821(10) 0.1392(8) 0.131(5) Uani 1 1 d . U . . .
H47A H 0.486881 0.511659 0.180973 0.196 Uiso 1 1 calc GR . . . .
H47B H 0.521008 0.418798 0.152789 0.196 Uiso 1 1 calc GR . . . .
H47C H 0.456505 0.510600 0.106580 0.196 Uiso 1 1 calc GR . . . .
C53 C 0.9173(9) 0.4213(8) 0.1867(6) 0.099(4) Uani 1 1 d . . . . .
C58 C 0.956(2) 0.2604(13) 0.0563(11) 0.196(8) Uani 1 1 d D U . . .
H58A H 0.976932 0.301040 0.015614 0.294 Uiso 1 1 calc GR . . . .
H58B H 1.009658 0.246545 0.090209 0.294 Uiso 1 1 calc GR . . . .
H58C H 0.876264 0.288865 0.078025 0.294 Uiso 1 1 calc GR . . . .
O12 O 0.9649(8) 0.1791(5) 0.0342(4) 0.106(3) Uani 1 1 d D U . . .
H12 H 0.986(13) 0.186(5) -0.0110(13) 0.159 Uiso 1 1 d DR . . . .
O0AA O 1.1269(18) 0.1959(11) -0.0797(8) 0.226(7) Uani 1 1 d . U . . .
C0AA C 1.211(3) 0.240(2) -0.0981(18) 0.263(13) Uani 1 1 d . U . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Dy1 O11 2.323(5) . ?
Dy1 O7 2.322(5) . ?
Dy1 O9 2.305(5) . ?
Dy1 O8 2.395(5) . ?
Dy1 O10 2.344(5) . ?
Dy1 O6 2.315(5) . ?
Dy1 N4 2.549(6) . ?
Dy1 N3 2.590(6) . ?
Dy2 Dy2 3.8639(7) 2_755 ?
Dy2 O4 2.294(6) . ?
Dy2 O2 2.320(5) . ?
Dy2 O5 2.307(6) . ?
Dy2 O1 2.362(5) . ?
Dy2 O1 2.385(5) 2_755 ?
Dy2 N2 2.536(6) . ?
Dy2 N1 2.477(6) . ?
Dy2 O12 2.463(8) . ?
O4 C18 1.264(11) . ?
O2 C11 1.266(8) . ?
O11 C53 1.228(10) . ?
O7 C31 1.241(9) . ?
O3 H3 0.8200 . ?
O3 N4 1.382(8) . ?
O9 C42 1.235(11) . ?
O5 C20 1.249(11) . ?
O1 C1 1.346(10) . ?
O8 C40 1.276(10) . ?
O10 C51 1.241(10) . ?
O6 C29 1.252(10) . ?
N2 N3 1.394(8) . ?
N2 C10 1.281(9) . ?
N1 C7 1.325(10) . ?
N1 C6 1.357(10) . ?
N4 C12 1.260(10) . ?
N3 C11 1.338(9) . ?
C11 C12 1.486(10) . ?
C52 H52 0.9300 . ?
C52 C51 1.372(14) . ?
C52 C53 1.396(14) . ?
C28 C26 1.464(19) . ?
C28 C27 1.40(2) . ?
C28 C25 1.54(2) . ?
C28 C29 1.566(15) . ?
C17 C16 1.478(17) . ?
C17 C14 1.53(2) . ?
C17 C18 1.529(14) . ?
C17 C15 1.46(2) . ?
C46 H46A 0.9600 . ?
C46 H46B 0.9600 . ?
C46 H46C 0.9600 . ?
C46 C43 1.500(17) . ?
C21 C24 1.470(18) . ?
C21 C22 1.57(2) . ?
C21 C23 1.43(2) . ?
C21 C20 1.542(15) . ?
C16 H16A 0.9600 . ?
C16 H16B 0.9600 . ?
C16 H16C 0.9600 . ?
C34 H34A 0.9600 . ?
C34 H34B 0.9600 . ?
C34 H34C 0.9600 . ?
C34 C32 1.422(16) . ?
C54 C55 1.56(3) . ?
C54 C57 1.45(2) . ?
C54 C56 1.52(2) . ?
C54 C53 1.574(17) . ?
C37 H37A 0.9600 . ?
C37 H37B 0.9600 . ?
C37 H37C 0.9600 . ?
C37 C39 1.54(2) . ?
C49 H49A 0.9600 . ?
C49 H49B 0.9600 . ?
C49 H49C 0.9600 . ?
C49 C50 1.460(18) . ?
C24 H24A 0.9600 . ?
C24 H24B 0.9600 . ?
C24 H24C 0.9600 . ?
C35 H35A 0.9600 . ?
C35 H35B 0.9600 . ?
C35 H35C 0.9600 . ?
C35 C32 1.435(17) . ?
C48 H48A 0.9600 . ?
C48 H48B 0.9600 . ?
C48 H48C 0.9600 . ?
C48 C50 1.48(2) . ?
C44 H44A 0.9600 . ?
C44 H44B 0.9600 . ?
C44 H44C 0.9600 . ?
C44 C43 1.528(19) . ?
C22 H22A 0.9600 . ?
C22 H22B 0.9600 . ?
C22 H22C 0.9600 . ?
C36 H36A 0.9600 . ?
C36 H36B 0.9600 . ?
C36 H36C 0.9600 . ?
C36 C39 1.494(19) . ?
C23 H23A 0.9600 . ?
C23 H23B 0.9600 . ?
C23 H23C 0.9600 . ?
C14 H14A 0.9600 . ?
C14 H14B 0.9600 . ?
C14 H14C 0.9600 . ?
C26 H26A 0.9600 . ?
C26 H26B 0.9600 . ?
C26 H26C 0.9600 . ?
C39 C38 1.454(14) . ?
C39 C40 1.545(13) . ?
C38 H38A 0.9600 . ?
C38 H38B 0.9600 . ?
C38 H38C 0.9600 . ?
C27 H27A 0.9600 . ?
C27 H27B 0.9600 . ?
C27 H27C 0.9600 . ?
C25 H25A 0.9600 . ?
C25 H25B 0.9600 . ?
C25 H25C 0.9600 . ?
C55 H55A 0.9600 . ?
C55 H55B 0.9600 . ?
C55 H55C 0.9600 . ?
C8 H8 0.9300 . ?
C8 C9 1.356(12) . ?
C8 C7 1.400(11) . ?
C10 H10 0.9300 . ?
C10 C7 1.470(10) . ?
C9 H9 0.9300 . ?
C9 C5 1.411(13) . ?
C12 C13 1.503(10) . ?
C29 C30 1.396(13) . ?
C13 H13A 0.9600 . ?
C13 H13B 0.9600 . ?
C13 H13C 0.9600 . ?
C6 C5 1.424(11) . ?
C6 C1 1.427(12) . ?
C5 C4 1.418(13) . ?
C18 C19 1.401(13) . ?
C43 C45 1.56(2) . ?
C43 C42 1.544(13) . ?
C4 H4 0.9300 . ?
C4 C3 1.345(15) . ?
C51 C50 1.541(11) . ?
C32 C33 1.506(16) . ?
C32 C31 1.531(11) . ?
C3 H3A 0.9300 . ?
C3 C2 1.413(14) . ?
C2 H2 0.9300 . ?
C2 C1 1.374(12) . ?
C40 C41 1.394(12) . ?
C33 H33A 0.9600 . ?
C33 H33B 0.9600 . ?
C33 H33C 0.9600 . ?
C50 C47 1.497(16) . ?
C57 H57A 0.9600 . ?
C57 H57B 0.9600 . ?
C57 H57C 0.9600 . ?
C20 C19 1.392(13) . ?
C31 C30 1.394(12) . ?
C45 H45A 0.9600 . ?
C45 H45B 0.9600 . ?
C45 H45C 0.9600 . ?
C19 H19 0.9300 . ?
C56 H56A 0.9600 . ?
C56 H56B 0.9600 . ?
C56 H56C 0.9600 . ?
C15 H15A 0.9600 . ?
C15 H15B 0.9600 . ?
C15 H15C 0.9600 . ?
C41 H41 0.9300 . ?
C41 C42 1.414(13) . ?
C30 H30 0.9300 . ?
C47 H47A 0.9600 . ?
C47 H47B 0.9600 . ?
C47 H47C 0.9600 . ?
C58 H58A 0.9600 . ?
C58 H58B 0.9600 . ?
C58 H58C 0.9600 . ?
C58 O12 1.411(19) . ?
O12 H12 0.854(10) . ?
O0AA C0AA 1.40(3) . ?

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
_geom_angle_publ_flag
O11 Dy1 O8 78.9(2) . . ?
O11 Dy1 O10 71.18(19) . . ?
O11 Dy1 N4 70.5(2) . . ?
O11 Dy1 N3 88.2(2) . . ?
O7 Dy1 O11 148.32(18) . . ?
O7 Dy1 O8 126.27(18) . . ?
O7 Dy1 O10 77.17(18) . . ?
O7 Dy1 N4 132.4(2) . . ?
O7 Dy1 N3 86.98(19) . . ?
O9 Dy1 O11 90.2(2) . . ?
O9 Dy1 O7 82.0(2) . . ?
O9 Dy1 O8 71.34(18) . . ?
O9 Dy1 O10 78.6(2) . . ?
O9 Dy1 O6 110.2(2) . . ?
O9 Dy1 N4 139.0(2) . . ?
O9 Dy1 N3 156.39(18) . . ?
O8 Dy1 N4 69.62(18) . . ?
O8 Dy1 N3 131.17(17) . . ?
O10 Dy1 O8 137.02(19) . . ?
O10 Dy1 N4 124.51(19) . . ?
O10 Dy1 N3 78.66(18) . . ?
O6 Dy1 O11 139.33(18) . . ?
O6 Dy1 O7 71.42(18) . . ?
O6 Dy1 O8 75.3(2) . . ?
O6 Dy1 O10 145.51(19) . . ?
O6 Dy1 N4 71.30(19) . . ?
O6 Dy1 N3 85.7(2) . . ?
N4 Dy1 N3 61.69(18) . . ?
O4 Dy2 Dy2 81.75(16) . 2_755 ?
O4 Dy2 O2 80.0(2) . . ?
O4 Dy2 O5 71.6(2) . . ?
O4 Dy2 O1 92.6(2) . . ?
O4 Dy2 O1 73.9(2) . 2_755 ?
O4 Dy2 N2 128.2(2) . . ?
O4 Dy2 N1 138.0(2) . . ?
O4 Dy2 O12 138.5(3) . . ?
O2 Dy2 Dy2 132.72(13) . 2_755 ?
O2 Dy2 O1 97.52(18) . 2_755 ?
O2 Dy2 O1 167.86(18) . . ?
O2 Dy2 N2 62.45(17) . . ?
O2 Dy2 N1 125.14(19) . . ?
O2 Dy2 O12 83.1(3) . . ?
O5 Dy2 Dy2 119.00(14) . 2_755 ?
O5 Dy2 O2 95.6(2) . . ?
O5 Dy2 O1 140.1(2) . 2_755 ?
O5 Dy2 O1 91.0(2) . . ?
O5 Dy2 N2 77.69(19) . . ?
O5 Dy2 N1 72.8(2) . . ?
O5 Dy2 O12 148.2(2) . . ?
O1 Dy2 Dy2 35.72(13) . 2_755 ?
O1 Dy2 Dy2 35.32(12) 2_755 2_755 ?
O1 Dy2 O1 71.0(2) . 2_755 ?
O1 Dy2 N2 129.15(19) . . ?
O1 Dy2 N2 141.1(2) 2_755 . ?
O1 Dy2 N1 126.01(19) 2_755 . ?
O1 Dy2 N1 66.6(2) . . ?
O1 Dy2 O12 96.5(3) . . ?
O1 Dy2 O12 71.1(2) 2_755 . ?
N2 Dy2 Dy2 150.08(12) . 2_755 ?
N1 Dy2 Dy2 96.89(14) . 2_755 ?
N1 Dy2 N2 62.69(19) . . ?
O12 Dy2 Dy2 82.45(19) . 2_755 ?
O12 Dy2 N2 73.6(2) . . ?
O12 Dy2 N1 82.0(3) . . ?
C18 O4 Dy2 134.7(6) . . ?
C11 O2 Dy2 124.3(4) . . ?
C53 O11 Dy1 137.1(6) . . ?
C31 O7 Dy1 137.0(5) . . ?
N4 O3 H3 109.5 . . ?
C42 O9 Dy1 140.3(6) . . ?
C20 O5 Dy2 133.7(6) . . ?
Dy2 O1 Dy2 109.0(2) . 2_755 ?
C1 O1 Dy2 124.5(5) . 2_755 ?
C1 O1 Dy2 121.2(5) . . ?
C40 O8 Dy1 135.8(5) . . ?
C51 O10 Dy1 135.5(5) . . ?
C29 O6 Dy1 137.7(5) . . ?
N3 N2 Dy2 119.6(4) . . ?
C10 N2 Dy2 122.0(5) . . ?
C10 N2 N3 118.4(6) . . ?
C7 N1 Dy2 123.3(5) . . ?
C7 N1 C6 119.2(7) . . ?
C6 N1 Dy2 117.0(5) . . ?
O3 N4 Dy1 118.7(4) . . ?
C12 N4 Dy1 125.7(5) . . ?
C12 N4 O3 115.5(6) . . ?
N2 N3 Dy1 131.3(4) . . ?
C11 N3 Dy1 119.8(5) . . ?
C11 N3 N2 108.4(5) . . ?
O2 C11 N3 125.2(7) . . ?
O2 C11 C12 117.4(6) . . ?
N3 C11 C12 117.4(6) . . ?
C51 C52 H52 117.5 . . ?
C51 C52 C53 125.0(9) . . ?
C53 C52 H52 117.5 . . ?
C26 C28 C25 108.4(17) . . ?
C26 C28 C29 116.6(12) . . ?
C27 C28 C26 114.7(16) . . ?
C27 C28 C25 104.6(16) . . ?
C27 C28 C29 103.0(13) . . ?
C25 C28 C29 108.7(12) . . ?
C16 C17 C14 109.1(13) . . ?
C16 C17 C18 115.4(11) . . ?
C18 C17 C14 106.8(11) . . ?
C15 C17 C16 110.5(14) . . ?
C15 C17 C14 107.2(16) . . ?
C15 C17 C18 107.4(13) . . ?
H46A C46 H46B 109.5 . . ?
H46A C46 H46C 109.5 . . ?
H46B C46 H46C 109.5 . . ?
C43 C46 H46A 109.5 . . ?
C43 C46 H46B 109.5 . . ?
C43 C46 H46C 109.5 . . ?
C24 C21 C22 111.5(16) . . ?
C24 C21 C20 117.1(12) . . ?
C23 C21 C24 108.0(15) . . ?
C23 C21 C22 105.8(16) . . ?
C23 C21 C20 108.3(16) . . ?
C20 C21 C22 105.5(11) . . ?
C17 C16 H16A 109.5 . . ?
C17 C16 H16B 109.5 . . ?
C17 C16 H16C 109.5 . . ?
H16A C16 H16B 109.5 . . ?
H16A C16 H16C 109.5 . . ?
H16B C16 H16C 109.5 . . ?
H34A C34 H34B 109.5 . . ?
H34A C34 H34C 109.5 . . ?
H34B C34 H34C 109.5 . . ?
C32 C34 H34A 109.5 . . ?
C32 C34 H34B 109.5 . . ?
C32 C34 H34C 109.5 . . ?
C55 C54 C53 106.1(15) . . ?
C57 C54 C55 112.5(17) . . ?
C57 C54 C56 107.2(18) . . ?
C57 C54 C53 106.8(15) . . ?
C56 C54 C55 112.9(18) . . ?
C56 C54 C53 111.2(13) . . ?
H37A C37 H37B 109.5 . . ?
H37A C37 H37C 109.5 . . ?
H37B C37 H37C 109.5 . . ?
C39 C37 H37A 109.5 . . ?
C39 C37 H37B 109.5 . . ?
C39 C37 H37C 109.5 . . ?
H49A C49 H49B 109.5 . . ?
H49A C49 H49C 109.5 . . ?
H49B C49 H49C 109.5 . . ?
C50 C49 H49A 109.5 . . ?
C50 C49 H49B 109.5 . . ?
C50 C49 H49C 109.5 . . ?
C21 C24 H24A 109.5 . . ?
C21 C24 H24B 109.5 . . ?
C21 C24 H24C 109.5 . . ?
H24A C24 H24B 109.5 . . ?
H24A C24 H24C 109.5 . . ?
H24B C24 H24C 109.5 . . ?
H35A C35 H35B 109.5 . . ?
H35A C35 H35C 109.5 . . ?
H35B C35 H35C 109.5 . . ?
C32 C35 H35A 109.5 . . ?
C32 C35 H35B 109.5 . . ?
C32 C35 H35C 109.5 . . ?
H48A C48 H48B 109.5 . . ?
H48A C48 H48C 109.5 . . ?
H48B C48 H48C 109.5 . . ?
C50 C48 H48A 109.5 . . ?
C50 C48 H48B 109.5 . . ?
C50 C48 H48C 109.5 . . ?
H44A C44 H44B 109.5 . . ?
H44A C44 H44C 109.5 . . ?
H44B C44 H44C 109.5 . . ?
C43 C44 H44A 109.5 . . ?
C43 C44 H44B 109.5 . . ?
C43 C44 H44C 109.5 . . ?
C21 C22 H22A 109.5 . . ?
C21 C22 H22B 109.5 . . ?
C21 C22 H22C 109.5 . . ?
H22A C22 H22B 109.5 . . ?
H22A C22 H22C 109.5 . . ?
H22B C22 H22C 109.5 . . ?
H36A C36 H36B 109.5 . . ?
H36A C36 H36C 109.5 . . ?
H36B C36 H36C 109.5 . . ?
C39 C36 H36A 109.5 . . ?
C39 C36 H36B 109.5 . . ?
C39 C36 H36C 109.5 . . ?
C21 C23 H23A 109.5 . . ?
C21 C23 H23B 109.5 . . ?
C21 C23 H23C 109.5 . . ?
H23A C23 H23B 109.5 . . ?
H23A C23 H23C 109.5 . . ?
H23B C23 H23C 109.5 . . ?
C17 C14 H14A 109.5 . . ?
C17 C14 H14B 109.5 . . ?
C17 C14 H14C 109.5 . . ?
H14A C14 H14B 109.5 . . ?
H14A C14 H14C 109.5 . . ?
H14B C14 H14C 109.5 . . ?
C28 C26 H26A 109.5 . . ?
C28 C26 H26B 109.5 . . ?
C28 C26 H26C 109.5 . . ?
H26A C26 H26B 109.5 . . ?
H26A C26 H26C 109.5 . . ?
H26B C26 H26C 109.5 . . ?
C37 C39 C40 104.7(10) . . ?
C36 C39 C37 107.6(13) . . ?
C36 C39 C40 107.6(11) . . ?
C38 C39 C37 107.3(13) . . ?
C38 C39 C36 112.2(12) . . ?
C38 C39 C40 116.8(10) . . ?
C39 C38 H38A 109.5 . . ?
C39 C38 H38B 109.5 . . ?
C39 C38 H38C 109.5 . . ?
H38A C38 H38B 109.5 . . ?
H38A C38 H38C 109.5 . . ?
H38B C38 H38C 109.5 . . ?
C28 C27 H27A 109.5 . . ?
C28 C27 H27B 109.5 . . ?
C28 C27 H27C 109.5 . . ?
H27A C27 H27B 109.5 . . ?
H27A C27 H27C 109.5 . . ?
H27B C27 H27C 109.5 . . ?
C28 C25 H25A 109.5 . . ?
C28 C25 H25B 109.5 . . ?
C28 C25 H25C 109.5 . . ?
H25A C25 H25B 109.5 . . ?
H25A C25 H25C 109.5 . . ?
H25B C25 H25C 109.5 . . ?
C54 C55 H55A 109.5 . . ?
C54 C55 H55B 109.5 . . ?
C54 C55 H55C 109.5 . . ?
H55A C55 H55B 109.5 . . ?
H55A C55 H55C 109.5 . . ?
H55B C55 H55C 109.5 . . ?
C9 C8 H8 120.1 . . ?
C9 C8 C7 119.8(8) . . ?
C7 C8 H8 120.1 . . ?
N2 C10 H10 121.7 . . ?
N2 C10 C7 116.7(7) . . ?
C7 C10 H10 121.7 . . ?
C8 C9 H9 119.8 . . ?
C8 C9 C5 120.3(8) . . ?
C5 C9 H9 119.8 . . ?
N4 C12 C11 115.0(6) . . ?
N4 C12 C13 125.4(7) . . ?
C11 C12 C13 119.6(7) . . ?
O6 C29 C28 117.0(9) . . ?
O6 C29 C30 124.4(9) . . ?
C30 C29 C28 118.6(9) . . ?
N1 C7 C8 122.1(7) . . ?
N1 C7 C10 115.1(6) . . ?
C8 C7 C10 122.8(7) . . ?
C12 C13 H13A 109.5 . . ?
C12 C13 H13B 109.5 . . ?
C12 C13 H13C 109.5 . . ?
H13A C13 H13B 109.5 . . ?
H13A C13 H13C 109.5 . . ?
H13B C13 H13C 109.5 . . ?
N1 C6 C5 122.2(8) . . ?
N1 C6 C1 116.9(7) . . ?
C5 C6 C1 120.9(7) . . ?
C9 C5 C6 116.3(8) . . ?
C9 C5 C4 125.3(9) . . ?
C4 C5 C6 118.3(9) . . ?
O4 C18 C17 116.3(9) . . ?
O4 C18 C19 123.0(9) . . ?
C19 C18 C17 120.7(10) . . ?
C46 C43 C44 111.9(13) . . ?
C46 C43 C45 106.9(14) . . ?
C46 C43 C42 108.8(10) . . ?
C44 C43 C45 110.4(14) . . ?
C44 C43 C42 113.8(11) . . ?
C42 C43 C45 104.6(11) . . ?
C5 C4 H4 119.7 . . ?
C3 C4 C5 120.5(10) . . ?
C3 C4 H4 119.7 . . ?
O10 C51 C52 123.4(8) . . ?
O10 C51 C50 116.3(8) . . ?
C52 C51 C50 120.2(9) . . ?
C34 C32 C35 108.9(13) . . ?
C34 C32 C33 111.7(12) . . ?
C34 C32 C31 109.7(9) . . ?
C35 C32 C33 102.5(14) . . ?
C35 C32 C31 109.1(9) . . ?
C33 C32 C31 114.5(10) . . ?
C4 C3 H3A 119.5 . . ?
C4 C3 C2 121.0(9) . . ?
C2 C3 H3A 119.5 . . ?
C3 C2 H2 119.1 . . ?
C1 C2 C3 121.8(10) . . ?
C1 C2 H2 119.1 . . ?
O8 C40 C39 117.5(8) . . ?
O8 C40 C41 124.1(8) . . ?
C41 C40 C39 118.1(9) . . ?
O1 C1 C6 117.3(7) . . ?
O1 C1 C2 125.2(9) . . ?
C2 C1 C6 117.5(8) . . ?
C32 C33 H33A 109.5 . . ?
C32 C33 H33B 109.5 . . ?
C32 C33 H33C 109.5 . . ?
H33A C33 H33B 109.5 . . ?
H33A C33 H33C 109.5 . . ?
H33B C33 H33C 109.5 . . ?
C49 C50 C48 110.3(13) . . ?
C49 C50 C51 114.3(11) . . ?
C49 C50 C47 109.3(12) . . ?
C48 C50 C51 107.1(10) . . ?
C48 C50 C47 105.4(13) . . ?
C47 C50 C51 109.9(9) . . ?
C54 C57 H57A 109.5 . . ?
C54 C57 H57B 109.5 . . ?
C54 C57 H57C 109.5 . . ?
H57A C57 H57B 109.5 . . ?
H57A C57 H57C 109.5 . . ?
H57B C57 H57C 109.5 . . ?
O5 C20 C21 116.3(9) . . ?
O5 C20 C19 123.8(9) . . ?
C19 C20 C21 119.9(10) . . ?
O7 C31 C32 116.8(7) . . ?
O7 C31 C30 125.2(7) . . ?
C30 C31 C32 117.9(8) . . ?
C43 C45 H45A 109.5 . . ?
C43 C45 H45B 109.5 . . ?
C43 C45 H45C 109.5 . . ?
H45A C45 H45B 109.5 . . ?
H45A C45 H45C 109.5 . . ?
H45B C45 H45C 109.5 . . ?
C18 C19 H19 118.2 . . ?
C20 C19 C18 123.5(9) . . ?
C20 C19 H19 118.2 . . ?
C54 C56 H56A 109.5 . . ?
C54 C56 H56B 109.5 . . ?
C54 C56 H56C 109.5 . . ?
H56A C56 H56B 109.5 . . ?
H56A C56 H56C 109.5 . . ?
H56B C56 H56C 109.5 . . ?
C17 C15 H15A 109.5 . . ?
C17 C15 H15B 109.5 . . ?
C17 C15 H15C 109.5 . . ?
H15A C15 H15B 109.5 . . ?
H15A C15 H15C 109.5 . . ?
H15B C15 H15C 109.5 . . ?
C40 C41 H41 118.1 . . ?
C40 C41 C42 123.8(9) . . ?
C42 C41 H41 118.1 . . ?
C29 C30 H30 118.8 . . ?
C31 C30 C29 122.4(9) . . ?
C31 C30 H30 118.8 . . ?
O9 C42 C43 115.4(9) . . ?
O9 C42 C41 124.0(8) . . ?
C41 C42 C43 120.6(10) . . ?
C50 C47 H47A 109.5 . . ?
C50 C47 H47B 109.5 . . ?
C50 C47 H47C 109.5 . . ?
H47A C47 H47B 109.5 . . ?
H47A C47 H47C 109.5 . . ?
H47B C47 H47C 109.5 . . ?
O11 C53 C52 123.6(9) . . ?
O11 C53 C54 112.0(9) . . ?
C52 C53 C54 124.2(10) . . ?
H58A C58 H58B 109.5 . . ?
H58A C58 H58C 109.5 . . ?
H58B C58 H58C 109.5 . . ?
O12 C58 H58A 109.5 . . ?
O12 C58 H58B 109.5 . . ?
O12 C58 H58C 109.5 . . ?
Dy2 O12 H12 119(3) . . ?
C58 O12 Dy2 135.5(10) . . ?
C58 O12 H12 106(3) . . ?

