# Electronic Supplementary Material (ESI) for RSC Advances.
# This journal is © The Royal Society of Chemistry 2020

####################################################################### 
# 
# 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_compound2
_database_code_depnum_ccdc_archive 'CCDC 1984194'
loop_
_audit_author_name
_audit_author_address
'Frank cluster'
;Frank cluster
China
;
_audit_update_record             
;
2020-02-15 deposited with the CCDC.	2020-03-10 downloaded from the CCDC.
;
_audit_creation_date             2020-02-14
_audit_creation_method           
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_chemical_name_common            ?
_chemical_name_systematic        
;
 ? 
;
_chemical_formula_moiety         'C60 H56 Dy2 N6 O14 S2, 2(C H4 O)'
_chemical_formula_sum            'C62 H64 Dy2 N6 O16 S2'
_chemical_formula_weight         1538.31
_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'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_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_id
_space_group_symop_operation_xyz
1 'x, y, z'
2 '-x, -y, -z'

_cell_length_a                   9.9101(6)
_cell_length_b                   11.7555(5)
_cell_length_c                   15.8011(5)
_cell_angle_alpha                73.569(3)
_cell_angle_beta                 88.693(4)
_cell_angle_gamma                65.351(5)
_cell_volume                     1595.15(12)
_cell_formula_units_Z            1
_cell_measurement_reflns_used    11063
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      25.6680
_cell_measurement_theta_min      3.6460
_exptl_absorpt_coefficient_mu    2.461
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.61666
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro 1.171.38.43 (Rigaku Oxford Diffraction, 2015)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            ?
_exptl_crystal_density_diffrn    1.601
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             770
_exptl_crystal_size_max          0.23
_exptl_crystal_size_mid          0.2
_exptl_crystal_size_min          0.12
_exptl_special_details           
;
 ? 
;
_diffrn_reflns_av_R_equivalents  0.0444
_diffrn_reflns_av_unetI/netI     0.0332
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       18
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            22939
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.00
_diffrn_reflns_theta_min         3.27
_diffrn_ambient_temperature      293.0
_diffrn_detector                 'CCD plate'
_diffrn_detector_area_resol_mean 10.6296
_diffrn_detector_type            Atlas
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_details      
;
List of Runs (angles in degrees, time in seconds):

  # Type    Start    End  Width  tₑₓₚ   ω     θ     κ     φ   Frames
#--------------------------------------------------------------------------
  1  ω    -69.00  52.00   1.00   25.00    --   10.68 -19.00-150.00  121
  2  ω    -20.00  52.00   1.00   25.00    --   10.68 -99.00  60.00   72
  3  ω    -77.00  99.00   1.00   25.00    --   10.68   0.00-120.00  176
  4  ω    -20.00  29.00   1.00   25.00    --  -11.93 -99.00 -90.00   49
  5  ω    -99.00 -34.00   1.00   25.00    --  -11.93 178.00  90.00   65
  6  ω    -20.00  29.00   1.00   25.00    --  -11.93 -99.00  90.00   49
  7  ω    -88.00 -42.00   1.00   25.00    --  -11.93 -77.00 -60.00   46
;
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'SuperNova, Single source at offset, Atlas'
_diffrn_measurement_method       'ω scans'
_diffrn_orient_matrix_type       
'CrysAlisPro convention (1999,Acta A55,543-557)'
_diffrn_orient_matrix_UB_11      0.0755252000
_diffrn_orient_matrix_UB_12      -0.0094362000
_diffrn_orient_matrix_UB_13      0.0014016000
_diffrn_orient_matrix_UB_21      0.0066949000
_diffrn_orient_matrix_UB_22      -0.0215029000
_diffrn_orient_matrix_UB_23      0.0470572000
_diffrn_orient_matrix_UB_31      0.0229639000
_diffrn_orient_matrix_UB_32      -0.0655312000
_diffrn_orient_matrix_UB_33      -0.0005973000
_diffrn_radiation_monochromator  mirror
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   'micro-focus sealed X-ray tube'
_diffrn_source_type              'SuperNova (Mo) X-ray Source'
_diffrn_standards_decay_%        ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_number         ?
_reflns_number_gt                4923
_reflns_number_total             5598
_reflns_odcompleteness_completeness 99.82
_reflns_odcompleteness_iscentric 1
_reflns_odcompleteness_theta     26.32
_reflns_threshold_expression     >2sigma(I)
_computing_cell_refinement       'CrysAlisPro 1.171.38.43 (Rigaku OD, 2015)'
_computing_data_collection       'CrysAlisPro 1.171.38.43 (Rigaku OD, 2015)'
_computing_data_reduction        'CrysAlisPro 1.171.38.43 (Rigaku OD, 2015)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'XL (Sheldrick, 2008)'
_computing_structure_solution    'XS (Sheldrick, 2008)'
_refine_diff_density_max         1.730
_refine_diff_density_min         -0.691
_refine_diff_density_rms         0.089
_refine_ls_extinction_coef       ?
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.066
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     396
_refine_ls_number_reflns         5598
_refine_ls_number_restraints     24
_refine_ls_R_factor_all          0.0510
_refine_ls_R_factor_gt           0.0459
_refine_ls_restrained_S_all      1.073
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0910P)²+0.3919P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1351
_refine_ls_wR_factor_ref         0.1419
_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. 