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
_geom_torsion_publ_flag
Dy1 O11 C53 C52 -10(2) . . . . ?
Dy1 O11 C53 C54 174.4(10) . . . . ?
Dy1 O7 C31 C32 165.8(6) . . . . ?
Dy1 O7 C31 C30 -11.8(15) . . . . ?
Dy1 O9 C42 C43 170.2(8) . . . . ?
Dy1 O9 C42 C41 -8.6(17) . . . . ?
Dy1 O8 C40 C39 177.5(8) . . . . ?
Dy1 O8 C40 C41 -8.7(16) . . . . ?
Dy1 O10 C51 C52 20.2(17) . . . . ?
Dy1 O10 C51 C50 -163.3(7) . . . . ?
Dy1 O6 C29 C28 -167.0(8) . . . . ?
Dy1 O6 C29 C30 10(2) . . . . ?
Dy1 N4 C12 C11 -4.6(11) . . . . ?
Dy1 N4 C12 C13 173.5(8) . . . . ?
Dy1 N3 C11 O2 -174.7(6) . . . . ?
Dy1 N3 C11 C12 5.9(9) . . . . ?
Dy2 O4 C18 C17 -157.4(9) . . . . ?
Dy2 O4 C18 C19 21.2(16) . . . . ?
Dy2 O2 C11 N3 4.4(12) . . . . ?
Dy2 O2 C11 C12 -176.2(5) . . . . ?
Dy2 O5 C20 C21 153.3(10) . . . . ?
Dy2 O5 C20 C19 -25.2(15) . . . . ?
Dy2 O1 C1 C6 -140.9(6) 2_755 . . . ?
Dy2 O1 C1 C6 10.2(11) . . . . ?
Dy2 O1 C1 C2 40.2(13) 2_755 . . . ?
Dy2 O1 C1 C2 -168.7(8) . . . . ?
Dy2 N2 N3 Dy1 170.6(3) . . . . ?
Dy2 N2 N3 C11 -1.2(7) . . . . ?
Dy2 N2 C10 C7 -1.5(9) . . . . ?
Dy2 N1 C7 C8 -172.9(7) . . . . ?
Dy2 N1 C7 C10 5.0(10) . . . . ?
Dy2 N1 C6 C5 172.3(7) . . . . ?
Dy2 N1 C6 C1 -5.9(10) . . . . ?
O4 C18 C19 C20 4.1(17) . . . . ?
O2 C11 C12 N4 179.4(8) . . . . ?
O2 C11 C12 C13 1.3(13) . . . . ?
O7 C31 C30 C29 -0.3(18) . . . . ?
O3 N4 C12 C11 179.5(7) . . . . ?
O3 N4 C12 C13 -2.4(14) . . . . ?
O5 C20 C19 C18 -2.0(18) . . . . ?
O8 C40 C41 C42 2.9(17) . . . . ?
O10 C51 C50 C49 150.0(13) . . . . ?
O10 C51 C50 C48 -87.4(14) . . . . ?
O10 C51 C50 C47 26.6(16) . . . . ?
O6 C29 C30 C31 1(2) . . . . ?
N2 N3 C11 O2 -1.8(11) . . . . ?
N2 N3 C11 C12 178.8(7) . . . . ?
N2 C10 C7 N1 -2.2(11) . . . . ?
N2 C10 C7 C8 175.7(8) . . . . ?
N1 C6 C5 C9 1.2(14) . . . . ?
N1 C6 C5 C4 -178.0(9) . . . . ?
N1 C6 C1 O1 -2.4(13) . . . . ?
N1 C6 C1 C2 176.6(9) . . . . ?
N3 N2 C10 C7 179.1(6) . . . . ?
N3 C11 C12 N4 -1.1(12) . . . . ?
N3 C11 C12 C13 -179.3(9) . . . . ?
C52 C51 C50 C49 -33.4(19) . . . . ?
C52 C51 C50 C48 89.2(17) . . . . ?
C52 C51 C50 C47 -156.8(13) . . . . ?
C28 C29 C30 C31 178.0(12) . . . . ?
C17 C18 C19 C20 -177.3(12) . . . . ?
C46 C43 C42 O9 44.0(16) . . . . ?
C46 C43 C42 C41 -137.1(13) . . . . ?
C21 C20 C19 C18 179.5(12) . . . . ?
C16 C17 C18 O4 -168.4(12) . . . . ?
C16 C17 C18 C19 12.9(19) . . . . ?
C34 C32 C31 O7 -57.8(13) . . . . ?
C34 C32 C31 C30 120.0(13) . . . . ?
C37 C39 C40 O8 -53.7(14) . . . . ?
C37 C39 C40 C41 132.2(11) . . . . ?
C24 C21 C20 O5 178.6(15) . . . . ?
C24 C21 C20 C19 -3(2) . . . . ?
C35 C32 C31 O7 61.5(15) . . . . ?
C35 C32 C31 C30 -120.8(14) . . . . ?
C44 C43 C42 O9 169.6(14) . . . . ?
C44 C43 C42 C41 -11.5(19) . . . . ?
C22 C21 C20 O5 -56.7(18) . . . . ?
C22 C21 C20 C19 121.9(14) . . . . ?
C36 C39 C40 O8 60.6(16) . . . . ?
C36 C39 C40 C41 -113.5(13) . . . . ?
C23 C21 C20 O5 56.2(17) . . . . ?
C23 C21 C20 C19 -125.2(15) . . . . ?
C14 C17 C18 O4 -46.9(17) . . . . ?
C14 C17 C18 C19 134.4(14) . . . . ?
C26 C28 C29 O6 171.4(16) . . . . ?
C26 C28 C29 C30 -5(2) . . . . ?
C39 C40 C41 C42 176.6(11) . . . . ?
C38 C39 C40 O8 -172.2(12) . . . . ?
C38 C39 C40 C41 13.7(19) . . . . ?
C27 C28 C29 O6 -61.9(18) . . . . ?
C27 C28 C29 C30 121.2(16) . . . . ?
C25 C28 C29 O6 48.6(18) . . . . ?
C25 C28 C29 C30 -128.2(15) . . . . ?
C55 C54 C53 O11 59.8(19) . . . . ?
C55 C54 C53 C52 -116.2(18) . . . . ?
C8 C9 C5 C6 -1.3(15) . . . . ?
C8 C9 C5 C4 177.8(11) . . . . ?
C10 N2 N3 Dy1 -10.0(9) . . . . ?
C10 N2 N3 C11 178.2(7) . . . . ?
C9 C8 C7 N1 1.0(15) . . . . ?
C9 C8 C7 C10 -176.7(9) . . . . ?
C9 C5 C4 C3 -177.5(12) . . . . ?
C7 N1 C6 C5 0.0(13) . . . . ?
C7 N1 C6 C1 -178.1(8) . . . . ?
C7 C8 C9 C5 0.3(16) . . . . ?
C6 N1 C7 C8 -1.2(13) . . . . ?
C6 N1 C7 C10 176.8(7) . . . . ?
C6 C5 C4 C3 1.6(18) . . . . ?
C5 C6 C1 O1 179.4(8) . . . . ?
C5 C6 C1 C2 -1.6(14) . . . . ?
C5 C4 C3 C2 -2(2) . . . . ?
C4 C3 C2 C1 0(2) . . . . ?
C51 C52 C53 O11 -5(3) . . . . ?
C51 C52 C53 C54 170.3(16) . . . . ?
C32 C31 C30 C29 -177.9(11) . . . . ?
C3 C2 C1 O1 -179.6(10) . . . . ?
C3 C2 C1 C6 1.6(16) . . . . ?
C40 C41 C42 O9 5.2(17) . . . . ?
C40 C41 C42 C43 -173.6(11) . . . . ?
C1 C6 C5 C9 179.3(9) . . . . ?
C1 C6 C5 C4 0.1(15) . . . . ?
C33 C32 C31 O7 175.7(12) . . . . ?
C33 C32 C31 C30 -6.5(16) . . . . ?
C57 C54 C53 O11 -60.4(19) . . . . ?
C57 C54 C53 C52 123.5(18) . . . . ?
C45 C43 C42 O9 -69.9(14) . . . . ?
C45 C43 C42 C41 109.0(14) . . . . ?
C56 C54 C53 O11 -177.1(17) . . . . ?
C56 C54 C53 C52 7(3) . . . . ?
C15 C17 C18 O4 67.8(16) . . . . ?
C15 C17 C18 C19 -110.9(15) . . . . ?
C53 C52 C51 O10 0(2) . . . . ?
C53 C52 C51 C50 -176.4(14) . . . . ?

_olex2_submission_special_instructions 'No special instructions were received'
####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_shelxl
_database_code_depnum_ccdc_archive 'CCDC 1824968'
_audit_update_record             
;
2018-02-21 deposited with the CCDC.
2018-05-03 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C119.63 H93.63 Cl0.73 Dy4 N9.63 O20'
_chemical_formula_weight         2661.93

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'
Cl Cl 0.1484 0.1585 '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'

_symmetry_cell_setting           Triclinic
_symmetry_space_group_name_H-M   P-1

loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   12.668(3)
_cell_length_b                   14.063(3)
_cell_length_c                   16.523(3)
_cell_angle_alpha                82.26(3)
_cell_angle_beta                 69.22(3)
_cell_angle_gamma                70.85(3)
_cell_volume                     2599.4(9)
_cell_formula_units_Z            1
_cell_measurement_temperature    113(2)
_cell_measurement_reflns_used    6684
_cell_measurement_theta_min      1.5332
_cell_measurement_theta_max      27.9464

_exptl_crystal_description       block
_exptl_crystal_colour            red
_exptl_crystal_size_max          0.20
_exptl_crystal_size_mid          0.18
_exptl_crystal_size_min          0.12
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.700
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1315
_exptl_absorpt_coefficient_mu    2.938
_exptl_absorpt_correction_type   MULTI-SCAN
_exptl_absorpt_correction_T_min  0.5911
_exptl_absorpt_correction_T_max  0.7194
_exptl_absorpt_process_details   crystalclear

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      113(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'rotating anode'
_diffrn_radiation_monochromator  multilayer
_diffrn_measurement_device_type  'rigaku saturn'
_diffrn_measurement_method       'ω scans'
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         0
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  0
_diffrn_standards_decay_%        0
_diffrn_reflns_number            24018
_diffrn_reflns_av_R_equivalents  0.0541
_diffrn_reflns_av_sigmaI/netI    0.0659
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_theta_min         1.80
_diffrn_reflns_theta_max         25.01
_reflns_number_total             9118
_reflns_number_gt                7843
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       crystalclear
_computing_cell_refinement       crystalclear
_computing_data_reduction        crystalclear
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'

_refine_special_details          
; 
 Refinement of F² against ALL reflections.  The weighted R-factor wR and 
 goodness of fit S are based on F², conventional R-factors R are based 
 on F, with F set to zero for negative F². The threshold expression of 
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement.  R-factors based 
 on F² are statistically about twice as large as those based on F, and R- 
 factors based on ALL data will be even larger. 
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0898P)²+5.4794P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     SHELXL
_refine_ls_extinction_coef       0.0072(4)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_number_reflns         9118
_refine_ls_number_parameters     714
_refine_ls_number_restraints     41
_refine_ls_R_factor_all          0.0597
_refine_ls_R_factor_gt           0.0496
_refine_ls_wR_factor_ref         0.1537
_refine_ls_wR_factor_gt          0.1404
_refine_ls_goodness_of_fit_ref   1.103
_refine_ls_restrained_S_all      1.101
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000

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
Dy1 Dy 0.48872(3) 0.87463(2) 0.47903(2) 0.01272(15) Uani 1 1 d . . .
Dy2 Dy 0.45998(3) 1.09338(2) 0.31210(2) 0.01418(15) Uani 1 1 d . . .
O1 O 0.6006(4) 0.7954(4) 0.5763(3) 0.0160(11) Uani 1 1 d . . .
O2 O 0.3520(4) 1.0101(3) 0.4296(3) 0.0166(11) Uani 1 1 d . . .
O3 O 0.1758(5) 1.2166(5) 0.2965(4) 0.0328(14) Uani 1 1 d . . .
H3 H 0.2243 1.2430 0.2600 0.049 Uiso 1 1 calc R . .
O4 O 0.4650(4) 0.8242(4) 0.3618(3) 0.0207(11) Uani 1 1 d . . .
O5 O 0.6674(4) 0.7637(4) 0.4003(3) 0.0178(11) Uani 1 1 d . . .
O6 O 0.4131(5) 1.0195(4) 0.2199(3) 0.0224(12) Uani 1 1 d . . .
O7 O 0.6284(4) 0.9738(4) 0.2356(3) 0.0189(11) Uani 1 1 d . . .
O8 O 0.4019(4) 1.2271(4) 0.2220(3) 0.0188(11) Uani 1 1 d . . .
O9 O 0.6068(4) 1.1741(4) 0.2627(3) 0.0179(11) Uani 1 1 d . . .
O10 O 0.5680(4) 1.0089(4) 0.4116(3) 0.0150(10) Uani 1 1 d . . .
H10 H 0.6556 0.9851 0.3819 0.018 Uiso 1 1 calc R . .
N1 N 0.4408(5) 0.7247(4) 0.5593(4) 0.0165(13) Uani 1 1 d . . .
N2 N 0.2808(5) 0.8626(5) 0.5114(4) 0.0171(13) Uani 1 1 d . . .
N3 N 0.2024(5) 0.9337(5) 0.4766(4) 0.0197(14) Uani 1 1 d . . .
N4 N 0.2336(5) 1.1439(5) 0.3451(4) 0.0206(14) Uani 1 1 d . . .
C1 C 0.5268(7) 0.6577(5) 0.5857(5) 0.0169(15) Uani 1 1 d . . .
C2 C 0.6161(7) 0.6964(6) 0.5913(5) 0.0195(16) Uani 1 1 d . . .
C3 C 0.7083(7) 0.6296(5) 0.6132(5) 0.0193(16) Uani 1 1 d . . .
H3A H 0.7698 0.6523 0.6158 0.023 Uiso 1 1 calc R . .
C4 C 0.7136(8) 0.5276(6) 0.6320(5) 0.0271(18) Uani 1 1 d . . .
H4 H 0.7796 0.4828 0.6460 0.032 Uiso 1 1 calc R . .
C5 C 0.6265(8) 0.4915(6) 0.6306(5) 0.0264(18) Uani 1 1 d . . .
H5 H 0.6311 0.4229 0.6449 0.032 Uiso 1 1 calc R . .
C6 C 0.5300(7) 0.5566(6) 0.6080(5) 0.0199(16) Uani 1 1 d . . .
C7 C 0.4333(7) 0.5292(6) 0.6045(5) 0.0247(18) Uani 1 1 d . . .
H7 H 0.4315 0.4617 0.6174 0.030 Uiso 1 1 calc R . .
C8 C 0.3426(7) 0.5992(6) 0.5827(5) 0.0229(17) Uani 1 1 d . . .
H8 H 0.2760 0.5818 0.5831 0.027 Uiso 1 1 calc R . .
C9 C 0.3500(7) 0.6976(6) 0.5596(5) 0.0210(16) Uani 1 1 d . . .
C10 C 0.2617(6) 0.7761(6) 0.5308(5) 0.0193(16) Uani 1 1 d . . .
H10A H 0.1941 0.7644 0.5265 0.023 Uiso 1 1 calc R . .
C11 C 0.2488(6) 1.0044(5) 0.4360(4) 0.0155(15) Uani 1 1 d . . .
C12 C 0.1783(6) 1.0833(5) 0.3903(5) 0.0180(16) Uani 1 1 d . . .
C13 C 0.0588(7) 1.0829(7) 0.3935(6) 0.034(2) Uani 1 1 d . . .
H13A H 0.0249 1.1418 0.3615 0.051 Uiso 1 1 calc R . .
H13B H 0.0066 1.0852 0.4538 0.051 Uiso 1 1 calc R . .
H13C H 0.0667 1.0214 0.3671 0.051 Uiso 1 1 calc R . .
C14 C 0.3246(7) 0.7801(6) 0.2890(5) 0.0201(16) Uani 1 1 d . . .
H14 H 0.2887 0.8185 0.3402 0.024 Uiso 1 1 calc R . .
C15 C 0.2538(8) 0.7610(6) 0.2478(6) 0.0269(18) Uani 1 1 d . . .
H15 H 0.1700 0.7841 0.2725 0.032 Uiso 1 1 calc R . .
C16 C 0.3056(8) 0.7093(6) 0.1719(5) 0.0269(19) Uani 1 1 d . . .
H16 H 0.2574 0.6981 0.1436 0.032 Uiso 1 1 calc R . .
C17 C 0.4275(8) 0.6735(6) 0.1364(6) 0.0290(19) Uani 1 1 d . . .
H17 H 0.4626 0.6382 0.0835 0.035 Uiso 1 1 calc R . .
C18 C 0.4985(7) 0.6884(6) 0.1771(5) 0.0232(17) Uani 1 1 d . . .
H18 H 0.5822 0.6622 0.1528 0.028 Uiso 1 1 calc R . .
C19 C 0.4476(7) 0.7424(5) 0.2545(5) 0.0187(16) Uani 1 1 d . . .
C20 C 0.5188(6) 0.7596(5) 0.3026(5) 0.0142(15) Uani 1 1 d . . .
C21 C 0.6369(6) 0.7021(5) 0.2861(5) 0.0168(15) Uani 1 1 d . . .
H21 H 0.6740 0.6577 0.2387 0.020 Uiso 1 1 calc R . .
C22 C 0.7033(6) 0.7073(5) 0.3373(5) 0.0189(16) Uani 1 1 d . . .
C23 C 0.8266(6) 0.6351(6) 0.3168(5) 0.0188(16) Uani 1 1 d . . .
C24 C 0.9060(7) 0.6227(6) 0.2328(5) 0.0253(18) Uani 1 1 d . . .
H24 H 0.8828 0.6606 0.1865 0.030 Uiso 1 1 calc R . .
C25 C 1.0182(8) 0.5560(7) 0.2161(6) 0.036(2) Uani 1 1 d . . .
H25 H 1.0729 0.5496 0.1587 0.043 Uiso 1 1 calc R . .
C26 C 1.0514(8) 0.4980(7) 0.2832(6) 0.038(2) Uani 1 1 d . . .
H26 H 1.1287 0.4517 0.2716 0.046 Uiso 1 1 calc R . .
C27 C 0.9722(8) 0.5076(7) 0.3663(6) 0.041(2) Uani 1 1 d . . .
H27 H 0.9940 0.4666 0.4119 0.049 Uiso 1 1 calc R . .
C28 C 0.8606(8) 0.5771(6) 0.3834(5) 0.031(2) Uani 1 1 d . . .
H28 H 0.8071 0.5852 0.4411 0.037 Uiso 1 1 calc R . .
C29 C 0.2676(7) 1.0071(7) 0.1382(5) 0.0282(19) Uani 1 1 d . . .
H29 H 0.2374 1.0491 0.1868 0.034 Uiso 1 1 calc R . .
C30 C 0.1922(7) 0.9998(7) 0.0968(6) 0.030(2) Uani 1 1 d . . .
H30 H 0.1102 1.0360 0.1180 0.036 Uiso 1 1 calc R . .
C31 C 0.2359(8) 0.9403(7) 0.0251(6) 0.029(2) Uani 1 1 d . . .
H31 H 0.1840 0.9357 -0.0029 0.035 Uiso 1 1 calc R . .
C32 C 0.3546(8) 0.8876(7) -0.0057(6) 0.0285(19) Uani 1 1 d . . .
H32 H 0.3850 0.8467 -0.0551 0.034 Uiso 1 1 calc R . .
C33 C 0.4290(8) 0.8949(6) 0.0358(6) 0.0270(19) Uani 1 1 d . . .
H33 H 0.5110 0.8589 0.0140 0.032 Uiso 1 1 calc R . .
C34 C 0.3876(7) 0.9528(6) 0.1080(5) 0.0196(16) Uani 1 1 d . . .
C35 C 0.4655(7) 0.9627(6) 0.1555(5) 0.0197(16) Uani 1 1 d . . .
C36 C 0.5870(7) 0.9126(6) 0.1284(5) 0.0204(16) Uani 1 1 d . . .
H36 H 0.6202 0.8700 0.0799 0.024 Uiso 1 1 calc R . .
C37 C 0.6614(6) 0.9224(5) 0.1694(5) 0.0163(15) Uani 1 1 d . . .
C38 C 0.7938(7) 0.8715(6) 0.1315(5) 0.0196(16) Uani 1 1 d . . .
C39 C 0.8663(7) 0.8851(6) 0.1725(5) 0.0271(18) Uani 1 1 d . . .
H39 H 0.8316 0.9238 0.2235 0.033 Uiso 1 1 calc R . .
C40 C 0.9889(8) 0.8430(7) 0.1402(6) 0.038(2) Uani 1 1 d . . .
H40 H 1.0374 0.8527 0.1689 0.046 Uiso 1 1 calc R . .
C41 C 1.0395(7) 0.7865(7) 0.0653(6) 0.032(2) Uani 1 1 d . . .
H41 H 1.1230 0.7578 0.0424 0.039 Uiso 1 1 calc R . .
C42 C 0.9690(7) 0.7726(6) 0.0250(5) 0.0280(19) Uani 1 1 d . . .
H42 H 1.0034 0.7336 -0.0258 0.034 Uiso 1 1 calc R . .
C43 C 0.8464(7) 0.8153(6) 0.0579(5) 0.0265(18) Uani 1 1 d . . .
H43 H 0.7983 0.8053 0.0288 0.032 Uiso 1 1 calc R . .
C44 C 0.3066(7) 1.3184(6) 0.0923(5) 0.0231(17) Uani 1 1 d . . .
H44 H 0.3020 1.2525 0.1111 0.028 Uiso 1 1 calc R . .
C45 C 0.2449(8) 1.3735(6) 0.0386(5) 0.0296(19) Uani 1 1 d . . .
H45 H 0.1976 1.3457 0.0210 0.036 Uiso 1 1 calc R . .
C46 C 0.2519(7) 1.4690(7) 0.0105(5) 0.030(2) Uani 1 1 d . . .
H46 H 0.2101 1.5062 -0.0270 0.036 Uiso 1 1 calc R . .
C47 C 0.3186(7) 1.5107(6) 0.0363(5) 0.0284(19) Uani 1 1 d . . .
H47 H 0.3230 1.5765 0.0172 0.034 Uiso 1 1 calc R . .
C48 C 0.3796(7) 1.4545(6) 0.0909(5) 0.0250(18) Uani 1 1 d . . .
H48 H 0.4251 1.4834 0.1094 0.030 Uiso 1 1 calc R . .
C49 C 0.3761(6) 1.3584(6) 0.1192(5) 0.0207(16) Uani 1 1 d . . .
C50 C 0.4430(7) 1.2971(6) 0.1742(5) 0.0228(18) Uani 1 1 d . . .
C51 C 0.5474(7) 1.3111(6) 0.1738(5) 0.0207(16) Uani 1 1 d . . .
H51 H 0.5696 1.3662 0.1401 0.025 Uiso 1 1 calc R . .
C52 C 0.6215(7) 1.2519(6) 0.2181(5) 0.0189(16) Uani 1 1 d . . .
C53 C 0.7304(7) 1.2778(6) 0.2127(5) 0.0201(16) Uani 1 1 d . . .
C54 C 0.7369(7) 1.3758(6) 0.1951(5) 0.0256(18) Uani 1 1 d . . .
H54 H 0.6728 1.4275 0.1842 0.031 Uiso 1 1 calc R . .
C55 C 0.8366(8) 1.3984(7) 0.1936(5) 0.030(2) Uani 1 1 d . . .
H55 H 0.8399 1.4656 0.1828 0.036 Uiso 1 1 calc R . .
C56 C 0.9315(8) 1.3220(7) 0.2078(6) 0.034(2) Uani 1 1 d . . .
H56 H 1.0002 1.3368 0.2063 0.040 Uiso 1 1 calc R . .
C57 C 0.9254(7) 1.2248(7) 0.2241(5) 0.0304(19) Uani 1 1 d . . .
H57 H 0.9904 1.1726 0.2333 0.036 Uiso 1 1 calc R . .
C58 C 0.8250(7) 1.2026(6) 0.2271(5) 0.0250(17) Uani 1 1 d . . .
H58 H 0.8212 1.1356 0.2391 0.030 Uiso 1 1 calc R . .
Cl1 Cl 0.9118(12) 0.8972(10) 0.3736(8) 0.039(4) Uani 0.184(8) 1 d PDU A 1
Cl2 Cl 1.016(2) 0.7110(17) 0.4608(16) 0.053(4) Uani 0.184(8) 1 d PDU A 1
C59 C 0.906(7) 0.781(5) 0.421(9) 0.085(5) Uani 0.184(8) 1 d PDU A 1
H59A H 0.8293 0.7921 0.4688 0.103 Uiso 0.184(8) 1 calc PR A 1
H59B H 0.9036 0.7406 0.3772 0.103 Uiso 0.184(8) 1 calc PR A 1
N5 N 1.0413(14) 0.7018(12) 0.4925(11) 0.085(5) Uani 0.816(8) 1 d PDU A 2
C60 C 0.9839(15) 0.7474(13) 0.4559(12) 0.053(4) Uani 0.816(8) 1 d PDU A 2
C61 C 0.8992(14) 0.8096(12) 0.4091(13) 0.054(4) Uani 0.816(8) 1 d PDU A 2
H61A H 0.8181 0.8107 0.4442 0.081 Uiso 0.816(8) 1 calc PR A 2
H61B H 0.9206 0.7797 0.3530 0.081 Uiso 0.816(8) 1 calc PR A 2
H61C H 0.9041 0.8785 0.4000 0.081 Uiso 0.816(8) 1 calc PR A 2


_geom_special_details            
; 
 All esds (except the esd in the dihedral angle between two l.s. planes) 
 are estimated using the full covariance matrix.  The cell esds are taken 
 into account individually in the estimation of esds in distances, angles 
 and torsion angles; correlations between esds in cell parameters are only 
 used when they are defined by crystal symmetry.  An approximate (isotropic) 
 treatment of cell esds is used for estimating esds involving l.s. planes. 
;

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Dy1 O4 2.296(5) . ?
Dy1 O5 2.322(5) . ?
Dy1 O10 2.360(5) 2_676 ?
Dy1 O10 2.386(5) . ?
Dy1 O2 2.391(5) . ?
Dy1 O1 2.436(5) . ?
Dy1 N1 2.468(6) . ?
Dy1 N2 2.554(6) . ?
Dy1 Dy1 3.8023(10) 2_676 ?
Dy1 Dy2 3.8388(9) 2_676 ?
Dy1 Dy2 3.8593(14) . ?
Dy2 O6 2.287(5) . ?
Dy2 O7 2.298(5) . ?
Dy2 O8 2.326(5) . ?
Dy2 O1 2.328(5) 2_676 ?
Dy2 O9 2.340(5) . ?
Dy2 O2 2.359(5) . ?
Dy2 O10 2.447(5) . ?
Dy2 N4 2.585(6) . ?
Dy2 Dy1 3.8388(9) 2_676 ?
O1 C2 1.343(9) . ?
O1 Dy2 2.328(5) 2_676 ?
O2 C11 1.302(9) . ?
O3 N4 1.390(8) . ?
O3 H3 0.8400 . ?
O4 C20 1.267(9) . ?
O5 C22 1.252(9) . ?
O6 C35 1.261(9) . ?
O7 C37 1.260(9) . ?
O8 C50 1.302(9) . ?
O9 C52 1.262(9) . ?
O10 Dy1 2.360(5) 2_676 ?
O10 H10 1.0000 . ?
N1 C9 1.323(10) . ?
N1 C1 1.348(10) . ?
N2 C10 1.294(9) . ?
N2 N3 1.384(8) . ?
N3 C11 1.307(9) . ?
N4 C12 1.275(10) . ?
C1 C6 1.410(10) . ?
C1 C2 1.441(11) . ?
C2 C3 1.366(10) . ?
C3 C4 1.411(11) . ?
C3 H3A 0.9500 . ?
C4 C5 1.366(12) . ?
C4 H4 0.9500 . ?
C5 C6 1.403(11) . ?
C5 H5 0.9500 . ?
C6 C7 1.421(11) . ?
C7 C8 1.369(11) . ?
C7 H7 0.9500 . ?
C8 C9 1.409(11) . ?
C8 H8 0.9500 . ?
C9 C10 1.457(11) . ?
C10 H10A 0.9500 . ?
C11 C12 1.484(10) . ?
C12 C13 1.499(11) . ?
C13 H13A 0.9800 . ?
C13 H13B 0.9800 . ?
C13 H13C 0.9800 . ?
C14 C19 1.394(11) . ?
C14 C15 1.407(11) . ?
C14 H14 0.9500 . ?
C15 C16 1.371(12) . ?
C15 H15 0.9500 . ?
C16 C17 1.382(12) . ?
C16 H16 0.9500 . ?
C17 C18 1.377(11) . ?
C17 H17 0.9500 . ?
C18 C19 1.407(11) . ?
C18 H18 0.9500 . ?
C19 C20 1.487(10) . ?
C20 C21 1.394(10) . ?
C21 C22 1.412(11) . ?
C21 H21 0.9500 . ?
C22 C23 1.504(10) . ?
C23 C28 1.387(11) . ?
C23 C24 1.389(11) . ?
C24 C25 1.376(12) . ?
C24 H24 0.9500 . ?
C25 C26 1.391(14) . ?
C25 H25 0.9500 . ?
C26 C27 1.377(13) . ?
C26 H26 0.9500 . ?
C27 C28 1.384(12) . ?
C27 H27 0.9500 . ?
C28 H28 0.9500 . ?
C29 C30 1.391(12) . ?
C29 C34 1.395(11) . ?
C29 H29 0.9500 . ?
C30 C31 1.382(13) . ?
C30 H30 0.9500 . ?
C31 C32 1.377(13) . ?
C31 H31 0.9500 . ?
C32 C33 1.384(11) . ?
C32 H32 0.9500 . ?
C33 C34 1.377(11) . ?
C33 H33 0.9500 . ?
C34 C35 1.510(10) . ?
C35 C36 1.397(11) . ?
C36 C37 1.389(11) . ?
C36 H36 0.9500 . ?
C37 C38 1.519(10) . ?
C38 C43 1.374(11) . ?
C38 C39 1.390(11) . ?
C39 C40 1.393(12) . ?
C39 H39 0.9500 . ?
C40 C41 1.393(13) . ?
C40 H40 0.9500 . ?
C41 C42 1.361(12) . ?
C41 H41 0.9500 . ?
C42 C43 1.395(11) . ?
C42 H42 0.9500 . ?
C43 H43 0.9500 . ?
C44 C45 1.381(11) . ?
C44 C49 1.400(11) . ?
C44 H44 0.9500 . ?
C45 C46 1.381(12) . ?
C45 H45 0.9500 . ?
C46 C47 1.373(12) . ?
C46 H46 0.9500 . ?
C47 C48 1.393(12) . ?
C47 H47 0.9500 . ?
C48 C49 1.379(11) . ?
C48 H48 0.9500 . ?
C49 C50 1.464(11) . ?
C50 C51 1.398(11) . ?
C51 C52 1.386(11) . ?
C51 H51 0.9500 . ?
C52 C53 1.510(10) . ?
C53 C58 1.383(11) . ?
C53 C54 1.392(11) . ?
C54 C55 1.391(11) . ?
C54 H54 0.9500 . ?
C55 C56 1.393(13) . ?
C55 H55 0.9500 . ?
C56 C57 1.379(13) . ?
C56 H56 0.9500 . ?
C57 C58 1.389(11) . ?
C57 H57 0.9500 . ?
C58 H58 0.9500 . ?
Cl1 C59 1.721(10) . ?
Cl2 C59 1.719(10) . ?
C59 H59A 0.9900 . ?
C59 H59B 0.9900 . ?
N5 C60 1.098(9) . ?
C60 C61 1.518(9) . ?
C61 H61A 0.9800 . ?
C61 H61B 0.9800 . ?
C61 H61C 0.9800 . ?