;
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups, All N(H) groups
 At 1.5 times of:
  All C(H,H,H) groups, All O(H) groups
2. Uiso/Uaniso restraints and constraints
Uanis(C30) \\sim Ueq, Uanis(N3) \\sim Ueq, Uanis(S1) \\sim Ueq, Uanis(Dy1)
\\sim Ueq: with sigma of 0.01 and sigma for terminal atoms of 0.02
Uanis(N3) = Uanis(C30)
3.a Ternary CH refined with riding coordinates:
 C13(H13)
3.b Secondary CH2 refined with riding coordinates:
 C12(H12A,H12B), C14(H14A,H14B)
3.c Aromatic/amide H refined with riding coordinates:
 N1(H1), N2(H2A), C2(H2B), C3(H3), C5(H5), C6(H6), C7(H7), C0AA(H0AA),
 C11(H11), C15(H15), C18(H18), C19(H19), C20(H20), C21(H21), C23(H23), C24(H24)
3.d Idealised Me refined as rotating group:
 C27(H27A,H27B,H27C), C29(H29A,H29B,H29C), C8(H8A,H8B,H8C)
3.e Idealised tetrahedral OH refined as rotating group:
 O2(H2), O31(H31)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
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_calc_flag
_atom_site_disorder_assembly
_atom_site_disorder_group
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
Dy1 Dy 0.96049(3) 0.61622(2) 0.578619(17) 0.07790(15) Uani 1 d . . . U
S1 S 0.7274(5) 0.3318(4) 0.7605(4) 0.205(2) Uani 1 d . . . U
O1 O 1.1251(5) 0.5381(4) 0.7030(3) 0.0844(10) Uani 1 d . . . .
O2 O 1.3183(7) 0.8391(5) 0.7214(3) 0.1045(14) Uani 1 d . . . .
H2 H 1.2587 0.9132 0.7205 0.157 Uiso 1 calc . . GR .
O3 O 1.8379(5) 0.7886(5) 0.6319(3) 0.0885(11) Uani 1 d . . . .
O4 O 1.1397(5) 0.4356(4) 0.5408(3) 0.0842(11) Uani 1 d . . . .
O5 O 1.3007(5) 0.2782(4) 0.4957(3) 0.0902(12) Uani 1 d . . . .
O6 O 0.9509(6) 0.7829(5) 0.4440(3) 0.0980(13) Uani 1 d . . . .
O7 O 1.1490(6) 0.6959(5) 0.5360(3) 0.1028(14) Uani 1 d . . . .
N1 N 1.3518(6) 0.6066(5) 0.6896(3) 0.0820(12) Uani 1 d . . . .
H1 H 1.2847 0.6007 0.6598 0.098 Uiso 1 calc . . R .
N2 N 1.5429(6) 0.8935(5) 0.6174(3) 0.0809(12) Uani 1 d . . . .
H2A H 1.6213 0.8439 0.5988 0.097 Uiso 1 calc . . R .
N3 N 0.8560(11) 0.4770(10) 0.6634(6) 0.139(2) Uani 1 d . . . U
C1 C 1.1658(8) 0.4893(6) 0.7872(4) 0.0839(15) Uani 1 d . . . .
C2 C 1.0697(10) 0.4494(7) 0.8458(5) 0.0963(18) Uani 1 d . . . .
H2B H 0.9786 0.4592 0.8227 0.116 Uiso 1 calc . . R .
C3 C 1.1108(12) 0.3978(8) 0.9340(6) 0.110(2) Uani 1 d . . . .
H3 H 1.0458 0.3744 0.9705 0.131 Uiso 1 calc . . R .
C4 C 1.2495(11) 0.3778(7) 0.9737(5) 0.100(2) Uani 1 d . . . .
C5 C 1.2884(13) 0.3213(8) 1.0660(6) 0.120(3) Uani 1 d . . . .
H5 H 1.2203 0.3022 1.1019 0.144 Uiso 1 calc . . R .
C6 C 1.4230(14) 0.2951(9) 1.1023(6) 0.130(3) Uani 1 d . . . .
H6 H 1.4481 0.2564 1.1632 0.156 Uiso 1 calc . . R .
C7 C 1.5234(12) 0.3242(8) 1.0511(6) 0.115(3) Uani 1 d . . . .
H7 H 1.6164 0.3052 1.0774 0.137 Uiso 1 calc . . R .
C0AA C 1.4888(10) 0.3818(7) 0.9605(5) 0.104(2) Uani 1 d . . . .
H0AA H 1.5588 0.3998 0.9260 0.125 Uiso 1 calc . . R .
C9 C 1.3474(9) 0.4131(6) 0.9206(4) 0.0942(19) Uani 1 d . . . .
C10 C 1.2994(8) 0.4793(6) 0.8246(4) 0.0837(15) Uani 1 d . . . .
C11 C 1.3818(8) 0.5435(6) 0.7731(4) 0.0829(15) Uani 1 d . . . .
H11 H 1.4646 0.5395 0.8025 0.100 Uiso 1 calc . . R .
C12 C 1.4253(7) 0.6878(6) 0.6422(4) 0.0851(15) Uani 1 d . . . .
H12A H 1.4411 0.6775 0.5835 0.102 Uiso 1 calc . . R .
H12B H 1.5220 0.6590 0.6740 0.102 Uiso 1 calc . . R .
C13 C 1.3300(7) 0.8314(6) 0.6340(4) 0.0812(14) Uani 1 d . . . .
H13 H 1.2302 0.8576 0.6058 0.097 Uiso 1 calc . . R .
C14 C 1.3967(8) 0.9188(6) 0.5788(4) 0.0844(15) Uani 1 d . . . .
H14A H 1.4062 0.9067 0.5204 0.101 Uiso 1 calc . . R .
H14B H 1.3286 1.0097 0.5714 0.101 Uiso 1 calc . . R .
C15 C 1.5604(8) 0.9424(6) 0.6788(4) 0.0807(15) Uani 1 d . . . .
H15 H 1.4742 0.9985 0.6964 0.097 Uiso 1 calc . . R .
C16 C 1.6963(8) 0.9181(6) 0.7203(4) 0.0806(15) Uani 1 d . . . .
C17 C 1.6979(8) 0.9687(6) 0.7955(4) 0.0850(16) Uani 1 d . . . .
C18 C 1.5672(10) 1.0433(7) 0.8267(5) 0.104(2) Uani 1 d . . . .
H18 H 1.4749 1.0657 0.7978 0.125 Uiso 1 calc . . R .
C19 C 1.5733(13) 1.0839(9) 0.8994(6) 0.118(3) Uani 1 d . . . .
H19 H 1.4852 1.1309 0.9203 0.142 Uiso 1 calc . . R .
C20 C 1.7109(15) 1.0550(9) 0.9422(6) 0.127(3) Uani 1 d . . . .
H20 H 1.7142 1.0857 0.9899 0.153 Uiso 1 calc . . R .
C21 C 1.8371(12) 0.9837(9) 0.9143(6) 0.113(2) Uani 1 d . . . .
H21 H 1.9284 0.9622 0.9440 0.136 Uiso 1 calc . . R .
C22 C 1.8335(10) 0.9403(7) 0.8399(5) 0.0950(19) Uani 1 d . . . .
C23 C 1.9712(9) 0.8631(7) 0.8097(5) 0.0969(19) Uani 1 d . . . .
H23 H 2.0625 0.8441 0.8382 0.116 Uiso 1 calc . . R .
C24 C 1.9669(11) 0.8185(7) 0.7397(5) 0.098(2) Uani 1 d . . . .
H24 H 2.0566 0.7723 0.7199 0.118 Uiso 1 calc . . R .
C25 C 1.8321(8) 0.8393(6) 0.6955(4) 0.0843(15) Uani 1 d . . . .
C26 C 1.2748(7) 0.3478(6) 0.5452(4) 0.0788(14) Uani 1 d . . . .
C27 C 1.3918(9) 0.3359(8) 0.6076(6) 0.109(2) Uani 1 d . . . .
H27A H 1.4326 0.3966 0.5798 0.164 Uiso 1 calc . . GR .
H27B H 1.4696 0.2481 0.6237 0.164 Uiso 1 calc . . GR .
H27C H 1.3493 0.3553 0.6598 0.164 Uiso 1 calc . . GR .
C28 C 1.0774(9) 0.7746(7) 0.4644(5) 0.0909(17) Uani 1 d . . . .
C29 C 1.1396(13) 0.8615(12) 0.4005(7) 0.145(4) Uani 1 d . . . .
H29A H 1.0692 0.9149 0.3487 0.218 Uiso 1 calc . . GR .
H29B H 1.2323 0.8071 0.3835 0.218 Uiso 1 calc . . GR .
H29C H 1.1562 0.9169 0.4295 0.218 Uiso 1 calc . . GR .
C30 C 0.7998(14) 0.4285(12) 0.7035(8) 0.139(2) Uani 1 d . . . U
O31 O 1.2081(7) 1.0946(6) 0.7209(4) 0.1186(17) Uani 1 d . . . .
H31 H 1.1454 1.1368 0.6775 0.178 Uiso 1 calc . . GR .
C8 C 1.1477(14) 1.1333(12) 0.7965(8) 0.154(4) Uani 1 d . . . .
H8A H 1.1380 1.2201 0.7901 0.231 Uiso 1 calc . . GR .
H8B H 1.2131 1.0731 0.8492 0.231 Uiso 1 calc . . GR .
H8C H 1.0512 1.1326 0.8012 0.231 Uiso 1 calc . . GR .


_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 O1 2.290(4) . ?
Dy1 O3 2.270(4) 1_455 ?
Dy1 O4 2.482(4) 2_766 ?
Dy1 O4 2.354(4) . ?
Dy1 O5 2.501(5) 2_766 ?
Dy1 O6 2.422(5) . ?
Dy1 O7 2.423(5) . ?
Dy1 N3 2.378(9) . ?
Dy1 C26 2.891(6) 2_766 ?
Dy1 C28 2.805(7) . ?
S1 C30 1.640(12) . ?
O1 C1 1.289(7) . ?
O2 C13 1.408(8) . ?
O3 Dy1 2.270(4) 1_655 ?
O3 C25 1.295(8) . ?
O4 Dy1 2.482(4) 2_766 ?
O4 C26 1.294(7) . ?
O5 Dy1 2.501(5) 2_766 ?
O5 C26 1.234(7) . ?
O6 C28 1.258(9) . ?
O7 C28 1.239(8) . ?
N1 C11 1.288(8) . ?
N1 C12 1.467(8) . ?
N2 C14 1.462(9) . ?
N2 C15 1.306(8) . ?
N3 C30 1.040(13) . ?
C1 C2 1.440(10) . ?
C1 C10 1.408(10) . ?
C2 C3 1.349(11) . ?
C3 C4 1.422(13) . ?
C4 C5 1.407(11) . ?
C4 C9 1.385(11) . ?
C5 C6 1.340(15) . ?
C6 C7 1.362(14) . ?
C7 C0AA 1.380(11) . ?
C0AA C9 1.405(11) . ?
C9 C10 1.481(9) . ?
C10 C11 1.426(10) . ?
C12 C13 1.520(9) . ?
C13 C14 1.512(9) . ?
C15 C16 1.394(10) . ?
C16 C17 1.474(9) . ?
C16 C25 1.402(9) . ?
C17 C18 1.399(10) . ?
C17 C22 1.395(11) . ?
C18 C19 1.374(12) . ?
C19 C20 1.400(15) . ?
C20 C21 1.330(14) . ?
C21 C22 1.415(10) . ?
C22 C23 1.446(11) . ?
C23 C24 1.361(9) . ?
C24 C25 1.416(11) . ?
C26 Dy1 2.891(6) 2_766 ?
C26 C27 1.475(10) . ?
C28 C29 1.535(12) . ?
O31 C8 1.430(12) . ?

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 O4 83.83(15) . . ?
O1 Dy1 O4 147.02(15) . 2_766 ?
O1 Dy1 O5 150.83(16) . 2_766 ?
O1 Dy1 O6 125.31(17) . . ?
O1 Dy1 O7 73.88(16) . . ?
O1 Dy1 N3 85.0(2) . . ?
O1 Dy1 C26 161.84(17) . 2_766 ?
O1 Dy1 C28 99.45(19) . . ?
O3 Dy1 O1 84.03(16) 1_455 . ?