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
_geom_angle_publ_flag
O4 Dy1 O5 71.54(18) . . ?
O4 Dy1 O10 151.03(17) . 2_676 ?
O5 Dy1 O10 134.38(17) . 2_676 ?
O4 Dy1 O10 99.01(18) . . ?
O5 Dy1 O10 87.81(17) . . ?
O10 Dy1 O10 73.55(18) 2_676 . ?
O4 Dy1 O2 70.54(17) . . ?
O5 Dy1 O2 129.70(17) . . ?
O10 Dy1 O2 80.93(17) 2_676 . ?
O10 Dy1 O2 67.09(16) . . ?
O4 Dy1 O1 135.38(17) . . ?
O5 Dy1 O1 71.49(17) . . ?
O10 Dy1 O1 73.12(17) 2_676 . ?
O10 Dy1 O1 103.64(17) . . ?
O2 Dy1 O1 154.03(16) . . ?
O4 Dy1 N1 88.43(19) . . ?
O5 Dy1 N1 86.31(19) . . ?
O10 Dy1 N1 103.90(18) 2_676 . ?
O10 Dy1 N1 168.55(18) . . ?
O2 Dy1 N1 123.96(18) . . ?
O1 Dy1 N1 65.15(18) . . ?
O4 Dy1 N2 67.40(19) . . ?
O5 Dy1 N2 127.49(18) . . ?
O10 Dy1 N2 95.18(18) 2_676 . ?
O10 Dy1 N2 129.22(18) . . ?
O2 Dy1 N2 62.23(18) . . ?
O1 Dy1 N2 120.46(18) . . ?
N1 Dy1 N2 61.73(19) . . ?
O4 Dy1 Dy1 129.90(13) . 2_676 ?
O5 Dy1 Dy1 114.22(13) . 2_676 ?
O10 Dy1 Dy1 37.01(12) 2_676 2_676 ?
O10 Dy1 Dy1 36.54(11) . 2_676 ?
O2 Dy1 Dy1 69.99(11) . 2_676 ?
O1 Dy1 Dy1 88.15(11) . 2_676 ?
N1 Dy1 Dy1 139.85(14) . 2_676 ?
N2 Dy1 Dy1 116.93(14) . 2_676 ?
O4 Dy1 Dy2 169.27(13) . 2_676 ?
O5 Dy1 Dy2 103.32(13) . 2_676 ?
O10 Dy1 Dy2 37.80(12) 2_676 2_676 ?
O10 Dy1 Dy2 90.06(12) . 2_676 ?
O2 Dy1 Dy2 118.73(12) . 2_676 ?
O1 Dy1 Dy2 35.36(11) . 2_676 ?
N1 Dy1 Dy2 81.76(14) . 2_676 ?
N2 Dy1 Dy2 111.02(14) . 2_676 ?
Dy1 Dy1 Dy2 60.67(3) 2_676 2_676 ?
O4 Dy1 Dy2 69.80(13) . . ?
O5 Dy1 Dy2 100.08(13) . . ?
O10 Dy1 Dy2 89.95(12) 2_676 . ?
O10 Dy1 Dy2 37.57(12) . . ?
O2 Dy1 Dy2 35.40(12) . . ?
O1 Dy1 Dy2 141.20(11) . . ?
N1 Dy1 Dy2 153.58(14) . . ?
N2 Dy1 Dy2 95.13(14) . . ?
Dy1 Dy1 Dy2 60.13(2) 2_676 . ?
Dy2 Dy1 Dy2 120.80(2) 2_676 . ?
O6 Dy2 O7 71.81(18) . . ?
O6 Dy2 O8 77.31(18) . . ?
O7 Dy2 O8 110.93(18) . . ?
O6 Dy2 O1 149.23(18) . 2_676 ?
O7 Dy2 O1 138.78(17) . 2_676 ?
O8 Dy2 O1 90.11(17) . 2_676 ?
O6 Dy2 O9 122.18(18) . . ?
O7 Dy2 O9 74.91(18) . . ?
O8 Dy2 O9 72.33(17) . . ?
O1 Dy2 O9 78.78(17) 2_676 . ?
O6 Dy2 O2 89.29(18) . . ?
O7 Dy2 O2 107.44(17) . . ?
O8 Dy2 O2 132.47(17) . . ?
O1 Dy2 O2 78.61(17) 2_676 . ?
O9 Dy2 O2 146.08(17) . . ?
O6 Dy2 O10 127.28(17) . . ?
O7 Dy2 O10 72.25(17) . . ?
O8 Dy2 O10 152.62(17) . . ?
O1 Dy2 O10 73.47(17) 2_676 . ?
O9 Dy2 O10 82.88(17) . . ?
O2 Dy2 O10 66.60(16) . . ?
O6 Dy2 N4 68.30(19) . . ?
O7 Dy2 N4 138.79(19) . . ?
O8 Dy2 N4 69.95(19) . . ?
O1 Dy2 N4 81.04(19) 2_676 . ?
O9 Dy2 N4 136.82(19) . . ?
O2 Dy2 N4 62.75(18) . . ?
O10 Dy2 N4 126.59(18) . . ?
O6 Dy2 Dy1 156.93(14) . 2_676 ?
O7 Dy2 Dy1 105.19(13) . 2_676 ?
O8 Dy2 Dy1 123.55(13) . 2_676 ?
O1 Dy2 Dy1 37.27(12) 2_676 2_676 ?
O9 Dy2 Dy1 77.21(12) . 2_676 ?
O2 Dy2 Dy1 69.48(12) . 2_676 ?
O10 Dy2 Dy1 36.24(11) . 2_676 ?
N4 Dy2 Dy1 107.32(14) . 2_676 ?
O6 Dy2 Dy1 98.34(14) . . ?
O7 Dy2 Dy1 77.41(13) . . ?
O8 Dy2 Dy1 168.27(12) . . ?
O1 Dy2 Dy1 88.34(12) 2_676 . ?
O9 Dy2 Dy1 118.67(12) . . ?
O2 Dy2 Dy1 35.94(11) . . ?
O10 Dy2 Dy1 36.48(11) . . ?
N4 Dy2 Dy1 98.33(14) . . ?
Dy1 Dy2 Dy1 59.20(2) 2_676 . ?
C2 O1 Dy2 122.0(4) . 2_676 ?
C2 O1 Dy1 115.4(4) . . ?
Dy2 O1 Dy1 107.36(19) 2_676 . ?
C11 O2 Dy2 122.2(4) . . ?
C11 O2 Dy1 121.0(4) . . ?
Dy2 O2 Dy1 108.66(19) . . ?
N4 O3 H3 109.5 . . ?
C20 O4 Dy1 140.0(5) . . ?
C22 O5 Dy1 136.6(5) . . ?
C35 O6 Dy2 138.6(5) . . ?
C37 O7 Dy2 136.8(5) . . ?
C50 O8 Dy2 138.3(5) . . ?
C52 O9 Dy2 136.8(5) . . ?
Dy1 O10 Dy1 106.45(18) 2_676 . ?
Dy1 O10 Dy2 105.96(18) 2_676 . ?
Dy1 O10 Dy2 105.95(18) . . ?
Dy1 O10 H10 112.6 2_676 . ?
Dy1 O10 H10 112.6 . . ?
Dy2 O10 H10 112.6 . . ?
C9 N1 C1 119.3(6) . . ?
C9 N1 Dy1 122.8(5) . . ?
C1 N1 Dy1 116.1(5) . . ?
C10 N2 N3 115.5(6) . . ?
C10 N2 Dy1 119.7(5) . . ?
N3 N2 Dy1 120.0(4) . . ?
C11 N3 N2 109.8(6) . . ?
C12 N4 O3 116.4(6) . . ?
C12 N4 Dy2 118.3(5) . . ?
O3 N4 Dy2 122.5(4) . . ?
N1 C1 C6 123.2(7) . . ?
N1 C1 C2 115.5(6) . . ?
C6 C1 C2 121.3(7) . . ?
O1 C2 C3 125.3(7) . . ?
O1 C2 C1 117.4(6) . . ?
C3 C2 C1 117.3(7) . . ?
C2 C3 C4 121.1(7) . . ?
C2 C3 H3A 119.4 . . ?
C4 C3 H3A 119.4 . . ?
C5 C4 C3 121.8(8) . . ?
C5 C4 H4 119.1 . . ?
C3 C4 H4 119.1 . . ?
C4 C5 C6 119.5(7) . . ?
C4 C5 H5 120.3 . . ?
C6 C5 H5 120.3 . . ?
C5 C6 C1 118.9(7) . . ?
C5 C6 C7 125.3(7) . . ?
C1 C6 C7 115.9(7) . . ?
C8 C7 C6 120.6(7) . . ?
C8 C7 H7 119.7 . . ?
C6 C7 H7 119.7 . . ?
C7 C8 C9 118.7(7) . . ?
C7 C8 H8 120.6 . . ?
C9 C8 H8 120.6 . . ?
N1 C9 C8 122.2(7) . . ?
N1 C9 C10 114.7(7) . . ?
C8 C9 C10 123.1(7) . . ?
N2 C10 C9 116.0(7) . . ?
N2 C10 H10A 122.0 . . ?
C9 C10 H10A 122.0 . . ?
O2 C11 N3 126.3(7) . . ?
O2 C11 C12 117.3(6) . . ?
N3 C11 C12 116.4(7) . . ?
N4 C12 C11 113.1(6) . . ?
N4 C12 C13 125.5(7) . . ?
C11 C12 C13 121.2(7) . . ?
C12 C13 H13A 109.5 . . ?
C12 C13 H13B 109.5 . . ?
H13A C13 H13B 109.5 . . ?
C12 C13 H13C 109.5 . . ?
H13A C13 H13C 109.5 . . ?
H13B C13 H13C 109.5 . . ?
C19 C14 C15 119.7(7) . . ?
C19 C14 H14 120.1 . . ?
C15 C14 H14 120.1 . . ?
C16 C15 C14 120.1(8) . . ?
C16 C15 H15 119.9 . . ?
C14 C15 H15 119.9 . . ?
C15 C16 C17 120.4(8) . . ?
C15 C16 H16 119.8 . . ?
C17 C16 H16 119.8 . . ?
C18 C17 C16 120.4(8) . . ?
C18 C17 H17 119.8 . . ?
C16 C17 H17 119.8 . . ?
C17 C18 C19 120.3(8) . . ?
C17 C18 H18 119.8 . . ?
C19 C18 H18 119.8 . . ?
C14 C19 C18 118.9(7) . . ?
C14 C19 C20 118.0(7) . . ?
C18 C19 C20 123.1(7) . . ?
O4 C20 C21 122.6(7) . . ?
O4 C20 C19 116.7(6) . . ?
C21 C20 C19 120.6(6) . . ?
C20 C21 C22 122.4(7) . . ?
C20 C21 H21 118.8 . . ?
C22 C21 H21 118.8 . . ?
O5 C22 C21 126.0(7) . . ?
O5 C22 C23 117.1(7) . . ?
C21 C22 C23 116.8(7) . . ?
C28 C23 C24 119.1(7) . . ?
C28 C23 C22 119.0(7) . . ?
C24 C23 C22 121.8(7) . . ?
C25 C24 C23 120.5(8) . . ?
C25 C24 H24 119.7 . . ?
C23 C24 H24 119.7 . . ?
C24 C25 C26 119.9(8) . . ?
C24 C25 H25 120.0 . . ?
C26 C25 H25 120.0 . . ?
C27 C26 C25 120.0(8) . . ?
C27 C26 H26 120.0 . . ?
C25 C26 H26 120.0 . . ?
C26 C27 C28 119.9(9) . . ?
C26 C27 H27 120.0 . . ?
C28 C27 H27 120.0 . . ?
C27 C28 C23 120.5(8) . . ?
C27 C28 H28 119.8 . . ?
C23 C28 H28 119.8 . . ?
C30 C29 C34 119.9(8) . . ?
C30 C29 H29 120.1 . . ?
C34 C29 H29 120.1 . . ?
C31 C30 C29 120.3(8) . . ?
C31 C30 H30 119.8 . . ?
C29 C30 H30 119.8 . . ?
C32 C31 C30 120.1(8) . . ?
C32 C31 H31 120.0 . . ?
C30 C31 H31 120.0 . . ?
C31 C32 C33 119.3(8) . . ?
C31 C32 H32 120.3 . . ?
C33 C32 H32 120.3 . . ?
C34 C33 C32 121.8(8) . . ?
C34 C33 H33 119.1 . . ?
C32 C33 H33 119.1 . . ?
C33 C34 C29 118.6(7) . . ?
C33 C34 C35 123.6(7) . . ?
C29 C34 C35 117.8(7) . . ?
O6 C35 C36 123.3(7) . . ?
O6 C35 C34 115.2(7) . . ?
C36 C35 C34 121.5(7) . . ?
C37 C36 C35 122.7(7) . . ?
C37 C36 H36 118.6 . . ?
C35 C36 H36 118.6 . . ?
O7 C37 C36 125.0(7) . . ?
O7 C37 C38 115.7(7) . . ?
C36 C37 C38 119.2(7) . . ?
C43 C38 C39 118.2(7) . . ?
C43 C38 C37 124.0(7) . . ?
C39 C38 C37 117.8(7) . . ?
C38 C39 C40 121.1(8) . . ?
C38 C39 H39 119.5 . . ?
C40 C39 H39 119.5 . . ?
C39 C40 C41 119.4(8) . . ?
C39 C40 H40 120.3 . . ?
C41 C40 H40 120.3 . . ?
C42 C41 C40 119.8(8) . . ?
C42 C41 H41 120.1 . . ?
C40 C41 H41 120.1 . . ?
C41 C42 C43 120.3(8) . . ?
C41 C42 H42 119.8 . . ?
C43 C42 H42 119.8 . . ?
C38 C43 C42 121.3(8) . . ?
C38 C43 H43 119.4 . . ?
C42 C43 H43 119.4 . . ?
C45 C44 C49 120.8(8) . . ?
C45 C44 H44 119.6 . . ?
C49 C44 H44 119.6 . . ?
C46 C45 C44 119.9(8) . . ?
C46 C45 H45 120.0 . . ?
C44 C45 H45 120.0 . . ?
C47 C46 C45 120.8(8) . . ?
C47 C46 H46 119.6 . . ?
C45 C46 H46 119.6 . . ?
C46 C47 C48 118.6(8) . . ?
C46 C47 H47 120.7 . . ?
C48 C47 H47 120.7 . . ?
C49 C48 C47 122.2(8) . . ?
C49 C48 H48 118.9 . . ?
C47 C48 H48 118.9 . . ?
C48 C49 C44 117.7(7) . . ?
C48 C49 C50 122.9(7) . . ?
C44 C49 C50 119.4(7) . . ?
O8 C50 C51 121.6(7) . . ?
O8 C50 C49 116.7(7) . . ?
C51 C50 C49 121.7(7) . . ?
C52 C51 C50 125.8(7) . . ?
C52 C51 H51 117.1 . . ?
C50 C51 H51 117.1 . . ?
O9 C52 C51 124.8(7) . . ?
O9 C52 C53 115.5(7) . . ?
C51 C52 C53 119.7(7) . . ?
C58 C53 C54 119.4(7) . . ?
C58 C53 C52 119.1(7) . . ?
C54 C53 C52 121.5(7) . . ?
C55 C54 C53 120.4(8) . . ?
C55 C54 H54 119.8 . . ?
C53 C54 H54 119.8 . . ?
C54 C55 C56 119.7(8) . . ?
C54 C55 H55 120.2 . . ?
C56 C55 H55 120.2 . . ?
C57 C56 C55 119.7(8) . . ?
C57 C56 H56 120.1 . . ?
C55 C56 H56 120.1 . . ?
C56 C57 C58 120.5(8) . . ?
C56 C57 H57 119.7 . . ?
C58 C57 H57 119.7 . . ?
C53 C58 C57 120.2(8) . . ?
C53 C58 H58 119.9 . . ?
C57 C58 H58 119.9 . . ?
Cl2 C59 Cl1 119(2) . . ?
Cl2 C59 H59A 107.7 . . ?
Cl1 C59 H59A 107.7 . . ?
Cl2 C59 H59B 107.7 . . ?
Cl1 C59 H59B 107.7 . . ?
H59A C59 H59B 107.1 . . ?
N5 C60 C61 177(2) . . ?
C60 C61 H61A 109.5 . . ?
C60 C61 H61B 109.5 . . ?
H61A C61 H61B 109.5 . . ?
C60 C61 H61C 109.5 . . ?
H61A C61 H61C 109.5 . . ?
H61B C61 H61C 109.5 . . ?