O3 Dy1 O4 165.87(17) 1_455 . ?
O3 Dy1 O4 126.36(16) 1_455 2_766 ?
O3 Dy1 O5 75.11(16) 1_455 2_766 ?
O3 Dy1 O6 84.51(17) 1_455 . ?
O3 Dy1 O7 89.41(19) 1_455 . ?
O3 Dy1 N3 97.0(3) 1_455 . ?
O3 Dy1 C26 100.10(17) 1_455 2_766 ?
O3 Dy1 C28 86.75(19) 1_455 . ?
O4 Dy1 O4 67.24(17) . 2_766 ?
O4 Dy1 O5 118.77(14) . 2_766 ?
O4 Dy1 O5 51.63(14) 2_766 2_766 ?
O4 Dy1 O6 96.64(17) . . ?
O4 Dy1 O7 80.27(18) . . ?
O4 Dy1 N3 89.2(3) . . ?
O4 Dy1 C26 93.67(16) . 2_766 ?
O4 Dy1 C26 26.50(15) 2_766 2_766 ?
O4 Dy1 C28 95.24(18) 2_766 . ?
O4 Dy1 C28 88.12(19) . . ?
O5 Dy1 C26 25.14(15) 2_766 2_766 ?
O5 Dy1 C28 99.48(19) 2_766 . ?
O6 Dy1 O4 75.55(16) . 2_766 ?
O6 Dy1 O5 73.30(17) . 2_766 ?
O6 Dy1 O7 52.71(17) . . ?
O6 Dy1 C26 72.83(17) . 2_766 ?
O6 Dy1 C28 26.58(19) . . ?
O7 Dy1 O4 114.22(16) . 2_766 ?
O7 Dy1 O5 125.11(16) . 2_766 ?
O7 Dy1 C26 123.54(17) . 2_766 ?
O7 Dy1 C28 26.13(19) . . ?
N3 Dy1 O4 79.3(2) . 2_766 ?
N3 Dy1 O5 77.7(2) . 2_766 ?
N3 Dy1 O6 149.5(2) . . ?
N3 Dy1 O7 157.2(3) . . ?
N3 Dy1 C26 77.0(2) . 2_766 ?
N3 Dy1 C28 174.5(3) . . ?
C28 Dy1 C26 98.4(2) . 2_766 ?
C1 O1 Dy1 154.2(4) . . ?
C25 O3 Dy1 146.9(4) . 1_655 ?
Dy1 O4 Dy1 112.76(17) . 2_766 ?
C26 O4 Dy1 152.3(4) . . ?
C26 O4 Dy1 94.7(3) . 2_766 ?
C26 O5 Dy1 95.4(4) . 2_766 ?
C28 O6 Dy1 93.9(4) . . ?
C28 O7 Dy1 94.4(5) . . ?
C11 N1 C12 124.0(6) . . ?
C15 N2 C14 123.3(6) . . ?
C30 N3 Dy1 171.3(13) . . ?
O1 C1 C2 119.7(6) . . ?
O1 C1 C10 121.8(6) . . ?
C10 C1 C2 118.4(6) . . ?
C3 C2 C1 120.4(8) . . ?
C2 C3 C4 122.8(8) . . ?
C5 C4 C3 120.6(8) . . ?
C9 C4 C3 119.5(7) . . ?
C9 C4 C5 119.9(8) . . ?
C6 C5 C4 120.3(10) . . ?
C5 C6 C7 120.8(8) . . ?
C6 C7 C0AA 120.7(9) . . ?
C7 C0AA C9 119.9(9) . . ?
C4 C9 C0AA 118.2(7) . . ?
C4 C9 C10 118.5(7) . . ?
C0AA C9 C10 123.3(7) . . ?
C1 C10 C9 119.8(6) . . ?
C1 C10 C11 120.8(6) . . ?
C11 C10 C9 119.1(6) . . ?
N1 C11 C10 125.9(6) . . ?
N1 C12 C13 110.5(5) . . ?
O2 C13 C12 106.1(5) . . ?
O2 C13 C14 112.4(5) . . ?
C14 C13 C12 111.6(5) . . ?
N2 C14 C13 113.7(5) . . ?
N2 C15 C16 126.0(6) . . ?
C15 C16 C17 119.6(6) . . ?
C15 C16 C25 121.0(6) . . ?
C25 C16 C17 119.3(6) . . ?
C18 C17 C16 122.7(7) . . ?
C22 C17 C16 120.0(6) . . ?
C22 C17 C18 117.3(6) . . ?
C19 C18 C17 121.0(9) . . ?
C18 C19 C20 120.6(9) . . ?
C21 C20 C19 119.8(8) . . ?
C20 C21 C22 120.6(9) . . ?
C17 C22 C21 120.7(8) . . ?
C17 C22 C23 119.0(6) . . ?
C21 C22 C23 120.3(8) . . ?
C24 C23 C22 119.9(8) . . ?
C23 C24 C25 123.1(8) . . ?
O3 C25 C16 122.1(7) . . ?
O3 C25 C24 119.2(6) . . ?
C16 C25 C24 118.6(6) . . ?
O4 C26 Dy1 58.8(3) . 2_766 ?
O4 C26 C27 119.1(6) . . ?
O5 C26 Dy1 59.5(3) . 2_766 ?
O5 C26 O4 118.3(6) . . ?
O5 C26 C27 122.6(6) . . ?
C27 C26 Dy1 177.4(5) . 2_766 ?
O6 C28 Dy1 59.5(3) . . ?
O6 C28 C29 119.6(7) . . ?
O7 C28 Dy1 59.4(4) . . ?
O7 C28 O6 118.9(6) . . ?
O7 C28 C29 121.5(8) . . ?
C29 C28 Dy1 179.0(6) . . ?
N3 C30 S1 170.7(15) . . ?

_olex2_submission_special_instructions 'No special instructions were received'
_oxdiff_exptl_absorpt_empirical_details 
;
Empirical correction (ABSPACK) includes:
- Absorption correction using spherical harmonics
- Frame scaling
;
_oxdiff_exptl_absorpt_empirical_full_max 1.494
_oxdiff_exptl_absorpt_empirical_full_min 0.575
####################################################################### 
# 
# 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_compound1
_database_code_depnum_ccdc_archive 'CCDC 1984195'
loop_
_audit_author_name
_audit_author_address
'Frank cluster'
;Frank cluster
China
;
_audit_update_record             
;
2020-02-15 deposited with the CCDC.	2020-03-10 downloaded from the CCDC.
;
_audit_creation_date             2020-02-14
_audit_creation_method           
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_chemical_name_common            ?
_chemical_name_systematic        
;
 ? 
;
_chemical_formula_moiety         'C62 H60 Dy2 N4 O18, 2(C H4 O)'
_chemical_formula_sum            'C64 H68 Dy2 N4 O20'
_chemical_formula_weight         1538.22
_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'
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'

_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_id
_space_group_symop_operation_xyz
1 'x, y, z'
2 '-x, -y, -z'

_cell_length_a                   9.9272(2)
_cell_length_b                   11.8458(4)
_cell_length_c                   15.0341(4)
_cell_angle_alpha                83.259(3)
_cell_angle_beta                 82.471(2)
_cell_angle_gamma                76.012(2)
_cell_volume                     1693.97(8)
_cell_formula_units_Z            1
_cell_measurement_reflns_used    15441
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      28.8070
_cell_measurement_theta_min      3.9290
_exptl_absorpt_coefficient_mu    2.261
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.48175
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro 1.171.38.43 (Rigaku Oxford Diffraction, 2015)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            ?
_exptl_crystal_density_diffrn    1.508
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             772
_exptl_crystal_size_max          0.27
_exptl_crystal_size_mid          0.21
_exptl_crystal_size_min          0.09
_exptl_special_details           
;
 ? 
;
_diffrn_reflns_av_R_equivalents  0.0271
_diffrn_reflns_av_unetI/netI     0.0192
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_number            25041
_diffrn_reflns_theta_full        25.01
_diffrn_reflns_theta_max         25.01
_diffrn_reflns_theta_min         3.34
_diffrn_ambient_temperature      293.0
_diffrn_detector                 'CCD plate'
_diffrn_detector_area_resol_mean 15.9784
_diffrn_detector_type            Eos
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_details      
;
List of Runs (angles in degrees, time in seconds):

  # Type    Start    End  Width  tₑₓₚ   ω     θ     κ     φ   Frames
#--------------------------------------------------------------------------
  1  ω    -51.00  38.00   1.00    5.00    --   17.61 -57.00 120.00   89
  2  ω    -73.00   4.00   1.00    5.00    --  -19.96 118.00 143.00   77
  3  ω    -90.00  10.00   1.00    5.00    --  -19.96 -77.00 -90.00  100
  4  ω    -50.00  50.00   1.00    5.00    --  -19.96  77.00  30.00  100
  5  ω    -89.00   1.00   1.00    5.00    --  -19.96 -57.00  30.00   90
  6  ω    -64.00  53.00   1.00    5.00    --  -19.96  19.00-150.00  117
  7  ω     35.00  94.00   1.00    5.00    --   17.61 178.00  30.00   59
  8  ω    -20.00  60.00   1.00    5.00    --   17.61 -99.00 -60.00   80
  9  ω    -89.00 -35.00   1.00    5.00    --  -19.96 -57.00 150.00   54
 10  ω    -89.00   1.00   1.00    5.00    --  -19.96 -57.00 120.00   90
;
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'SuperNova, Single source at offset, Eos'
_diffrn_measurement_method       'ω scans'
_diffrn_orient_matrix_type       
'CrysAlisPro convention (1999,Acta A55,543-557)'
_diffrn_orient_matrix_UB_11      0.0682382000
_diffrn_orient_matrix_UB_12      0.0011016000
_diffrn_orient_matrix_UB_13      0.0085553000
_diffrn_orient_matrix_UB_21      0.0179000000
_diffrn_orient_matrix_UB_22      0.0130630000
_diffrn_orient_matrix_UB_23      -0.0466776000
_diffrn_orient_matrix_UB_31      -0.0225228000
_diffrn_orient_matrix_UB_32      0.0605515000
_diffrn_orient_matrix_UB_33      0.0055584000
_diffrn_radiation_monochromator  mirror
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   'micro-focus sealed X-ray tube'
_diffrn_source_type              'SuperNova (Mo) X-ray Source'
_diffrn_standards_decay_%        ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_number         ?
_reflns_number_gt                5647
_reflns_number_total             5943
_reflns_odcompleteness_completeness 99.80
_reflns_odcompleteness_iscentric 1
_reflns_odcompleteness_theta     26.32
_reflns_threshold_expression     >2sigma(I)
_computing_cell_refinement       'CrysAlisPro 1.171.38.43 (Rigaku OD, 2015)'
_computing_data_collection       'CrysAlisPro 1.171.38.43 (Rigaku OD, 2015)'
_computing_data_reduction        'CrysAlisPro 1.171.38.43 (Rigaku OD, 2015)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'XL (Sheldrick, 2008)'
_computing_structure_solution    'XS (Sheldrick, 2008)'
_refine_diff_density_max         1.843
_refine_diff_density_min         -1.018
_refine_diff_density_rms         0.093
_refine_ls_extinction_coef       ?
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.105
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     425
_refine_ls_number_reflns         5943
_refine_ls_number_restraints     5
_refine_ls_R_factor_all          0.0369
_refine_ls_R_factor_gt           0.0356
_refine_ls_restrained_S_all      1.104
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0701P)²+0.9644P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1048
_refine_ls_wR_factor_ref         0.1068
_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. 