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
_geom_torsion_publ_flag
O4 Dy1 Dy2 O6 7.47(18) . . . . ?
O5 Dy1 Dy2 O6 73.38(18) . . . . ?
O10 Dy1 Dy2 O6 -151.36(18) 2_676 . . . ?
O10 Dy1 Dy2 O6 146.2(2) . . . . ?
O2 Dy1 Dy2 O6 -77.1(2) . . . . ?
O1 Dy1 Dy2 O6 146.3(2) . . . . ?
N1 Dy1 Dy2 O6 -28.8(3) . . . . ?
N2 Dy1 Dy2 O6 -56.16(19) . . . . ?
Dy1 Dy1 Dy2 O6 -174.38(13) 2_676 . . . ?
Dy2 Dy1 Dy2 O6 -174.38(13) 2_676 . . . ?
O4 Dy1 Dy2 O7 -61.67(19) . . . . ?
O5 Dy1 Dy2 O7 4.24(17) . . . . ?
O10 Dy1 Dy2 O7 139.49(17) 2_676 . . . ?
O10 Dy1 Dy2 O7 77.1(2) . . . . ?
O2 Dy1 Dy2 O7 -146.2(2) . . . . ?
O1 Dy1 Dy2 O7 77.2(2) . . . . ?
N1 Dy1 Dy2 O7 -97.9(3) . . . . ?
N2 Dy1 Dy2 O7 -125.30(19) . . . . ?
Dy1 Dy1 Dy2 O7 116.47(13) 2_676 . . . ?
Dy2 Dy1 Dy2 O7 116.48(13) 2_676 . . . ?
O4 Dy1 Dy2 O8 74.8(6) . . . . ?
O5 Dy1 Dy2 O8 140.7(6) . . . . ?
O10 Dy1 Dy2 O8 -84.1(6) 2_676 . . . ?
O10 Dy1 Dy2 O8 -146.5(6) . . . . ?
O2 Dy1 Dy2 O8 -9.8(6) . . . . ?
O1 Dy1 Dy2 O8 -146.4(6) . . . . ?
N1 Dy1 Dy2 O8 38.5(7) . . . . ?
N2 Dy1 Dy2 O8 11.1(6) . . . . ?
Dy1 Dy1 Dy2 O8 -107.1(6) 2_676 . . . ?
Dy2 Dy1 Dy2 O8 -107.1(6) 2_676 . . . ?
O4 Dy1 Dy2 O1 157.30(18) . . . 2_676 ?
O5 Dy1 Dy2 O1 -136.79(18) . . . 2_676 ?
O10 Dy1 Dy2 O1 -1.53(15) 2_676 . . 2_676 ?
O10 Dy1 Dy2 O1 -63.9(2) . . . 2_676 ?
O2 Dy1 Dy2 O1 72.7(2) . . . 2_676 ?
O1 Dy1 Dy2 O1 -63.9(3) . . . 2_676 ?
N1 Dy1 Dy2 O1 121.0(3) . . . 2_676 ?
N2 Dy1 Dy2 O1 93.67(18) . . . 2_676 ?
Dy1 Dy1 Dy2 O1 -24.55(12) 2_676 . . 2_676 ?
Dy2 Dy1 Dy2 O1 -24.55(12) 2_676 . . 2_676 ?
O4 Dy1 Dy2 O9 -126.4(2) . . . . ?
O5 Dy1 Dy2 O9 -60.54(19) . . . . ?
O10 Dy1 Dy2 O9 74.72(18) 2_676 . . . ?
O10 Dy1 Dy2 O9 12.3(2) . . . . ?
O2 Dy1 Dy2 O9 149.0(2) . . . . ?
O1 Dy1 Dy2 O9 12.4(2) . . . . ?
N1 Dy1 Dy2 O9 -162.7(3) . . . . ?
N2 Dy1 Dy2 O9 169.92(19) . . . . ?
Dy1 Dy1 Dy2 O9 51.70(14) 2_676 . . . ?
Dy2 Dy1 Dy2 O9 51.70(14) 2_676 . . . ?
O4 Dy1 Dy2 O2 84.6(2) . . . . ?
O5 Dy1 Dy2 O2 150.5(2) . . . . ?
O10 Dy1 Dy2 O2 -74.3(2) 2_676 . . . ?
O10 Dy1 Dy2 O2 -136.7(3) . . . . ?
O1 Dy1 Dy2 O2 -136.6(3) . . . . ?
N1 Dy1 Dy2 O2 48.3(4) . . . . ?
N2 Dy1 Dy2 O2 20.9(2) . . . . ?
Dy1 Dy1 Dy2 O2 -97.3(2) 2_676 . . . ?
Dy2 Dy1 Dy2 O2 -97.3(2) 2_676 . . . ?
O4 Dy1 Dy2 O10 -138.8(2) . . . . ?
O5 Dy1 Dy2 O10 -72.9(2) . . . . ?
O10 Dy1 Dy2 O10 62.4(3) 2_676 . . . ?
O2 Dy1 Dy2 O10 136.7(3) . . . . ?
O1 Dy1 Dy2 O10 0.1(2) . . . . ?
N1 Dy1 Dy2 O10 -175.0(4) . . . . ?
N2 Dy1 Dy2 O10 157.6(2) . . . . ?
Dy1 Dy1 Dy2 O10 39.37(18) 2_676 . . . ?
Dy2 Dy1 Dy2 O10 39.37(18) 2_676 . . . ?
O4 Dy1 Dy2 N4 76.6(2) . . . . ?
O5 Dy1 Dy2 N4 142.52(19) . . . . ?
O10 Dy1 Dy2 N4 -82.23(18) 2_676 . . . ?
O10 Dy1 Dy2 N4 -144.6(2) . . . . ?
O2 Dy1 Dy2 N4 -7.9(2) . . . . ?
O1 Dy1 Dy2 N4 -144.6(2) . . . . ?
N1 Dy1 Dy2 N4 40.3(3) . . . . ?
N2 Dy1 Dy2 N4 13.0(2) . . . . ?
Dy1 Dy1 Dy2 N4 -105.25(14) 2_676 . . . ?
Dy2 Dy1 Dy2 N4 -105.25(14) 2_676 . . . ?
O4 Dy1 Dy2 Dy1 -178.15(14) . . . 2_676 ?
O5 Dy1 Dy2 Dy1 -112.24(13) . . . 2_676 ?
O10 Dy1 Dy2 Dy1 23.02(11) 2_676 . . 2_676 ?
O10 Dy1 Dy2 Dy1 -39.37(18) . . . 2_676 ?
O2 Dy1 Dy2 Dy1 97.3(2) . . . 2_676 ?
O1 Dy1 Dy2 Dy1 -39.31(18) . . . 2_676 ?
N1 Dy1 Dy2 Dy1 145.6(3) . . . 2_676 ?
N2 Dy1 Dy2 Dy1 118.22(14) . . . 2_676 ?
Dy2 Dy1 Dy2 Dy1 0.0 2_676 . . 2_676 ?
O4 Dy1 O1 C2 -31.8(6) . . . . ?
O5 Dy1 O1 C2 -67.2(5) . . . . ?
O10 Dy1 O1 C2 142.1(5) 2_676 . . . ?
O10 Dy1 O1 C2 -150.1(4) . . . . ?
O2 Dy1 O1 C2 144.5(5) . . . . ?
N1 Dy1 O1 C2 27.4(5) . . . . ?
N2 Dy1 O1 C2 56.0(5) . . . . ?
Dy1 Dy1 O1 C2 176.5(5) 2_676 . . . ?
Dy2 Dy1 O1 C2 139.7(6) 2_676 . . . ?
Dy2 Dy1 O1 C2 -150.2(4) . . . . ?
O4 Dy1 O1 Dy2 -171.49(19) . . . 2_676 ?
O5 Dy1 O1 Dy2 153.1(2) . . . 2_676 ?
O10 Dy1 O1 Dy2 2.35(16) 2_676 . . 2_676 ?
O10 Dy1 O1 Dy2 70.1(2) . . . 2_676 ?
O2 Dy1 O1 Dy2 4.8(5) . . . 2_676 ?
N1 Dy1 O1 Dy2 -112.3(2) . . . 2_676 ?
N2 Dy1 O1 Dy2 -83.7(2) . . . 2_676 ?
Dy1 Dy1 O1 Dy2 36.75(16) 2_676 . . 2_676 ?
Dy2 Dy1 O1 Dy2 70.1(2) . . . 2_676 ?
O6 Dy2 O2 C11 -43.5(5) . . . . ?
O7 Dy2 O2 C11 -114.2(5) . . . . ?
O8 Dy2 O2 C11 28.5(6) . . . . ?
O1 Dy2 O2 C11 108.0(5) 2_676 . . . ?
O9 Dy2 O2 C11 157.1(4) . . . . ?
O10 Dy2 O2 C11 -175.2(5) . . . . ?
N4 Dy2 O2 C11 22.3(5) . . . . ?
Dy1 Dy2 O2 C11 145.7(5) 2_676 . . . ?
Dy1 Dy2 O2 C11 -148.9(6) . . . . ?
O6 Dy2 O2 Dy1 105.3(2) . . . . ?
O7 Dy2 O2 Dy1 34.7(2) . . . . ?
O8 Dy2 O2 Dy1 177.31(18) . . . . ?
O1 Dy2 O2 Dy1 -103.2(2) 2_676 . . . ?
O9 Dy2 O2 Dy1 -54.1(4) . . . . ?
O10 Dy2 O2 Dy1 -26.39(17) . . . . ?
N4 Dy2 O2 Dy1 171.1(3) . . . . ?
Dy1 Dy2 O2 Dy1 -65.46(15) 2_676 . . . ?
O4 Dy1 O2 C11 67.1(5) . . . . ?
O5 Dy1 O2 C11 110.2(5) . . . . ?
O10 Dy1 O2 C11 -107.8(5) 2_676 . . . ?
O10 Dy1 O2 C11 176.3(5) . . . . ?
O1 Dy1 O2 C11 -110.1(5) . . . . ?
N1 Dy1 O2 C11 -7.1(6) . . . . ?
N2 Dy1 O2 C11 -7.0(5) . . . . ?
Dy1 Dy1 O2 C11 -144.4(5) 2_676 . . . ?
Dy2 Dy1 O2 C11 -107.0(5) 2_676 . . . ?
Dy2 Dy1 O2 C11 149.3(6) . . . . ?
O4 Dy1 O2 Dy2 -82.2(2) . . . . ?
O5 Dy1 O2 Dy2 -39.1(3) . . . . ?
O10 Dy1 O2 Dy2 102.9(2) 2_676 . . . ?
O10 Dy1 O2 Dy2 27.01(18) . . . . ?
O1 Dy1 O2 Dy2 100.6(4) . . . . ?
N1 Dy1 O2 Dy2 -156.39(19) . . . . ?
N2 Dy1 O2 Dy2 -156.3(3) . . . . ?
Dy1 Dy1 O2 Dy2 66.26(15) 2_676 . . . ?
Dy2 Dy1 O2 Dy2 103.70(16) 2_676 . . . ?
O5 Dy1 O4 C20 10.9(7) . . . . ?
O10 Dy1 O4 C20 167.7(6) 2_676 . . . ?
O10 Dy1 O4 C20 95.5(7) . . . . ?
O2 Dy1 O4 C20 157.2(8) . . . . ?
O1 Dy1 O4 C20 -24.5(8) . . . . ?
N1 Dy1 O4 C20 -75.7(7) . . . . ?
N2 Dy1 O4 C20 -135.6(8) . . . . ?
Dy1 Dy1 O4 C20 117.4(7) 2_676 . . . ?
Dy2 Dy1 O4 C20 -51.9(12) 2_676 . . . ?
Dy2 Dy1 O4 C20 119.5(7) . . . . ?
O4 Dy1 O5 C22 -7.9(7) . . . . ?
O10 Dy1 O5 C22 -172.5(6) 2_676 . . . ?
O10 Dy1 O5 C22 -108.2(7) . . . . ?
O2 Dy1 O5 C22 -50.7(7) . . . . ?
O1 Dy1 O5 C22 146.7(7) . . . . ?
N1 Dy1 O5 C22 81.7(7) . . . . ?
N2 Dy1 O5 C22 32.0(8) . . . . ?
Dy1 Dy1 O5 C22 -134.2(7) 2_676 . . . ?
Dy2 Dy1 O5 C22 162.3(7) 2_676 . . . ?
Dy2 Dy1 O5 C22 -72.5(7) . . . . ?
O7 Dy2 O6 C35 -12.9(7) . . . . ?
O8 Dy2 O6 C35 104.4(8) . . . . ?
O1 Dy2 O6 C35 172.5(6) 2_676 . . . ?
O9 Dy2 O6 C35 45.1(8) . . . . ?
O2 Dy2 O6 C35 -121.5(8) . . . . ?
O10 Dy2 O6 C35 -62.1(8) . . . . ?
N4 Dy2 O6 C35 177.7(8) . . . . ?
Dy1 Dy2 O6 C35 -99.0(8) 2_676 . . . ?
Dy1 Dy2 O6 C35 -86.6(7) . . . . ?
O6 Dy2 O7 C37 13.6(7) . . . . ?
O8 Dy2 O7 C37 -54.5(7) . . . . ?
O1 Dy2 O7 C37 -170.6(6) 2_676 . . . ?
O9 Dy2 O7 C37 -118.4(7) . . . . ?
O2 Dy2 O7 C37 96.9(7) . . . . ?
O10 Dy2 O7 C37 154.4(7) . . . . ?
N4 Dy2 O7 C37 28.6(8) . . . . ?
Dy1 Dy2 O7 C37 169.7(7) 2_676 . . . ?
Dy1 Dy2 O7 C37 116.9(7) . . . . ?
O6 Dy2 O8 C50 -128.0(7) . . . . ?
O7 Dy2 O8 C50 -63.4(7) . . . . ?
O1 Dy2 O8 C50 80.3(7) 2_676 . . . ?
O9 Dy2 O8 C50 2.2(7) . . . . ?
O2 Dy2 O8 C50 154.9(6) . . . . ?
O10 Dy2 O8 C50 28.3(9) . . . . ?
N4 Dy2 O8 C50 160.8(7) . . . . ?
Dy1 Dy2 O8 C50 62.8(7) 2_676 . . . ?
Dy1 Dy2 O8 C50 162.7(5) . . . . ?
O6 Dy2 O9 C52 67.0(7) . . . . ?
O7 Dy2 O9 C52 123.5(7) . . . . ?
O8 Dy2 O9 C52 5.2(6) . . . . ?
O1 Dy2 O9 C52 -88.5(7) 2_676 . . . ?
O2 Dy2 O9 C52 -137.5(6) . . . . ?
O10 Dy2 O9 C52 -163.0(7) . . . . ?
N4 Dy2 O9 C52 -24.8(8) . . . . ?
Dy1 Dy2 O9 C52 -126.6(7) 2_676 . . . ?
Dy1 Dy2 O9 C52 -170.3(6) . . . . ?
O4 Dy1 O10 Dy1 151.26(19) . . . 2_676 ?
O5 Dy1 O10 Dy1 -137.8(2) . . . 2_676 ?
O10 Dy1 O10 Dy1 0.0 2_676 . . 2_676 ?
O2 Dy1 O10 Dy1 86.9(2) . . . 2_676 ?
O1 Dy1 O10 Dy1 -67.5(2) . . . 2_676 ?
N1 Dy1 O10 Dy1 -78.7(9) . . . 2_676 ?
N2 Dy1 O10 Dy1 83.1(3) . . . 2_676 ?
Dy2 Dy1 O10 Dy1 -34.49(16) 2_676 . . 2_676 ?
Dy2 Dy1 O10 Dy1 112.5(2) . . . 2_676 ?
O4 Dy1 O10 Dy2 38.8(2) . . . . ?
O5 Dy1 O10 Dy2 109.69(19) . . . . ?
O10 Dy1 O10 Dy2 -112.5(2) 2_676 . . . ?
O2 Dy1 O10 Dy2 -25.56(17) . . . . ?
O1 Dy1 O10 Dy2 -179.96(15) . . . . ?
N1 Dy1 O10 Dy2 168.8(8) . . . . ?
N2 Dy1 O10 Dy2 -29.3(3) . . . . ?
Dy1 Dy1 O10 Dy2 -112.5(2) 2_676 . . . ?
Dy2 Dy1 O10 Dy2 -146.98(15) 2_676 . . . ?
O6 Dy2 O10 Dy1 -156.54(19) . . . 2_676 ?
O7 Dy2 O10 Dy1 154.4(2) . . . 2_676 ?
O8 Dy2 O10 Dy1 53.0(4) . . . 2_676 ?
O1 Dy2 O10 Dy1 -2.31(16) 2_676 . . 2_676 ?
O9 Dy2 O10 Dy1 78.05(19) . . . 2_676 ?
O2 Dy2 O10 Dy1 -86.8(2) . . . 2_676 ?
N4 Dy2 O10 Dy1 -67.3(3) . . . 2_676 ?
Dy1 Dy2 O10 Dy1 -112.8(2) . . . 2_676 ?
O6 Dy2 O10 Dy1 -43.7(3) . . . . ?
O7 Dy2 O10 Dy1 -92.7(2) . . . . ?
O8 Dy2 O10 Dy1 165.9(3) . . . . ?
O1 Dy2 O10 Dy1 110.5(2) 2_676 . . . ?
O9 Dy2 O10 Dy1 -169.1(2) . . . . ?
O2 Dy2 O10 Dy1 26.03(17) . . . . ?
N4 Dy2 O10 Dy1 45.5(3) . . . . ?
Dy1 Dy2 O10 Dy1 112.8(2) 2_676 . . . ?
O4 Dy1 N1 C9 -46.5(6) . . . . ?
O5 Dy1 N1 C9 -118.1(6) . . . . ?
O10 Dy1 N1 C9 106.9(6) 2_676 . . . ?
O10 Dy1 N1 C9 -177.4(7) . . . . ?
O2 Dy1 N1 C9 18.6(6) . . . . ?
O1 Dy1 N1 C9 170.6(6) . . . . ?
N2 Dy1 N1 C9 18.5(5) . . . . ?
Dy1 Dy1 N1 C9 117.7(5) 2_676 . . . ?
Dy2 Dy1 N1 C9 137.8(6) 2_676 . . . ?
Dy2 Dy1 N1 C9 -12.8(8) . . . . ?
O4 Dy1 N1 C1 117.7(5) . . . . ?
O5 Dy1 N1 C1 46.2(5) . . . . ?
O10 Dy1 N1 C1 -88.8(5) 2_676 . . . ?
O10 Dy1 N1 C1 -13.1(12) . . . . ?
O2 Dy1 N1 C1 -177.1(4) . . . . ?
O1 Dy1 N1 C1 -25.1(5) . . . . ?
N2 Dy1 N1 C1 -177.2(6) . . . . ?
Dy1 Dy1 N1 C1 -78.0(5) 2_676 . . . ?
Dy2 Dy1 N1 C1 -57.9(5) 2_676 . . . ?
Dy2 Dy1 N1 C1 151.5(4) . . . . ?
O4 Dy1 N2 C10 81.7(6) . . . . ?
O5 Dy1 N2 C10 40.5(6) . . . . ?
O10 Dy1 N2 C10 -122.2(6) 2_676 . . . ?
O10 Dy1 N2 C10 164.8(5) . . . . ?
O2 Dy1 N2 C10 160.9(6) . . . . ?
O1 Dy1 N2 C10 -48.8(6) . . . . ?
N1 Dy1 N2 C10 -19.2(5) . . . . ?
Dy1 Dy1 N2 C10 -153.7(5) 2_676 . . . ?
Dy2 Dy1 N2 C10 -86.8(6) 2_676 . . . ?
Dy2 Dy1 N2 C10 147.3(5) . . . . ?
O4 Dy1 N2 N3 -72.5(5) . . . . ?
O5 Dy1 N2 N3 -113.8(5) . . . . ?
O10 Dy1 N2 N3 83.5(5) 2_676 . . . ?
O10 Dy1 N2 N3 10.5(6) . . . . ?
O2 Dy1 N2 N3 6.6(4) . . . . ?
O1 Dy1 N2 N3 157.0(4) . . . . ?
N1 Dy1 N2 N3 -173.5(6) . . . . ?
Dy1 Dy1 N2 N3 52.1(5) 2_676 . . . ?
Dy2 Dy1 N2 N3 118.9(5) 2_676 . . . ?
Dy2 Dy1 N2 N3 -6.9(5) . . . . ?
C10 N2 N3 C11 -160.8(6) . . . . ?
Dy1 N2 N3 C11 -5.5(7) . . . . ?
O6 Dy2 N4 C12 81.5(6) . . . . ?
O7 Dy2 N4 C12 66.2(6) . . . . ?
O8 Dy2 N4 C12 165.4(6) . . . . ?
O1 Dy2 N4 C12 -101.1(6) 2_676 . . . ?
O9 Dy2 N4 C12 -164.0(5) . . . . ?
O2 Dy2 N4 C12 -19.4(5) . . . . ?
O10 Dy2 N4 C12 -39.5(6) . . . . ?
Dy1 Dy2 N4 C12 -74.4(6) 2_676 . . . ?
Dy1 Dy2 N4 C12 -14.2(6) . . . . ?
O6 Dy2 N4 O3 -78.8(5) . . . . ?
O7 Dy2 N4 O3 -94.2(6) . . . . ?
O8 Dy2 N4 O3 5.1(5) . . . . ?
O1 Dy2 N4 O3 98.5(5) 2_676 . . . ?
O9 Dy2 N4 O3 35.6(6) . . . . ?
O2 Dy2 N4 O3 -179.8(6) . . . . ?
O10 Dy2 N4 O3 160.1(5) . . . . ?
Dy1 Dy2 N4 O3 125.2(5) 2_676 . . . ?
Dy1 Dy2 N4 O3 -174.5(5) . . . . ?
C9 N1 C1 C6 4.8(11) . . . . ?
Dy1 N1 C1 C6 -160.1(6) . . . . ?
C9 N1 C1 C2 -174.2(7) . . . . ?
Dy1 N1 C1 C2 20.9(8) . . . . ?
Dy2 O1 C2 C3 -73.6(9) 2_676 . . . ?
Dy1 O1 C2 C3 153.0(6) . . . . ?
Dy2 O1 C2 C1 104.8(6) 2_676 . . . ?
Dy1 O1 C2 C1 -28.5(8) . . . . ?
N1 C1 C2 O1 4.9(10) . . . . ?
C6 C1 C2 O1 -174.2(6) . . . . ?
N1 C1 C2 C3 -176.5(6) . . . . ?
C6 C1 C2 C3 4.4(11) . . . . ?
O1 C2 C3 C4 176.7(7) . . . . ?
C1 C2 C3 C4 -1.8(11) . . . . ?
C2 C3 C4 C5 -1.1(13) . . . . ?
C3 C4 C5 C6 1.5(13) . . . . ?
C4 C5 C6 C1 1.1(12) . . . . ?
C4 C5 C6 C7 -179.6(8) . . . . ?
N1 C1 C6 C5 176.9(7) . . . . ?
C2 C1 C6 C5 -4.1(11) . . . . ?
N1 C1 C6 C7 -2.5(11) . . . . ?
C2 C1 C6 C7 176.5(7) . . . . ?
C5 C6 C7 C8 179.1(8) . . . . ?
C1 C6 C7 C8 -1.6(11) . . . . ?
C6 C7 C8 C9 3.1(12) . . . . ?
C1 N1 C9 C8 -3.1(11) . . . . ?
Dy1 N1 C9 C8 160.7(6) . . . . ?
C1 N1 C9 C10 179.4(6) . . . . ?
Dy1 N1 C9 C10 -16.8(9) . . . . ?
C7 C8 C9 N1 -0.8(12) . . . . ?
C7 C8 C9 C10 176.5(7) . . . . ?
N3 N2 C10 C9 174.3(6) . . . . ?
Dy1 N2 C10 C9 19.0(9) . . . . ?
N1 C9 C10 N2 -2.1(10) . . . . ?
C8 C9 C10 N2 -179.6(7) . . . . ?
Dy2 O2 C11 N3 153.0(6) . . . . ?
Dy1 O2 C11 N3 7.9(10) . . . . ?
Dy2 O2 C11 C12 -24.5(8) . . . . ?
Dy1 O2 C11 C12 -169.6(4) . . . . ?
N2 N3 C11 O2 -1.3(10) . . . . ?
N2 N3 C11 C12 176.3(6) . . . . ?
O3 N4 C12 C11 176.5(6) . . . . ?
Dy2 N4 C12 C11 15.0(8) . . . . ?
O3 N4 C12 C13 1.5(11) . . . . ?
Dy2 N4 C12 C13 -160.1(6) . . . . ?
O2 C11 C12 N4 4.4(9) . . . . ?
N3 C11 C12 N4 -173.4(7) . . . . ?
O2 C11 C12 C13 179.7(7) . . . . ?
N3 C11 C12 C13 1.9(10) . . . . ?
C19 C14 C15 C16 -2.8(12) . . . . ?
C14 C15 C16 C17 1.5(13) . . . . ?
C15 C16 C17 C18 0.6(13) . . . . ?
C16 C17 C18 C19 -1.4(12) . . . . ?
C15 C14 C19 C18 2.0(11) . . . . ?
C15 C14 C19 C20 -176.8(7) . . . . ?
C17 C18 C19 C14 0.1(11) . . . . ?
C17 C18 C19 C20 178.8(7) . . . . ?
Dy1 O4 C20 C21 -11.5(11) . . . . ?
Dy1 O4 C20 C19 164.4(5) . . . . ?
C14 C19 C20 O4 -13.9(10) . . . . ?
C18 C19 C20 O4 167.4(7) . . . . ?
C14 C19 C20 C21 162.1(7) . . . . ?
C18 C19 C20 C21 -16.6(11) . . . . ?
O4 C20 C21 C22 3.7(11) . . . . ?
C19 C20 C21 C22 -172.1(7) . . . . ?
Dy1 O5 C22 C21 6.5(12) . . . . ?
Dy1 O5 C22 C23 -170.5(5) . . . . ?
C20 C21 C22 O5 -1.8(12) . . . . ?
C20 C21 C22 C23 175.2(7) . . . . ?
O5 C22 C23 C28 48.0(10) . . . . ?
C21 C22 C23 C28 -129.2(8) . . . . ?
O5 C22 C23 C24 -133.8(8) . . . . ?
C21 C22 C23 C24 48.9(10) . . . . ?
C28 C23 C24 C25 -1.8(12) . . . . ?
C22 C23 C24 C25 -180.0(8) . . . . ?
C23 C24 C25 C26 2.1(13) . . . . ?
C24 C25 C26 C27 -0.2(14) . . . . ?
C25 C26 C27 C28 -1.8(15) . . . . ?
C26 C27 C28 C23 2.1(15) . . . . ?
C24 C23 C28 C27 -0.3(13) . . . . ?
C22 C23 C28 C27 177.9(8) . . . . ?
C34 C29 C30 C31 -1.1(13) . . . . ?
C29 C30 C31 C32 0.1(13) . . . . ?
C30 C31 C32 C33 0.1(13) . . . . ?
C31 C32 C33 C34 0.6(13) . . . . ?
C32 C33 C34 C29 -1.6(13) . . . . ?
C32 C33 C34 C35 179.9(8) . . . . ?
C30 C29 C34 C33 1.8(12) . . . . ?
C30 C29 C34 C35 -179.6(8) . . . . ?
Dy2 O6 C35 C36 10.6(13) . . . . ?
Dy2 O6 C35 C34 -168.8(5) . . . . ?
C33 C34 C35 O6 179.4(8) . . . . ?
C29 C34 C35 O6 0.8(10) . . . . ?
C33 C34 C35 C36 0.0(12) . . . . ?
C29 C34 C35 C36 -178.5(8) . . . . ?
O6 C35 C36 C37 -1.1(13) . . . . ?
C34 C35 C36 C37 178.2(7) . . . . ?
Dy2 O7 C37 C36 -12.5(12) . . . . ?
Dy2 O7 C37 C38 165.1(5) . . . . ?
C35 C36 C37 O7 2.2(12) . . . . ?
C35 C36 C37 C38 -175.4(7) . . . . ?
O7 C37 C38 C43 -177.7(7) . . . . ?
C36 C37 C38 C43 0.1(12) . . . . ?
O7 C37 C38 C39 0.4(10) . . . . ?
C36 C37 C38 C39 178.2(7) . . . . ?
C43 C38 C39 C40 -0.1(13) . . . . ?
C37 C38 C39 C40 -178.3(8) . . . . ?
C38 C39 C40 C41 0.2(14) . . . . ?
C39 C40 C41 C42 -0.4(14) . . . . ?
C40 C41 C42 C43 0.5(13) . . . . ?
C39 C38 C43 C42 0.2(12) . . . . ?
C37 C38 C43 C42 178.3(7) . . . . ?
C41 C42 C43 C38 -0.4(13) . . . . ?
C49 C44 C45 C46 0.4(12) . . . . ?
C44 C45 C46 C47 -0.9(12) . . . . ?
C45 C46 C47 C48 0.3(12) . . . . ?
C46 C47 C48 C49 0.7(12) . . . . ?
C47 C48 C49 C44 -1.1(12) . . . . ?
C47 C48 C49 C50 177.8(7) . . . . ?
C45 C44 C49 C48 0.5(11) . . . . ?
C45 C44 C49 C50 -178.4(7) . . . . ?
Dy2 O8 C50 C51 -6.0(11) . . . . ?
Dy2 O8 C50 C49 172.4(5) . . . . ?
C48 C49 C50 O8 155.3(7) . . . . ?
C44 C49 C50 O8 -25.9(10) . . . . ?
C48 C49 C50 C51 -26.3(11) . . . . ?
C44 C49 C50 C51 152.5(7) . . . . ?
O8 C50 C51 C52 3.8(12) . . . . ?
C49 C50 C51 C52 -174.5(7) . . . . ?
Dy2 O9 C52 C51 -8.2(12) . . . . ?
Dy2 O9 C52 C53 173.4(5) . . . . ?
C50 C51 C52 O9 2.9(12) . . . . ?
C50 C51 C52 C53 -178.8(7) . . . . ?
O9 C52 C53 C58 23.0(10) . . . . ?
C51 C52 C53 C58 -155.5(7) . . . . ?
O9 C52 C53 C54 -155.9(7) . . . . ?
C51 C52 C53 C54 25.7(11) . . . . ?
C58 C53 C54 C55 -1.1(12) . . . . ?
C52 C53 C54 C55 177.7(7) . . . . ?
C53 C54 C55 C56 1.4(12) . . . . ?
C54 C55 C56 C57 -0.5(13) . . . . ?
C55 C56 C57 C58 -0.6(13) . . . . ?
C54 C53 C58 C57 0.0(12) . . . . ?
C52 C53 C58 C57 -178.8(7) . . . . ?
C56 C57 C58 C53 0.8(13) . . . . ?

loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_site_symmetry_A
O3 H3 O8 0.84 2.05 2.733(8) 137.7 .

_diffrn_measured_fraction_theta_max 0.995
_diffrn_reflns_theta_full        25.01
_diffrn_measured_fraction_theta_full 0.995
_refine_diff_density_max         2.985
_refine_diff_density_min         -2.157
_refine_diff_density_rms         0.359
####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_m20151218h1
_database_code_depnum_ccdc_archive 'CCDC 1824967'
_audit_update_record             
;
2018-02-21 deposited with the CCDC.
2018-05-03 downloaded from the CCDC.
;
_audit_creation_date             2018-02-21
_audit_creation_method           
;
Olex2 1.2
(compiled 2017.08.10 svn.r3458 for OlexSys, GUI svn.r5381)
;
_shelx_SHELXL_version_number     2016/6
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C72 H42 Dy4 F48 N10 O24, 0.5(C14)'
_chemical_formula_sum            'C79 H42 Dy4 F48 N10 O24'
_chemical_formula_weight         3077.22
_chemical_melting_point          ?
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'

_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.
;
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 1 21/c 1'
_space_group_name_Hall           '-P 2ybc'
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'

_cell_length_a                   17.7920(18)
_cell_length_b                   17.7736(16)
_cell_length_c                   17.3809(17)
_cell_angle_alpha                90
_cell_angle_beta                 103.707(3)
_cell_angle_gamma                90
_cell_volume                     5339.8(9)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    17302
_cell_measurement_temperature    113(2)
_cell_measurement_theta_max      27.1
_cell_measurement_theta_min      3.1
_shelx_estimated_absorpt_T_max   0.721
_shelx_estimated_absorpt_T_min   0.593
_exptl_absorpt_coefficient_mu    2.921
_exptl_absorpt_correction_T_max  0.8337
_exptl_absorpt_correction_T_min  0.7418
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   ?
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            Colorless
_exptl_crystal_density_diffrn    1.914
_exptl_crystal_density_meas      .
_exptl_crystal_density_method    "'not measured'"
_exptl_crystal_description       Prism
_exptl_crystal_F_000             2948
_exptl_crystal_size_max          0.2
_exptl_crystal_size_mid          0.18
_exptl_crystal_size_min          0.12
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0199
_diffrn_reflns_av_unetI/netI     0.0159
_diffrn_reflns_Laue_measured_fraction_full 0.996
_diffrn_reflns_Laue_measured_fraction_max 0.994
_diffrn_reflns_limit_h_max       23
_diffrn_reflns_limit_h_min       -23
_diffrn_reflns_limit_k_max       22
_diffrn_reflns_limit_k_min       -23
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_number            53554
_diffrn_reflns_point_group_measured_fraction_full 0.996
_diffrn_reflns_point_group_measured_fraction_max 0.994
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         27.508
_diffrn_reflns_theta_min         3.110
_diffrn_ambient_temperature      113.15
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.996
_diffrn_measured_fraction_theta_max 0.994
_diffrn_measurement_device_type  'Bruker P4'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   ?
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                10873
_reflns_number_total             12205
_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       ?
_computing_data_collection       ?
_computing_data_reduction        ?
_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    ?
_refine_diff_density_max         1.289
_refine_diff_density_min         -0.755
_refine_diff_density_rms         0.083
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.024
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     887
_refine_ls_number_reflns         12205
_refine_ls_number_restraints     366
_refine_ls_R_factor_all          0.0294
_refine_ls_R_factor_gt           0.0248
_refine_ls_restrained_S_all      1.079
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0322P)²+8.3207P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0633
_refine_ls_wR_factor_ref         0.0655
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups
 At 1.5 times of:
  All C(H,H,H) groups, All O(H) groups
2. Restrained distances
 F5'-F6'
 2.1 with sigma of 0.01
 C33-F22 = C33-F23 = C33-F24 = C33-F22' = C33-F23' = C33-F24'
 1.36 with sigma of 0.01
 C18-F4 = C18-F5 = C18-F6 = C18-F4' = C18-F5'
 1.36 with sigma of 0.01
 C14-F1 = C14-F2 = C14-F3 = C14-F1' = C14-F2' = C14-F3'
 1.36 with sigma of 0.01
 C29-F19 = C29-F20 = C29-F21 = C29-F19' = C29-F20' = C29-F21'
 1.36 with sigma of 0.01
 C37-C38 = C38-C39 = C39-C40 = C40-C41 = C41-C42 = C42-C43
 1.54 with sigma of 0.01
 C37-C39 = C38-C40 = C39-C41 = C40-C42 = C41-C43
 2.5 with sigma of 0.02
3. Rigid bond restraints
 O12, C34
 with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.02
4. Uiso/Uaniso restraints and constraints
C37 \\sim C38 \\sim C39 \\sim C40 \\sim C41 \\sim C42 \\sim C43: within 1.7A
with sigma of 0.01 and sigma for terminal atoms of 0.02
F19 \\sim F20 \\sim F21 \\sim F19' \\sim F20' \\sim F21': within 1.7A with
sigma of 0.01 and sigma for terminal atoms of 0.02
F22 \\sim F23 \\sim F24 \\sim F22' \\sim F23' \\sim F24': within 1.7A with
sigma of 0.01 and sigma for terminal atoms of 0.02
Uanis(C37) \\sim Ueq, Uanis(C38) \\sim Ueq, Uanis(C39) \\sim Ueq, Uanis(C40)
\\sim Ueq, Uanis(C41) \\sim Ueq, Uanis(C42) \\sim Ueq, Uanis(C43) \\sim Ueq:
with sigma of 0.01 and sigma for terminal atoms of 0.02
Uanis(C35) \\sim Ueq, Uanis(C36) \\sim Ueq: with sigma of 0.01 and sigma for
terminal atoms of 0.02
Uanis(F22) \\sim Ueq, Uanis(F23) \\sim Ueq, Uanis(F24) \\sim Ueq, Uanis(F22')
\\sim Ueq, Uanis(F23') \\sim Ueq, Uanis(F24') \\sim Ueq, Uanis(F1) \\sim Ueq,
Uanis(F2) \\sim Ueq, Uanis(F3) \\sim Ueq, Uanis(F1') \\sim Ueq, Uanis(F2')
\\sim Ueq, Uanis(F3') \\sim Ueq, Uanis(F4) \\sim Ueq, Uanis(F5) \\sim Ueq,
Uanis(F6) \\sim Ueq, Uanis(F4') \\sim Ueq, Uanis(F5') \\sim Ueq, Uanis(F6')
\\sim Ueq, Uanis(F7) \\sim Ueq, Uanis(F8) \\sim Ueq, Uanis(F9) \\sim Ueq,
Uanis(F10) \\sim Ueq, Uanis(F11) \\sim Ueq, Uanis(F12) \\sim Ueq, Uanis(F13)
\\sim Ueq, Uanis(F14) \\sim Ueq, Uanis(F15) \\sim Ueq, Uanis(F16) \\sim Ueq,
Uanis(F17) \\sim Ueq, Uanis(F18) \\sim Ueq, Uanis(F19) \\sim Ueq, Uanis(F20)
\\sim Ueq, Uanis(F21) \\sim Ueq: with sigma of 0.01 and sigma for terminal
atoms of 0.02
Uanis(F20') \\sim Ueq: with sigma of 0.01 and sigma for terminal atoms of 0.02
5. Others
 Fixed Sof: F1(0.5) F2(0.5) F3(0.5) F1'(0.5) F2'(0.5) F3'(0.5) F4(0.5) F5(0.5)
 F6(0.5) F4'(0.5) F5'(0.5) F6'(0.5) F19(0.5) F20(0.5) F21(0.5) F22(0.5)
 F23(0.5) F24(0.5) F19'(0.5) F20'(0.5) F21'(0.5) F22'(0.5) F23'(0.5) F24'(0.5)
 C37(0.5) C38(0.5) C39(0.5) C40(0.5) C41(0.5) C42(0.5) C43(0.5)
6.a Aromatic/amide H refined with riding coordinates:
 C3(H3A), C4(H4), C5(H5), C7(H7), C8(H8), C10(H10), C16(H16), C21(H21),
 C26(H26), C31(H31), C34(H34)
6.b Idealised Me refined as rotating group:
 C13(H13A,H13B,H13C), C35(H35A,H35B,H35C), C36(H36A,H36B,H36C)
6.c Idealised tetrahedral OH refined as rotating group:
 O3(H3)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
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 0.42785(2) 0.50008(2) 0.06684(2) 0.02369(4) Uani 1 1 d . . . . .
Dy2 Dy 0.20029(2) 0.37814(2) 0.23738(2) 0.02804(4) Uani 1 1 d . . . . .
F1 F 0.2776(7) 0.6702(4) -0.1229(4) 0.112(3) Uani 0.5 1 d D U P A 1
F2 F 0.3559(6) 0.7545(5) -0.0819(5) 0.112(4) Uani 0.5 1 d D U P A 1
F3 F 0.2462(5) 0.7571(5) -0.0479(5) 0.096(3) Uani 0.5 1 d D U P A 1
F1' F 0.2390(4) 0.6750(5) -0.0865(5) 0.100(3) Uani 0.5 1 d D U P A 2
F2' F 0.3404(4) 0.7210(8) -0.1099(5) 0.121(4) Uani 0.5 1 d D U P A 2
F3' F 0.2901(7) 0.7801(4) -0.0369(6) 0.115(4) Uani 0.5 1 d D U P A 2
F4 F 0.3795(10) 0.7527(5) 0.2406(8) 0.095(5) Uani 0.5 1 d D U P B 3
F5 F 0.2893(6) 0.6741(9) 0.2368(11) 0.104(5) Uani 0.5 1 d D U P B 3
F6 F 0.4090(7) 0.6488(7) 0.2968(7) 0.100(4) Uani 0.5 1 d D U P B 3
F4' F 0.3996(8) 0.7424(6) 0.2611(8) 0.075(3) Uani 0.5 1 d D U P B 4
F5' F 0.2879(5) 0.6974(9) 0.2319(9) 0.086(4) Uani 0.5 1 d D U P B 4
F6' F 0.3790(6) 0.6307(6) 0.2928(7) 0.069(3) Uani 0.5 1 d D U P B 4
F7 F 0.11446(17) 0.64578(15) 0.20427(15) 0.0757(8) Uani 1 1 d . U . . .
F8 F 0.1360(2) 0.67871(15) 0.32557(17) 0.0987(11) Uani 1 1 d . U . . .
F9 F 0.04506(17) 0.60163(18) 0.2773(2) 0.0963(10) Uani 1 1 d . U . . .
F10 F 0.42210(14) 0.48772(16) 0.42790(15) 0.0694(7) Uani 1 1 d . U . . .
F11 F 0.35096(15) 0.46351(12) 0.50914(12) 0.0620(6) Uani 1 1 d . U . . .
F12 F 0.36803(14) 0.57782(12) 0.47679(12) 0.0581(6) Uani 1 1 d . U . . .
F13 F -0.08566(15) 0.3486(2) 0.1505(2) 0.1108(14) Uani 1 1 d . U . . .
F14 F -0.07241(16) 0.43236(17) 0.2403(3) 0.1329(17) Uani 1 1 d . U . . .
F15 F -0.11282(12) 0.32259(15) 0.26079(17) 0.0705(7) Uani 1 1 d . U . . .
F16 F 0.1828(2) 0.2246(3) 0.47799(19) 0.1261(15) Uani 1 1 d . U . . .
F17 F 0.07368(16) 0.17637(17) 0.43318(17) 0.0838(9) Uani 1 1 d . U . . .
F18 F 0.1703(2) 0.14755(19) 0.3854(2) 0.1117(13) Uani 1 1 d . U . . .
F19 F 0.4542(5) 0.2563(5) 0.2803(6) 0.092(4) Uani 0.5 1 d D U P C 1
F20 F 0.4069(9) 0.1753(7) 0.3418(6) 0.127(5) Uani 0.5 1 d D U P C 1
F21 F 0.4132(9) 0.1453(5) 0.2228(6) 0.099(4) Uani 0.5 1 d D U P C 1
F22 F 0.1712(10) 0.0960(7) 0.0768(9) 0.118(4) Uani 0.5 1 d D U P D 1
F23 F 0.1034(9) 0.1143(8) 0.1578(9) 0.119(5) Uani 0.5 1 d D U P D 1
F24 F 0.0665(5) 0.1780(7) 0.0732(7) 0.088(4) Uani 0.5 1 d D U P D 1
F19' F 0.4479(5) 0.2495(5) 0.2379(5) 0.072(2) Uani 0.5 1 d D U P C 2
F20' F 0.4217(7) 0.2013(7) 0.3489(4) 0.103(4) Uani 0.5 1 d D U P C 2
F21' F 0.4184(7) 0.1348(4) 0.2498(5) 0.062(2) Uani 0.5 1 d D U P C 2
F22' F 0.1694(11) 0.1189(8) 0.0518(9) 0.144(6) Uani 0.5 1 d D U P D 2
F23' F 0.1180(9) 0.0952(8) 0.1487(9) 0.118(5) Uani 0.5 1 d D U P D 2
F24' F 0.0897(6) 0.1822(7) 0.0439(6) 0.097(4) Uani 0.5 1 d D U P D 2
O1 O 0.55798(11) 0.51587(12) 0.06416(11) 0.0294(4) Uani 1 1 d . . . . .
O2 O 0.29340(11) 0.49825(11) 0.04308(11) 0.0285(4) Uani 1 1 d . . . . .
O3 O 0.05416(12) 0.43456(15) 0.07839(14) 0.0456(6) Uani 1 1 d . . . . .
H3 H 0.034152 0.420282 0.115088 0.068 Uiso 1 1 calc GR . . . .
O4 O 0.38969(12) 0.61554(12) -0.00015(12) 0.0344(4) Uani 1 1 d . . . . .
O5 O 0.41800(12) 0.59512(11) 0.16182(11) 0.0303(4) Uani 1 1 d . . . . .
O6 O 0.15192(13) 0.49872(12) 0.25315(14) 0.0412(5) Uani 1 1 d . . . . .
O7 O 0.28235(12) 0.43515(12) 0.34675(12) 0.0350(5) Uani 1 1 d . . . . .
O8 O 0.06532(13) 0.37100(14) 0.22503(16) 0.0461(6) Uani 1 1 d . . . . .
O9 O 0.17647(13) 0.29591(13) 0.33625(13) 0.0415(5) Uani 1 1 d . . . . .
O10 O 0.30662(11) 0.29604(12) 0.26014(13) 0.0348(5) Uani 1 1 d . . . . .
O11 O 0.16240(13) 0.27132(12) 0.16034(14) 0.0436(6) Uani 1 1 d . . . . .
O12 O 0.41804(12) 0.37008(11) 0.04834(13) 0.0354(5) Uani 1 1 d . U . . .
N1 N 0.51752(12) 0.45947(12) 0.19037(13) 0.0236(4) Uani 1 1 d . . . . .
N2 N 0.36734(12) 0.44492(12) 0.17394(13) 0.0234(4) Uani 1 1 d . . . . .
N3 N 0.28701(12) 0.43928(13) 0.16013(13) 0.0243(4) Uani 1 1 d . . . . .
N4 N 0.13363(12) 0.43273(14) 0.10411(14) 0.0299(5) Uani 1 1 d . . . . .
N5 N 0.42899(16) 0.24612(16) 0.02709(19) 0.0466(7) Uani 1 1 d . . . . .
C1 C 0.59408(15) 0.47132(15) 0.19656(16) 0.0257(5) Uani 1 1 d . . . . .
C2 C 0.61490(16) 0.50362(16) 0.12951(16) 0.0292(6) Uani 1 1 d . . . . .
C3 C 0.69139(17) 0.5216(2) 0.13588(18) 0.0378(7) Uani 1 1 d . . . . .
H3A H 0.706351 0.545413 0.092897 0.045 Uiso 1 1 calc R . . . .
C4 C 0.74780(17) 0.5049(2) 0.20583(19) 0.0419(8) Uani 1 1 d . . . . .
H4 H 0.800384 0.516937 0.208512 0.050 Uiso 1 1 calc R . . . .
C5 C 0.72893(16) 0.4721(2) 0.26963(18) 0.0372(7) Uani 1 1 d . . . . .
H5 H 0.768158 0.460563 0.315575 0.045 Uiso 1 1 calc R . . . .
C6 C 0.65078(15) 0.45517(16) 0.26707(16) 0.0297(6) Uani 1 1 d . . . . .
C7 C 0.62366(16) 0.42414(17) 0.33024(17) 0.0337(6) Uani 1 1 d . . . . .
H7 H 0.659536 0.410750 0.378024 0.040 Uiso 1 1 calc R . . . .
C8 C 0.54636(16) 0.41318(17) 0.32333(17) 0.0322(6) Uani 1 1 d . . . . .
H8 H 0.528271 0.392918 0.366217 0.039 Uiso 1 1 calc R . . . .
C9 C 0.49363(15) 0.43237(15) 0.25159(15) 0.0253(5) Uani 1 1 d . . . . .
C10 C 0.40955(15) 0.42471(15) 0.24109(16) 0.0261(5) Uani 1 1 d . . . . .
H10 H 0.387658 0.405740 0.282004 0.031 Uiso 1 1 calc R . . . .
C11 C 0.25621(14) 0.46923(15) 0.08883(15) 0.0243(5) Uani 1 1 d . . . . .
C12 C 0.17018(15) 0.46954(16) 0.06109(16) 0.0283(6) Uani 1 1 d . . . . .
C13 C 0.13279(18) 0.5130(2) -0.0114(2) 0.0419(8) Uani 1 1 d . . . . .
H13A H 0.095791 0.480612 -0.047425 0.063 Uiso 1 1 calc GR . . . .
H13B H 0.172464 0.530282 -0.037970 0.063 Uiso 1 1 calc GR . . . .
H13C H 0.105578 0.556489 0.003554 0.063 Uiso 1 1 calc GR . . . .
C14 C 0.3027(3) 0.7109(2) -0.0576(2) 0.0667(12) Uani 1 1 d D . . . .
C15 C 0.3473(2) 0.66683(19) 0.0152(2) 0.0435(8) Uani 1 1 d . . . . .
C16 C 0.3360(2) 0.6877(2) 0.0880(2) 0.0537(9) Uani 1 1 d . . . . .
H16 H 0.301691 0.727867 0.091543 0.064 Uiso 1 1 calc R . . . .
C17 C 0.3745(2) 0.65018(17) 0.15671(19) 0.0375(7) Uani 1 1 d . . . . .
C18 C 0.3612(2) 0.68044(19) 0.2345(2) 0.0530(9) Uani 1 1 d D . . . .
C19 C 0.1164(3) 0.6217(2) 0.2770(2) 0.0575(10) Uani 1 1 d . . . . .
C20 C 0.1717(2) 0.55370(19) 0.2977(2) 0.0408(7) Uani 1 1 d . . . . .
C21 C 0.2361(2) 0.55886(19) 0.36090(19) 0.0423(7) Uani 1 1 d . . . . .
H21 H 0.245569 0.603701 0.391419 0.051 Uiso 1 1 calc R . . . .
C22 C 0.28643(19) 0.49893(17) 0.37928(18) 0.0363(7) Uani 1 1 d . . . . .
C23 C 0.3576(2) 0.5077(2) 0.4486(2) 0.0477(9) Uani 1 1 d . . . . .
C24 C -0.0644(2) 0.3598(3) 0.2269(4) 0.0703(14) Uani 1 1 d . . . . .
C25 C 0.02076(18) 0.33724(19) 0.2595(2) 0.0444(8) Uani 1 1 d . . . . .
C26 C 0.0408(2) 0.2848(2) 0.3197(2) 0.0468(8) Uani 1 1 d . . . . .
H26 H 0.001342 0.260737 0.339211 0.056 Uiso 1 1 calc R . . . .
C27 C 0.1175(2) 0.26680(19) 0.3517(2) 0.0418(7) Uani 1 1 d . . . . .
C28 C 0.1353(3) 0.2023(3) 0.4118(3) 0.0635(11) Uani 1 1 d . . . . .
C29 C 0.4012(2) 0.2026(2) 0.2696(3) 0.0762(16) Uani 1 1 d D . . . .
C30 C 0.31817(18) 0.23122(18) 0.2376(2) 0.0444(8) Uani 1 1 d . . . . .
C31 C 0.2664(2) 0.18429(19) 0.1886(3) 0.0566(10) Uani 1 1 d . . . . .
H31 H 0.281997 0.135087 0.177741 0.068 Uiso 1 1 calc R . . . .
C32 C 0.1909(2) 0.20861(19) 0.1548(2) 0.0506(9) Uani 1 1 d . . . . .
C33 C 0.1364(3) 0.1506(2) 0.1064(3) 0.088(2) Uani 1 1 d D . . . .
C34 C 0.4567(2) 0.3126(2) 0.0514(3) 0.0566(10) Uani 1 1 d . U . . .
H34 H 0.510853 0.316492 0.073001 0.068 Uiso 1 1 calc R . . . .
C35 C 0.3510(3) 0.2329(3) -0.0052(4) 0.104(2) Uani 1 1 d . U . . .
H35A H 0.323583 0.281013 -0.015871 0.156 Uiso 1 1 calc GR . . . .
H35B H 0.329360 0.203566 0.032142 0.156 Uiso 1 1 calc GR . . . .
H35C H 0.344919 0.204769 -0.054841 0.156 Uiso 1 1 calc GR . . . .
C36 C 0.4791(3) 0.1790(3) 0.0354(5) 0.120(3) Uani 1 1 d . U . . .
H36A H 0.532422 0.193257 0.060938 0.180 Uiso 1 1 calc GR . . . .
H36B H 0.477442 0.157942 -0.017081 0.180 Uiso 1 1 calc GR . . . .
H36C H 0.460841 0.141327 0.067867 0.180 Uiso 1 1 calc GR . . . .
C37 C 0.1153(9) 0.7666(7) 0.0375(10) 0.127(5) Uani 0.5 1 d D U P . .
C38 C 0.1580(6) 0.8397(6) 0.0586(7) 0.101(3) Uani 0.5 1 d D U P . .
C39 C 0.1198(6) 0.9052(6) 0.0128(6) 0.081(3) Uani 0.5 1 d D U P . .
C40 C 0.0554(5) 0.9336(5) 0.0513(5) 0.065(2) Uani 0.5 1 d D U P . .
C41 C 0.0140(6) 0.9958(8) -0.0058(8) 0.074(3) Uani 0.5 1 d D U P . .
C42 C -0.0515(6) 1.0328(7) 0.0241(7) 0.101(3) Uani 0.5 1 d D U P . .
C43 C -0.0924(10) 1.0960(9) -0.0337(11) 0.131(5) Uani 0.5 1 d D U P . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Dy1 Dy1 3.8494(4) 3_665 ?
Dy1 O1 2.3437(19) . ?
Dy1 O1 2.3665(19) 3_665 ?
Dy1 O2 2.3294(19) . ?
Dy1 O4 2.378(2) . ?
Dy1 O5 2.3972(19) . ?
Dy1 O12 2.334(2) . ?
Dy1 N1 2.460(2) . ?
Dy1 N2 2.556(2) . ?
Dy2 O6 2.349(2) . ?
Dy2 O7 2.336(2) . ?
Dy2 O8 2.363(2) . ?
Dy2 O9 2.369(2) . ?
Dy2 O10 2.347(2) . ?
Dy2 O11 2.329(2) . ?
Dy2 N3 2.519(2) . ?
Dy2 N4 2.532(2) . ?
F1 C14 1.330(7) . ?
F2 C14 1.366(8) . ?
F3 C14 1.341(7) . ?
F1' C14 1.294(6) . ?
F2' C14 1.264(7) . ?
F3' C14 1.316(7) . ?
F4 C18 1.323(8) . ?
F5 C18 1.294(8) . ?
F6 C18 1.333(8) . ?
F4' C18 1.321(8) . ?
F5' C18 1.327(8) . ?
F6' C18 1.326(10) . ?
F7 C19 1.327(5) . ?
F8 C19 1.313(5) . ?
F9 C19 1.319(5) . ?
F10 C23 1.330(5) . ?
F11 C23 1.341(4) . ?
F12 C23 1.336(4) . ?
F13 C24 1.307(7) . ?
F14 C24 1.324(6) . ?
F15 C24 1.329(4) . ?
F16 C28 1.317(6) . ?
F17 C28 1.321(5) . ?
F18 C28 1.297(6) . ?
F19 C29 1.323(7) . ?
F20 C29 1.327(9) . ?
F21 C29 1.352(8) . ?
F22 C33 1.320(9) . ?
F23 C33 1.344(9) . ?
F24 C33 1.333(8) . ?
F19' C29 1.382(8) . ?
F20' C29 1.340(8) . ?
F21' C29 1.310(8) . ?
F22' C33 1.352(9) . ?
F23' C33 1.316(9) . ?
F24' C33 1.326(8) . ?
O1 C2 1.348(3) . ?
O2 C11 1.259(3) . ?
O3 H3 0.8400 . ?
O3 N4 1.379(3) . ?
O4 C15 1.251(4) . ?
O5 C17 1.237(4) . ?
O6 C20 1.245(4) . ?
O7 C22 1.261(4) . ?
O8 C25 1.254(4) . ?
O9 C27 1.255(4) . ?
O10 C30 1.250(4) . ?
O11 C32 1.238(4) . ?
O12 C34 1.226(4) . ?
N1 C1 1.357(3) . ?
N1 C9 1.326(3) . ?
N2 N3 1.396(3) . ?
N2 C10 1.281(3) . ?
N3 C11 1.341(3) . ?
N4 C12 1.281(4) . ?
N5 C34 1.311(5) . ?
N5 C35 1.389(5) . ?
N5 C36 1.476(6) . ?
C1 C2 1.425(4) . ?
C1 C6 1.420(4) . ?
C2 C3 1.377(4) . ?
C3 H3A 0.9500 . ?
C3 C4 1.412(4) . ?
C4 H4 0.9500 . ?
C4 C5 1.364(5) . ?
C5 H5 0.9500 . ?
C5 C6 1.413(4) . ?
C6 C7 1.412(4) . ?
C7 H7 0.9500 . ?
C7 C8 1.366(4) . ?
C8 H8 0.9500 . ?
C8 C9 1.413(4) . ?
C9 C10 1.470(4) . ?
C10 H10 0.9500 . ?
C11 C12 1.492(3) . ?
C12 C13 1.493(4) . ?
C13 H13A 0.9800 . ?
C13 H13B 0.9800 . ?
C13 H13C 0.9800 . ?
C14 C15 1.539(5) . ?
C15 C16 1.380(5) . ?
C16 H16 0.9500 . ?
C16 C17 1.397(5) . ?
C17 C18 1.525(5) . ?
C19 C20 1.546(5) . ?
C20 C21 1.390(5) . ?
C21 H21 0.9500 . ?
C21 C22 1.379(5) . ?
C22 C23 1.535(5) . ?
C24 C25 1.540(5) . ?
C25 C26 1.384(5) . ?
C26 H26 0.9500 . ?
C26 C27 1.384(5) . ?
C27 C28 1.532(5) . ?
C29 C30 1.536(5) . ?
C30 C31 1.377(5) . ?
C31 H31 0.9500 . ?
C31 C32 1.400(5) . ?
C32 C33 1.525(5) . ?
C34 H34 0.9500 . ?
C35 H35A 0.9800 . ?
C35 H35B 0.9800 . ?
C35 H35C 0.9800 . ?
C36 H36A 0.9800 . ?
C36 H36B 0.9800 . ?
C36 H36C 0.9800 . ?
C37 C38 1.506(9) . ?
C38 C39 1.481(9) . ?
C38 C43 1.619(17) 3_575 ?
C39 C40 1.542(8) . ?
C39 C42 1.655(16) 3_575 ?
C39 C43 0.67(2) 3_575 ?
C40 C41 1.551(9) . ?
C40 C41 1.806(17) 3_575 ?
C40 C42 1.427(17) 3_575 ?
C40 C43 0.947(18) 3_575 ?
C41 C41 0.598(18) 3_575 ?
C41 C42 0.952(17) 3_575 ?
C41 C42 1.531(9) . ?
C42 C43 1.567(9) . ?