;
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups, All N(H) groups
 At 1.5 times of:
  All C(H,H,H) groups, All O(H) groups
2. Restrained distances
 C32-O10
 1.4 with sigma of 0.001
 C30-C31
 1.5 with sigma of 0.0001
 H31C-H6_$1
 2.1 with sigma of 0.005
3. Others
 1*[Sof(O2A)+Sof(H2AA)]+1*[Sof(O2)]=1 with esd of 0.0001
 1*[Sof(O2A)+Sof(H2AA)]+1*[Sof(H2B)]=1 with esd of 0.0001
 Sof(O2A)=Sof(H2AA)=FVAR(1)
4.a Secondary CH2 refined with riding coordinates:
 C12(H12A,H12B), C14(H14A,H14B)
4.b Aromatic/amide H refined with riding coordinates:
 N1(H1), C11(H11), C2(H2), C3(H3), C8(H8), C5(H5), C7(H7), C6(H6), N2(H2A),
 C15(H15), C24(H24), C18(H18), C23(H23), C19(H19), C21(H21), C20(H20)
4.c Idealised Me refined as rotating group:
 C31(H31A,H31B,H31C), C29(H29A,H29B,H29C), C27(H27A,H27B,H27C), C32(H32A,H32B,
 H32C)
4.d Idealised tetrahedral OH refined as rotating group:
 O2(H2B), O10(H10), O2A(H2AA)
;
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
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_calc_flag
_atom_site_disorder_assembly
_atom_site_disorder_group
_atom_site_refinement_flags_posn
Dy1 Dy 0.546308(18) 0.841579(15) 0.575610(12) 0.05724(10) Uani 1 d . . .
O1 O 0.6652(3) 0.8275(3) 0.6997(2) 0.0645(7) Uani 1 d . . .
N1 N 0.9446(4) 0.7709(3) 0.6706(3) 0.0632(8) Uani 1 d . . .
H1 H 0.8693 0.7891 0.6445 0.076 Uiso 1 calc . . R
O4 O 0.7949(3) 0.7927(3) 0.5205(2) 0.0737(8) Uani 1 d . . .
O9 O 0.3608(4) 0.7977(3) 0.7020(3) 0.0807(9) Uani 1 d . . .
O7 O 0.3463(3) 0.8095(3) 0.5104(2) 0.0683(8) Uani 1 d . . .
O5 O 0.6480(4) 0.7753(3) 0.4309(2) 0.0718(8) Uani 1 d . . .
C30 C 0.3099(4) 0.9005(5) 0.6993(3) 0.0732(12) Uani 1 d . . D
O8 O 0.3489(4) 0.9776(3) 0.6586(3) 0.0861(10) Uani 1 d . . .
C26 C 0.7671(5) 0.7753(4) 0.4451(3) 0.0647(11) Uani 1 d . . .
C28 C 0.3199(4) 0.9047(4) 0.4638(3) 0.0599(9) Uani 1 d . . .
C1 C 0.6787(5) 0.8281(4) 0.7834(3) 0.0649(10) Uani 1 d . . .
C12 C 1.0747(4) 0.7279(4) 0.6166(3) 0.0656(10) Uani 1 d . . .
H12A H 1.1515 0.7390 0.6458 0.079 Uiso 1 calc . . R
H12B H 1.0749 0.7726 0.5582 0.079 Uiso 1 calc . . R
C31 C 0.1689(5) 0.9307(6) 0.7521(4) 0.0896(17) Uani 1 d . . D
H31A H 0.1738 0.8929 0.8121 0.134 Uiso 1 calc . . GR
H31B H 0.1025 0.9047 0.7233 0.134 Uiso 1 calc . . GR
H31C H 0.1403 1.0138 0.7547 0.134 Uiso 1 calc . . DGR
C10 C 0.8109(5) 0.8160(5) 0.8136(3) 0.0723(12) Uani 1 d . . .
C11 C 0.9342(5) 0.7837(5) 0.7551(4) 0.0736(12) Uani 1 d . . .
H11 H 1.0177 0.7700 0.7806 0.088 Uiso 1 calc . . R
C29 C 0.1921(6) 0.9403(5) 0.4146(4) 0.0783(13) Uani 1 d . . .
H29A H 0.1610 0.8721 0.4059 0.117 Uiso 1 calc . . GR
H29B H 0.2139 0.9802 0.3571 0.117 Uiso 1 calc . . GR
H29C H 0.1196 0.9913 0.4493 0.117 Uiso 1 calc . . GR
C2 C 0.5607(6) 0.8448(5) 0.8479(4) 0.0830(14) Uani 1 d . . .
H2 H 0.4729 0.8518 0.8296 0.100 Uiso 1 calc . . R
C9 C 0.8237(7) 0.8349(6) 0.9054(4) 0.0888(16) Uani 1 d . . .
C27 C 0.8867(7) 0.7539(7) 0.3675(4) 0.0977(19) Uani 1 d . . .
H27A H 0.8650 0.7065 0.3262 0.147 Uiso 1 calc . . GR
H27B H 0.9723 0.7144 0.3917 0.147 Uiso 1 calc . . GR
H27C H 0.8969 0.8274 0.3364 0.147 Uiso 1 calc . . GR
C4 C 0.7008(8) 0.8467(8) 0.9687(4) 0.108(2) Uani 1 d . . .
C3 C 0.5718(7) 0.8510(7) 0.9362(4) 0.103(2) Uani 1 d . . .
H3 H 0.4917 0.8584 0.9768 0.123 Uiso 1 calc . . R
C8 C 0.9464(8) 0.8458(7) 0.9371(5) 0.104(2) Uani 1 d . . .
H8 H 1.0271 0.8394 0.8971 0.125 Uiso 1 calc . . R
C5 C 0.7117(11) 0.8699(9) 1.0567(5) 0.138(3) Uani 1 d . . .
H5 H 0.6310 0.8828 1.0968 0.165 Uiso 1 calc . . R
C7 C 0.9525(11) 0.8652(9) 1.0236(6) 0.131(3) Uani 1 d . . .
H7 H 1.0359 0.8724 1.0417 0.157 Uiso 1 calc . . R
C6 C 0.8318(13) 0.8745(9) 1.0861(6) 0.147(4) Uani 1 d . . .
H6 H 0.8356 0.8836 1.1462 0.176 Uiso 1 calc . . DR
O6 O 0.4007(3) 0.9744(3) 0.4597(2) 0.0648(7) Uani 1 d . . .
C14 C 1.2279(5) 0.5576(4) 0.5383(3) 0.0671(11) Uani 1 d . . .
H14A H 1.2297 0.4798 0.5232 0.081 Uiso 1 calc . . R
H14B H 1.2227 0.6091 0.4831 0.081 Uiso 1 calc . . R
N2 N 1.3568(4) 0.5550(3) 0.5752(3) 0.0622(8) Uani 1 d . . .
H2A H 1.3898 0.6167 0.5666 0.075 Uiso 1 calc . . R
C15 C 1.4239(5) 0.4638(4) 0.6205(3) 0.0623(10) Uani 1 d . . .
H15 H 1.3879 0.3974 0.6264 0.075 Uiso 1 calc . . R
C16 C 1.5462(5) 0.4547(4) 0.6617(3) 0.0599(10) Uani 1 d . . .
C13 C 1.0961(5) 0.5994(4) 0.6035(3) 0.0660(10) Uani 1 d . . .
C25 C 1.6113(5) 0.5511(4) 0.6517(3) 0.0624(10) Uani 1 d . . .
C17 C 1.6059(5) 0.3476(4) 0.7145(3) 0.0666(11) Uani 1 d . . .
C24 C 1.7347(5) 0.5397(5) 0.6939(4) 0.0749(12) Uani 1 d . . .
H24 H 1.7794 0.6012 0.6867 0.090 Uiso 1 calc . . R
C18 C 1.5499(6) 0.2479(4) 0.7265(4) 0.0779(13) Uani 1 d . . .
H18 H 1.4707 0.2488 0.6993 0.093 Uiso 1 calc . . R
C22 C 1.7273(6) 0.3415(5) 0.7565(4) 0.0778(13) Uani 1 d . . .
C23 C 1.7882(6) 0.4399(5) 0.7448(4) 0.0859(15) Uani 1 d . . .
H23 H 1.8675 0.4360 0.7730 0.103 Uiso 1 calc . . R
C19 C 1.6102(8) 0.1491(6) 0.7776(5) 0.0972(19) Uani 1 d . . .
H19 H 1.5722 0.0837 0.7841 0.117 Uiso 1 calc . . R
C21 C 1.7845(8) 0.2394(6) 0.8089(5) 0.102(2) Uani 1 d . . .
H21 H 1.8637 0.2368 0.8367 0.122 Uiso 1 calc . . R
C20 C 1.7295(8) 0.1464(6) 0.8203(5) 0.104(2) Uani 1 d . . .
H20 H 1.7692 0.0802 0.8560 0.125 Uiso 1 calc . . R
O3 O 1.5645(4) 0.6447(3) 0.6026(2) 0.0691(8) Uani 1 d . . .
O2 O 1.1018(5) 0.5307(4) 0.6876(3) 0.0762(14) Uani 0.783(9) d . . .
H2B H 1.1703 0.5356 0.7108 0.114 Uiso 0.783(9) calc . . GR
O10 O 1.2539(7) 0.6129(6) 0.8052(4) 0.1290(17) Uani 1 d . . D
H10 H 1.2914 0.6682 0.7937 0.194 Uiso 1 calc . . GR
C32 C 1.301(3) 0.5467(17) 0.8832(9) 0.362(16) Uani 1 d . . D
H32A H 1.3879 0.4925 0.8676 0.543 Uiso 1 calc . . GR
H32B H 1.2332 0.5046 0.9109 0.543 Uiso 1 calc . . GR
H32C H 1.3155 0.5977 0.9244 0.543 Uiso 1 calc . . GR
O2A O 0.9955(16) 0.5819(15) 0.5606(13) 0.080(6) Uani 0.217(9) d . . .
H2AA H 0.9314 0.5685 0.5974 0.121 Uiso 0.217(9) calc . . GR


_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 O1 2.304(3) . ?
Dy1 O4 2.449(3) . ?
Dy1 O9 2.566(4) . ?
Dy1 O7 2.452(3) . ?
Dy1 O5 2.410(3) . ?
Dy1 C30 2.797(4) . ?
Dy1 O8 2.510(4) . ?
Dy1 C26 2.770(5) . ?
Dy1 C28 2.885(4) . ?
Dy1 O6 2.553(3) . ?
Dy1 O6 2.349(3) 2_676 ?
Dy1 O3 2.287(3) 1_455 ?
O1 C1 1.284(5) . ?
N1 C12 1.446(6) . ?
N1 C11 1.284(6) . ?
O4 C26 1.251(6) . ?
O9 C30 1.199(6) . ?
O7 C28 1.246(5) . ?
O5 C26 1.228(6) . ?
C30 O8 1.155(6) . ?
C30 C31 1.49994(12) . ?
C26 C27 1.549(7) . ?
C28 C29 1.499(6) . ?
C28 O6 1.275(5) . ?
C1 C10 1.414(7) . ?
C1 C2 1.410(7) . ?
C12 C13 1.518(6) . ?
C10 C11 1.411(7) . ?
C10 C9 1.450(7) . ?
C2 C3 1.358(8) . ?
C9 C4 1.435(10) . ?
C9 C8 1.403(9) . ?
C4 C3 1.417(10) . ?
C4 C5 1.405(10) . ?
C8 C7 1.359(10) . ?
C5 C6 1.339(13) . ?
C7 C6 1.412(14) . ?
O6 Dy1 2.349(3) 2_676 ?
C14 N2 1.451(6) . ?
C14 C13 1.544(6) . ?
N2 C15 1.294(6) . ?
C15 C16 1.410(7) . ?
C16 C25 1.426(7) . ?
C16 C17 1.455(6) . ?
C13 O2 1.421(7) . ?