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
_geom_angle_publ_flag
O1 Dy1 Dy1 35.39(5) . 3_665 ?
O1 Dy1 Dy1 35.00(4) 3_665 3_665 ?
O1 Dy1 O1 70.38(7) . 3_665 ?
O1 Dy1 O4 93.19(7) . . ?
O1 Dy1 O4 73.46(7) 3_665 . ?
O1 Dy1 O5 142.08(7) 3_665 . ?
O1 Dy1 O5 99.38(7) . . ?
O1 Dy1 N1 127.56(7) 3_665 . ?
O1 Dy1 N1 67.24(7) . . ?
O1 Dy1 N2 144.48(7) 3_665 . ?
O1 Dy1 N2 130.46(7) . . ?
O2 Dy1 Dy1 134.17(5) . 3_665 ?
O2 Dy1 O1 99.60(7) . 3_665 ?
O2 Dy1 O1 167.43(7) . . ?
O2 Dy1 O4 76.30(7) . . ?
O2 Dy1 O5 83.82(7) . . ?
O2 Dy1 O12 85.51(7) . . ?
O2 Dy1 N1 125.24(7) . . ?
O2 Dy1 N2 62.08(7) . . ?
O4 Dy1 Dy1 81.89(5) . 3_665 ?
O4 Dy1 O5 70.74(7) . . ?
O4 Dy1 N1 137.01(7) . . ?
O4 Dy1 N2 124.54(7) . . ?
O5 Dy1 Dy1 125.75(5) . 3_665 ?
O5 Dy1 N1 75.16(7) . . ?
O5 Dy1 N2 69.92(7) . . ?
O12 Dy1 Dy1 87.42(5) . 3_665 ?
O12 Dy1 O1 76.72(7) . 3_665 ?
O12 Dy1 O1 99.08(7) . . ?
O12 Dy1 O4 141.60(7) . . ?
O12 Dy1 O5 141.02(7) . . ?
O12 Dy1 N1 80.89(7) . . ?
O12 Dy1 N2 71.94(7) . . ?
N1 Dy1 Dy1 98.00(5) . 3_665 ?
N1 Dy1 N2 63.25(7) . . ?
N2 Dy1 Dy1 153.57(5) . 3_665 ?
O6 Dy2 O8 70.56(8) . . ?
O6 Dy2 O9 110.16(9) . . ?
O6 Dy2 N3 87.49(8) . . ?
O6 Dy2 N4 69.64(8) . . ?
O7 Dy2 O6 71.64(8) . . ?
O7 Dy2 O8 121.53(9) . . ?
O7 Dy2 O9 82.07(8) . . ?
O7 Dy2 O10 79.00(7) . . ?
O7 Dy2 N3 84.43(7) . . ?
O7 Dy2 N4 130.18(8) . . ?
O8 Dy2 O9 71.35(8) . . ?
O8 Dy2 N3 135.42(7) . . ?
O8 Dy2 N4 72.06(8) . . ?
O9 Dy2 N3 152.88(7) . . ?
O9 Dy2 N4 140.75(8) . . ?
O10 Dy2 O6 148.24(7) . . ?
O10 Dy2 O8 137.98(7) . . ?
O10 Dy2 O9 76.69(8) . . ?
O10 Dy2 N3 77.70(7) . . ?
O10 Dy2 N4 125.20(7) . . ?
O11 Dy2 O6 138.29(8) . . ?
O11 Dy2 O7 149.47(7) . . ?
O11 Dy2 O8 75.79(9) . . ?
O11 Dy2 O9 80.62(9) . . ?
O11 Dy2 O10 72.66(7) . . ?
O11 Dy2 N3 100.11(8) . . ?
O11 Dy2 N4 77.14(8) . . ?
N3 Dy2 N4 63.92(7) . . ?
Dy1 O1 Dy1 109.62(7) . 3_665 ?
C2 O1 Dy1 120.81(17) . . ?
C2 O1 Dy1 124.14(17) . 3_665 ?
C11 O2 Dy1 124.40(16) . . ?
N4 O3 H3 109.5 . . ?
C15 O4 Dy1 129.9(2) . . ?
C17 O5 Dy1 130.9(2) . . ?
C20 O6 Dy2 137.0(2) . . ?
C22 O7 Dy2 135.5(2) . . ?
C25 O8 Dy2 136.6(2) . . ?
C27 O9 Dy2 135.4(2) . . ?
C30 O10 Dy2 134.9(2) . . ?
C32 O11 Dy2 135.3(2) . . ?
C34 O12 Dy1 142.8(2) . . ?
C1 N1 Dy1 117.06(17) . . ?
C9 N1 Dy1 122.81(16) . . ?
C9 N1 C1 119.9(2) . . ?
N3 N2 Dy1 119.54(15) . . ?
C10 N2 Dy1 120.92(17) . . ?
C10 N2 N3 119.5(2) . . ?
N2 N3 Dy2 132.14(15) . . ?
C11 N3 Dy2 119.75(16) . . ?
C11 N3 N2 107.9(2) . . ?
O3 N4 Dy2 121.85(17) . . ?
C12 N4 Dy2 122.50(17) . . ?
C12 N4 O3 115.0(2) . . ?
C34 N5 C35 123.1(4) . . ?
C34 N5 C36 121.6(4) . . ?
C35 N5 C36 115.2(4) . . ?
N1 C1 C2 116.6(2) . . ?
N1 C1 C6 122.1(3) . . ?
C6 C1 C2 121.2(2) . . ?
O1 C2 C1 117.7(2) . . ?
O1 C2 C3 124.1(3) . . ?
C3 C2 C1 118.1(3) . . ?
C2 C3 H3A 119.7 . . ?
C2 C3 C4 120.5(3) . . ?
C4 C3 H3A 119.7 . . ?
C3 C4 H4 119.1 . . ?
C5 C4 C3 121.9(3) . . ?
C5 C4 H4 119.1 . . ?
C4 C5 H5 120.1 . . ?
C4 C5 C6 119.7(3) . . ?
C6 C5 H5 120.1 . . ?
C5 C6 C1 118.5(3) . . ?
C7 C6 C1 116.5(2) . . ?
C7 C6 C5 125.0(3) . . ?
C6 C7 H7 119.7 . . ?
C8 C7 C6 120.7(3) . . ?
C8 C7 H7 119.7 . . ?
C7 C8 H8 120.4 . . ?
C7 C8 C9 119.2(3) . . ?
C9 C8 H8 120.4 . . ?
N1 C9 C8 121.6(2) . . ?
N1 C9 C10 116.4(2) . . ?
C8 C9 C10 122.0(2) . . ?
N2 C10 C9 116.6(2) . . ?
N2 C10 H10 121.7 . . ?
C9 C10 H10 121.7 . . ?
O2 C11 N3 125.8(2) . . ?
O2 C11 C12 116.5(2) . . ?
N3 C11 C12 117.6(2) . . ?
N4 C12 C11 115.7(2) . . ?
N4 C12 C13 124.8(3) . . ?
C11 C12 C13 119.5(3) . . ?
C12 C13 H13A 109.5 . . ?
C12 C13 H13B 109.5 . . ?
C12 C13 H13C 109.5 . . ?
H13A C13 H13B 109.5 . . ?
H13A C13 H13C 109.5 . . ?
H13B C13 H13C 109.5 . . ?
F1 C14 F2 99.4(7) . . ?
F1 C14 F3 109.3(7) . . ?
F1 C14 C15 115.4(4) . . ?
F2 C14 C15 106.4(5) . . ?
F3 C14 F2 106.6(7) . . ?
F3 C14 C15 117.7(5) . . ?
F1' C14 F3' 112.1(7) . . ?
F1' C14 C15 107.6(4) . . ?
F2' C14 F1' 110.9(7) . . ?
F2' C14 F3' 102.6(9) . . ?
F2' C14 C15 113.9(5) . . ?
F3' C14 C15 109.8(5) . . ?
O4 C15 C14 114.5(3) . . ?
O4 C15 C16 128.2(3) . . ?
C16 C15 C14 117.3(3) . . ?
C15 C16 H16 119.8 . . ?
C15 C16 C17 120.4(3) . . ?
C17 C16 H16 119.8 . . ?
O5 C17 C16 127.7(3) . . ?
O5 C17 C18 116.2(3) . . ?
C16 C17 C18 116.2(3) . . ?
F4 C18 F6 104.3(9) . . ?
F4 C18 C17 109.0(7) . . ?
F5 C18 F4 107.9(11) . . ?
F5 C18 F6 112.6(9) . . ?
F5 C18 C17 111.0(9) . . ?
F6 C18 C17 111.6(7) . . ?
F4' C18 F5' 104.2(10) . . ?
F4' C18 F6' 106.2(8) . . ?
F4' C18 C17 115.4(7) . . ?
F5' C18 C17 114.0(8) . . ?
F6' C18 F5' 103.4(7) . . ?
F6' C18 C17 112.6(6) . . ?
F7 C19 C20 110.2(3) . . ?
F8 C19 F7 107.8(4) . . ?
F8 C19 F9 108.4(4) . . ?
F8 C19 C20 113.3(3) . . ?
F9 C19 F7 106.5(4) . . ?
F9 C19 C20 110.4(3) . . ?
O6 C20 C19 113.4(3) . . ?
O6 C20 C21 127.0(3) . . ?
C21 C20 C19 119.6(3) . . ?
C20 C21 H21 120.0 . . ?
C22 C21 C20 120.0(3) . . ?
C22 C21 H21 120.0 . . ?
O7 C22 C21 128.7(3) . . ?
O7 C22 C23 113.1(3) . . ?
C21 C22 C23 118.2(3) . . ?
F10 C23 F11 107.3(3) . . ?
F10 C23 F12 107.1(3) . . ?
F10 C23 C22 111.4(3) . . ?
F11 C23 C22 110.3(3) . . ?
F12 C23 F11 106.8(3) . . ?
F12 C23 C22 113.6(3) . . ?
F13 C24 F14 108.1(4) . . ?
F13 C24 F15 108.2(4) . . ?
F13 C24 C25 110.9(4) . . ?
F14 C24 F15 107.4(4) . . ?
F14 C24 C25 109.1(4) . . ?
F15 C24 C25 113.0(4) . . ?
O8 C25 C24 112.2(3) . . ?
O8 C25 C26 127.2(3) . . ?
C26 C25 C24 120.5(3) . . ?
C25 C26 H26 119.6 . . ?
C25 C26 C27 120.8(3) . . ?
C27 C26 H26 119.6 . . ?
O9 C27 C26 127.9(3) . . ?
O9 C27 C28 113.9(3) . . ?
C26 C27 C28 118.1(3) . . ?
F16 C28 F17 105.2(4) . . ?
F16 C28 C27 110.9(4) . . ?
F17 C28 C27 113.7(3) . . ?
F18 C28 F16 105.7(4) . . ?
F18 C28 F17 109.8(4) . . ?
F18 C28 C27 111.1(3) . . ?
F19 C29 F20 103.9(8) . . ?
F19 C29 F21 114.7(9) . . ?
F19 C29 C30 113.8(5) . . ?
F20 C29 F21 107.8(8) . . ?
F20 C29 C30 108.4(8) . . ?
F21 C29 C30 107.8(7) . . ?
F19' C29 C30 105.9(5) . . ?
F20' C29 F19' 112.1(7) . . ?
F20' C29 C30 112.6(7) . . ?
F21' C29 F19' 104.5(8) . . ?
F21' C29 F20' 103.3(7) . . ?
F21' C29 C30 118.3(6) . . ?
O10 C30 C29 114.0(3) . . ?
O10 C30 C31 128.1(3) . . ?
C31 C30 C29 117.9(3) . . ?
C30 C31 H31 119.8 . . ?
C30 C31 C32 120.4(3) . . ?
C32 C31 H31 119.8 . . ?
O11 C32 C31 128.0(3) . . ?
O11 C32 C33 115.6(3) . . ?
C31 C32 C33 116.4(3) . . ?
F22 C33 F23 103.0(12) . . ?
F22 C33 F24 125.1(10) . . ?
F22 C33 C32 114.6(9) . . ?
F23 C33 C32 106.2(8) . . ?
F24 C33 F23 87.4(10) . . ?
F24 C33 C32 113.5(7) . . ?
F22' C33 C32 110.1(9) . . ?
F23' C33 F22' 106.7(11) . . ?
F23' C33 F24' 125.7(9) . . ?
F23' C33 C32 114.1(8) . . ?
F24' C33 F22' 83.8(10) . . ?
F24' C33 C32 111.1(7) . . ?
O12 C34 N5 124.9(4) . . ?
O12 C34 H34 117.5 . . ?
N5 C34 H34 117.5 . . ?
N5 C35 H35A 109.5 . . ?
N5 C35 H35B 109.5 . . ?
N5 C35 H35C 109.5 . . ?
H35A C35 H35B 109.5 . . ?
H35A C35 H35C 109.5 . . ?
H35B C35 H35C 109.5 . . ?
N5 C36 H36A 109.5 . . ?
N5 C36 H36B 109.5 . . ?
N5 C36 H36C 109.5 . . ?
H36A C36 H36B 109.5 . . ?
H36A C36 H36C 109.5 . . ?
H36B C36 H36C 109.5 . . ?
C37 C38 C43 104.7(11) . 3_575 ?
C39 C38 C37 114.0(10) . . ?
C39 C38 C43 24.6(8) . 3_575 ?
C38 C39 C40 108.5(8) . . ?
C38 C39 C42 159.0(9) . 3_575 ?
C40 C39 C42 52.9(6) . 3_575 ?
C43 C39 C38 89.2(16) 3_575 . ?
C43 C39 C40 21.4(16) 3_575 . ?
C43 C39 C42 70.7(14) 3_575 3_575 ?
C39 C40 C41 104.2(7) . . ?
C39 C40 C41 122.6(8) . 3_575 ?
C41 C40 C41 18.6(7) . 3_575 ?
C42 C40 C39 67.6(7) 3_575 . ?
C42 C40 C41 37.0(7) 3_575 . ?
C42 C40 C41 55.0(7) 3_575 3_575 ?
C43 C40 C39 15.1(13) 3_575 . ?
C43 C40 C41 116.8(13) 3_575 . ?
C43 C40 C41 134.3(14) 3_575 3_575 ?
C43 C40 C42 79.8(11) 3_575 3_575 ?
C40 C41 C40 161.4(7) . 3_575 ?
C41 C41 C40 56(2) 3_575 3_575 ?
C41 C41 C40 106(3) 3_575 . ?
C41 C41 C42 11(2) 3_575 . ?
C41 C41 C42 162(4) 3_575 3_575 ?
C42 C41 C40 64.4(11) 3_575 . ?
C42 C41 C40 111.9(8) . . ?
C42 C41 C40 49.8(5) . 3_575 ?
C42 C41 C40 133.3(15) 3_575 3_575 ?
C42 C41 C42 173.1(15) 3_575 . ?
C40 C42 C39 59.5(6) 3_575 3_575 ?
C40 C42 C41 75.2(8) 3_575 . ?
C40 C42 C43 36.5(8) 3_575 . ?
C41 C42 C39 137.3(15) 3_575 3_575 ?
C41 C42 C39 134.6(9) . 3_575 ?
C41 C42 C40 78.6(12) 3_575 3_575 ?
C41 C42 C41 6.9(15) 3_575 . ?
C41 C42 C43 115.1(15) 3_575 . ?
C41 C42 C43 111.4(11) . . ?
C43 C42 C39 24.0(8) . 3_575 ?
C39 C43 C38 66.2(14) 3_575 3_575 ?
C39 C43 C40 144(3) 3_575 3_575 ?
C39 C43 C42 85.4(18) 3_575 . ?
C40 C43 C38 144.9(19) 3_575 3_575 ?
C40 C43 C42 63.7(11) 3_575 . ?
C42 C43 C38 150.9(15) . 3_575 ?

loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_site_symmetry_A
O3 H3 O8 0.84 2.06 2.752(3) 139.9 .

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_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
Dy1 O1 C2 C1 8.2(3) . . . . ?
Dy1 O1 C2 C1 -143.0(2) 3_665 . . . ?
Dy1 O1 C2 C3 -170.6(2) . . . . ?
Dy1 O1 C2 C3 38.2(4) 3_665 . . . ?
Dy1 O2 C11 N3 4.5(4) . . . . ?
Dy1 O2 C11 C12 -176.43(17) . . . . ?
Dy1 O4 C15 C14 -150.5(2) . . . . ?
Dy1 O4 C15 C16 29.2(6) . . . . ?
Dy1 O5 C17 C16 -23.2(5) . . . . ?
Dy1 O5 C17 C18 156.5(2) . . . . ?
Dy1 O12 C34 N5 -171.8(3) . . . . ?
Dy1 N1 C1 C2 -2.2(3) . . . . ?
Dy1 N1 C1 C6 175.5(2) . . . . ?
Dy1 N1 C9 C8 -176.6(2) . . . . ?
Dy1 N1 C9 C10 2.4(3) . . . . ?
Dy1 N2 N3 Dy2 172.45(10) . . . . ?
Dy1 N2 N3 C11 -2.6(3) . . . . ?
Dy1 N2 C10 C9 -2.2(3) . . . . ?
Dy2 O6 C20 C19 177.5(3) . . . . ?
Dy2 O6 C20 C21 -2.1(6) . . . . ?
Dy2 O7 C22 C21 4.5(5) . . . . ?
Dy2 O7 C22 C23 -176.1(2) . . . . ?
Dy2 O8 C25 C24 176.2(3) . . . . ?
Dy2 O8 C25 C26 -4.3(7) . . . . ?
Dy2 O9 C27 C26 -11.9(6) . . . . ?
Dy2 O9 C27 C28 166.1(3) . . . . ?
Dy2 O10 C30 C29 179.0(3) . . . . ?
Dy2 O10 C30 C31 -0.9(6) . . . . ?
Dy2 O11 C32 C31 -10.8(7) . . . . ?
Dy2 O11 C32 C33 168.0(3) . . . . ?
Dy2 N3 C11 O2 -176.7(2) . . . . ?
Dy2 N3 C11 C12 4.3(3) . . . . ?
Dy2 N4 C12 C11 8.3(3) . . . . ?
Dy2 N4 C12 C13 -170.0(2) . . . . ?
F1 C14 C15 O4 36.9(8) . . . . ?
F1 C14 C15 C16 -142.8(8) . . . . ?
F2 C14 C15 O4 -72.3(6) . . . . ?
F2 C14 C15 C16 108.0(6) . . . . ?
F3 C14 C15 O4 168.3(6) . . . . ?
F3 C14 C15 C16 -11.4(8) . . . . ?
F1' C14 C15 O4 86.7(7) . . . . ?
F1' C14 C15 C16 -93.0(7) . . . . ?
F2' C14 C15 O4 -36.7(9) . . . . ?
F2' C14 C15 C16 143.6(8) . . . . ?
F3' C14 C15 O4 -151.1(7) . . . . ?
F3' C14 C15 C16 29.2(8) . . . . ?
F7 C19 C20 O6 -61.1(5) . . . . ?
F7 C19 C20 C21 118.5(4) . . . . ?
F8 C19 C20 O6 178.0(4) . . . . ?
F8 C19 C20 C21 -2.4(6) . . . . ?
F9 C19 C20 O6 56.3(4) . . . . ?
F9 C19 C20 C21 -124.1(4) . . . . ?
F13 C24 C25 O8 56.0(5) . . . . ?
F13 C24 C25 C26 -123.5(4) . . . . ?
F14 C24 C25 O8 -62.9(6) . . . . ?
F14 C24 C25 C26 117.6(5) . . . . ?
F15 C24 C25 O8 177.7(4) . . . . ?
F15 C24 C25 C26 -1.8(7) . . . . ?
F19 C29 C30 O10 -32.1(8) . . . . ?
F19 C29 C30 C31 147.8(7) . . . . ?
F20 C29 C30 O10 82.9(7) . . . . ?
F20 C29 C30 C31 -97.2(7) . . . . ?
F21 C29 C30 O10 -160.6(7) . . . . ?
F21 C29 C30 C31 19.3(8) . . . . ?
F19' C29 C30 O10 -64.2(6) . . . . ?
F19' C29 C30 C31 115.7(5) . . . . ?
F20' C29 C30 O10 58.7(7) . . . . ?
F20' C29 C30 C31 -121.4(7) . . . . ?
F21' C29 C30 O10 179.2(7) . . . . ?
F21' C29 C30 C31 -0.9(8) . . . . ?
O1 C2 C3 C4 -178.2(3) . . . . ?
O2 C11 C12 N4 172.7(2) . . . . ?
O2 C11 C12 C13 -8.9(4) . . . . ?
O3 N4 C12 C11 179.0(2) . . . . ?
O3 N4 C12 C13 0.7(4) . . . . ?
O4 C15 C16 C17 0.3(6) . . . . ?
O5 C17 C18 F4 124.5(8) . . . . ?
O5 C17 C18 F5 -116.7(8) . . . . ?
O5 C17 C18 F6 9.8(7) . . . . ?
O5 C17 C18 F4' 103.0(8) . . . . ?
O5 C17 C18 F5' -136.4(8) . . . . ?
O5 C17 C18 F6' -19.1(7) . . . . ?
O6 C20 C21 C22 0.4(6) . . . . ?
O7 C22 C23 F10 50.7(4) . . . . ?
O7 C22 C23 F11 -68.4(4) . . . . ?
O7 C22 C23 F12 171.7(3) . . . . ?
O8 C25 C26 C27 3.5(6) . . . . ?
O9 C27 C28 F16 55.9(5) . . . . ?
O9 C27 C28 F17 174.2(4) . . . . ?
O9 C27 C28 F18 -61.4(5) . . . . ?
O10 C30 C31 C32 2.7(7) . . . . ?
O11 C32 C33 F22 156.4(8) . . . . ?
O11 C32 C33 F23 -90.6(9) . . . . ?
O11 C32 C33 F24 3.7(9) . . . . ?
O11 C32 C33 F22' 129.2(8) . . . . ?
O11 C32 C33 F23' -110.9(10) . . . . ?
O11 C32 C33 F24' 38.1(9) . . . . ?
N1 C1 C2 O1 -3.6(4) . . . . ?
N1 C1 C2 C3 175.2(3) . . . . ?
N1 C1 C6 C5 -177.4(3) . . . . ?
N1 C1 C6 C7 1.6(4) . . . . ?
N1 C9 C10 N2 0.0(4) . . . . ?
N2 N3 C11 O2 -0.9(4) . . . . ?
N2 N3 C11 C12 -180.0(2) . . . . ?
N3 N2 C10 C9 -179.8(2) . . . . ?
N3 C11 C12 N4 -8.2(4) . . . . ?
N3 C11 C12 C13 170.2(3) . . . . ?
C1 N1 C9 C8 -1.8(4) . . . . ?
C1 N1 C9 C10 177.1(2) . . . . ?
C1 C2 C3 C4 3.0(5) . . . . ?
C1 C6 C7 C8 -2.2(4) . . . . ?
C2 C1 C6 C5 0.2(4) . . . . ?
C2 C1 C6 C7 179.2(3) . . . . ?
C2 C3 C4 C5 -1.2(5) . . . . ?
C3 C4 C5 C6 -1.2(5) . . . . ?
C4 C5 C6 C1 1.7(5) . . . . ?
C4 C5 C6 C7 -177.2(3) . . . . ?
C5 C6 C7 C8 176.8(3) . . . . ?
C6 C1 C2 O1 178.7(2) . . . . ?
C6 C1 C2 C3 -2.5(4) . . . . ?
C6 C7 C8 C9 0.8(5) . . . . ?
C7 C8 C9 N1 1.2(4) . . . . ?
C7 C8 C9 C10 -177.7(3) . . . . ?
C8 C9 C10 N2 178.9(3) . . . . ?
C9 N1 C1 C2 -177.3(2) . . . . ?
C9 N1 C1 C6 0.4(4) . . . . ?
C10 N2 N3 Dy2 -9.9(3) . . . . ?
C10 N2 N3 C11 175.1(2) . . . . ?
C14 C15 C16 C17 180.0(4) . . . . ?
C15 C16 C17 O5 -3.4(6) . . . . ?
C15 C16 C17 C18 176.8(3) . . . . ?
C16 C17 C18 F4 -55.8(9) . . . . ?
C16 C17 C18 F5 63.0(8) . . . . ?
C16 C17 C18 F6 -170.5(7) . . . . ?
C16 C17 C18 F4' -77.2(8) . . . . ?
C16 C17 C18 F5' 43.3(8) . . . . ?
C16 C17 C18 F6' 160.7(6) . . . . ?
C19 C20 C21 C22 -179.1(3) . . . . ?
C20 C21 C22 O7 -1.6(6) . . . . ?
C20 C21 C22 C23 178.9(3) . . . . ?
C21 C22 C23 F10 -129.8(3) . . . . ?
C21 C22 C23 F11 111.1(4) . . . . ?
C21 C22 C23 F12 -8.8(5) . . . . ?
C24 C25 C26 C27 -177.0(4) . . . . ?
C25 C26 C27 O9 4.4(6) . . . . ?
C25 C26 C27 C28 -173.6(4) . . . . ?
C26 C27 C28 F16 -125.8(4) . . . . ?
C26 C27 C28 F17 -7.5(6) . . . . ?
C26 C27 C28 F18 116.9(4) . . . . ?
C29 C30 C31 C32 -177.2(4) . . . . ?
C30 C31 C32 O11 3.1(7) . . . . ?
C30 C31 C32 C33 -175.7(4) . . . . ?
C31 C32 C33 F22 -24.7(10) . . . . ?
C31 C32 C33 F23 88.4(9) . . . . ?
C31 C32 C33 F24 -177.4(7) . . . . ?
C31 C32 C33 F22' -51.9(9) . . . . ?
C31 C32 C33 F23' 68.1(11) . . . . ?
C31 C32 C33 F24' -142.9(7) . . . . ?
C35 N5 C34 O12 -0.3(8) . . . . ?
C36 N5 C34 O12 -177.8(5) . . . . ?
C37 C38 C39 C40 81.7(12) . . . . ?
C37 C38 C39 C42 56(3) . . . 3_575 ?
C37 C38 C39 C43 72(2) . . . 3_575 ?
C38 C39 C40 C41 -174.1(10) . . . . ?
C38 C39 C40 C41 -171.1(9) . . . 3_575 ?
C38 C39 C40 C42 -168.9(11) . . . 3_575 ?
C38 C39 C40 C43 -26(5) . . . 3_575 ?
C39 C40 C41 C40 172(3) . . . 3_575 ?
C39 C40 C41 C41 172(3) . . . 3_575 ?
C39 C40 C41 C42 -178.4(10) . . . . ?
C39 C40 C41 C42 8.0(14) . . . 3_575 ?
C39 C42 C43 C38 11.4(16) 3_575 . . 3_575 ?
C39 C42 C43 C40 -160(3) 3_575 . . 3_575 ?
C40 C41 C42 C39 2.7(12) 3_575 . . 3_575 ?
C40 C41 C42 C39 -173.3(12) . . . 3_575 ?
C40 C41 C42 C40 -176.0(11) . . . 3_575 ?
C40 C41 C42 C41 -57(11) . . . 3_575 ?
C40 C41 C42 C41 119(12) 3_575 . . 3_575 ?
C40 C41 C42 C43 179.5(12) . . . . ?
C40 C41 C42 C43 -4.5(10) 3_575 . . . ?
C40 C42 C43 C38 171(4) 3_575 . . 3_575 ?
C40 C42 C43 C39 160(3) 3_575 . . 3_575 ?
C41 C40 C41 C40 0.000(13) 3_575 . . 3_575 ?
C41 C40 C41 C42 10(3) 3_575 . . . ?
C41 C40 C41 C42 -164(4) 3_575 . . 3_575 ?
C41 C41 C42 C39 -116(11) 3_575 . . 3_575 ?
C41 C41 C42 C40 -119(12) 3_575 . . 3_575 ?
C41 C41 C42 C43 -123(11) 3_575 . . . ?
C41 C42 C43 C38 179(3) . . . 3_575 ?
C41 C42 C43 C38 172(3) 3_575 . . 3_575 ?
C41 C42 C43 C39 167(2) . . . 3_575 ?
C41 C42 C43 C39 161(2) 3_575 . . 3_575 ?
C41 C42 C43 C40 7.3(16) . . . 3_575 ?
C41 C42 C43 C40 1(2) 3_575 . . 3_575 ?
C42 C39 C40 C41 -5.2(9) 3_575 . . . ?
C42 C39 C40 C41 -2.2(9) 3_575 . . 3_575 ?
C42 C39 C40 C43 143(5) 3_575 . . 3_575 ?
C42 C40 C41 C40 164(4) 3_575 . . 3_575 ?
C42 C40 C41 C41 164(4) 3_575 . . 3_575 ?
C42 C40 C41 C42 173.5(17) 3_575 . . . ?
C43 C38 C39 C40 9.3(19) 3_575 . . . ?
C43 C38 C39 C42 -16(2) 3_575 . . 3_575 ?
C43 C39 C40 C41 -148(5) 3_575 . . . ?
C43 C39 C40 C41 -145(5) 3_575 . . 3_575 ?
C43 C39 C40 C42 -143(5) 3_575 . . 3_575 ?
C43 C40 C41 C40 163(3) 3_575 . . 3_575 ?
C43 C40 C41 C41 163(3) 3_575 . . 3_575 ?
C43 C40 C41 C42 172.6(16) 3_575 . . . ?
C43 C40 C41 C42 -1(2) 3_575 . . 3_575 ?

_olex2_submission_special_instructions 'No special instructions were received'