C13 O2A 1.325(18) . ?
C25 C24 1.423(7) . ?
C25 O3 1.280(6) . ?
C17 C18 1.406(7) . ?
C17 C22 1.415(7) . ?
C24 C23 1.362(7) . ?
C18 C19 1.375(8) . ?
C22 C23 1.421(8) . ?
C22 C21 1.403(8) . ?
C19 C20 1.411(11) . ?
C21 C20 1.328(10) . ?
O3 Dy1 2.287(3) 1_655 ?
O10 C32 1.4007(10) . ?

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 O4 73.92(11) . . ?
O1 Dy1 O9 79.52(12) . . ?
O1 Dy1 O7 148.94(12) . . ?
O1 Dy1 O5 125.41(11) . . ?
O1 Dy1 C30 83.73(13) . . ?
O1 Dy1 O8 86.77(13) . . ?
O1 Dy1 C26 100.42(13) . . ?
O1 Dy1 C28 159.43(12) . . ?
O1 Dy1 O6 85.74(11) . 2_676 ?
O1 Dy1 O6 147.40(10) . . ?
O4 Dy1 O9 144.78(12) . . ?
O4 Dy1 O7 129.42(11) . . ?
O4 Dy1 C30 157.56(14) . . ?
O4 Dy1 O8 147.68(13) . . ?
O4 Dy1 C26 26.86(13) . . ?
O4 Dy1 C28 125.32(12) . . ?
O4 Dy1 O6 111.91(11) . . ?
O9 Dy1 C30 25.37(14) . . ?
O9 Dy1 C26 152.71(13) . . ?
O9 Dy1 C28 85.19(12) . . ?
O7 Dy1 O9 70.25(12) . . ?
O7 Dy1 C30 72.11(14) . . ?
O7 Dy1 O8 79.25(13) . . ?
O7 Dy1 C26 103.17(13) . . ?
O7 Dy1 C28 25.37(11) . . ?
O7 Dy1 O6 51.54(10) . . ?
O5 Dy1 O4 53.02(11) . . ?
O5 Dy1 O9 138.43(12) . . ?
O5 Dy1 O7 76.94(12) . . ?
O5 Dy1 C30 149.04(14) . . ?
O5 Dy1 O8 145.67(13) . . ?
O5 Dy1 C26 26.28(13) . . ?
O5 Dy1 C28 75.06(12) . . ?
O5 Dy1 O6 74.00(11) . . ?
C30 Dy1 C28 76.64(14) . . ?
O8 Dy1 O9 49.70(12) . . ?
O8 Dy1 C30 24.38(14) . . ?
O8 Dy1 C26 157.19(14) . . ?
O8 Dy1 C28 72.82(13) . . ?
O8 Dy1 O6 71.85(12) . . ?
C26 Dy1 C30 175.19(13) . . ?
C26 Dy1 C28 99.48(13) . . ?
O6 Dy1 O4 76.98(12) 2_676 . ?
O6 Dy1 O9 123.97(12) 2_676 . ?
O6 Dy1 O9 102.96(11) . . ?
O6 Dy1 O7 116.88(10) 2_676 . ?
O6 Dy1 O5 93.26(12) 2_676 . ?
O6 Dy1 C30 99.84(14) 2_676 . ?
O6 Dy1 C30 86.00(14) . . ?
O6 Dy1 O8 75.94(12) 2_676 . ?
O6 Dy1 C26 91.68(13) . . ?
O6 Dy1 C26 82.99(13) 2_676 . ?
O6 Dy1 C28 91.57(11) 2_676 . ?
O6 Dy1 C28 26.22(11) . . ?
O6 Dy1 O6 65.69(12) 2_676 . ?
O3 Dy1 O1 87.00(12) 1_455 . ?
O3 Dy1 O4 86.37(12) 1_455 . ?
O3 Dy1 O9 69.35(12) 1_455 . ?
O3 Dy1 O7 76.03(11) 1_455 . ?
O3 Dy1 O5 78.63(12) 1_455 . ?
O3 Dy1 C30 94.49(15) 1_455 . ?
O3 Dy1 O8 118.84(13) 1_455 . ?
O3 Dy1 C26 83.37(14) 1_455 . ?
O3 Dy1 C28 100.45(12) 1_455 . ?
O3 Dy1 O6 163.11(12) 1_455 2_676 ?
O3 Dy1 O6 124.66(11) 1_455 . ?
C1 O1 Dy1 156.1(3) . . ?
C11 N1 C12 124.3(4) . . ?
C26 O4 Dy1 91.0(3) . . ?
C30 O9 Dy1 88.1(3) . . ?
C28 O7 Dy1 97.1(3) . . ?
C26 O5 Dy1 93.4(3) . . ?
O9 C30 Dy1 66.5(2) . . ?
O9 C30 C31 113.7(5) . . ?
O8 C30 Dy1 63.8(3) . . ?
O8 C30 O9 130.0(4) . . ?
O8 C30 C31 116.2(5) . . ?
C31 C30 Dy1 169.9(4) . . ?
C30 O8 Dy1 91.9(3) . . ?
O4 C26 Dy1 62.1(2) . . ?
O4 C26 C27 118.8(5) . . ?
O5 C26 Dy1 60.3(3) . . ?
O5 C26 O4 122.0(4) . . ?
O5 C26 C27 119.2(5) . . ?
C27 C26 Dy1 173.1(4) . . ?
O7 C28 Dy1 57.5(2) . . ?
O7 C28 C29 121.0(4) . . ?
O7 C28 O6 119.5(4) . . ?
C29 C28 Dy1 173.9(4) . . ?
O6 C28 Dy1 62.2(2) . . ?
O6 C28 C29 119.4(4) . . ?
O1 C1 C10 121.5(4) . . ?
O1 C1 C2 120.7(5) . . ?
C2 C1 C10 117.8(4) . . ?
N1 C12 C13 111.6(4) . . ?
C1 C10 C9 121.2(5) . . ?
C11 C10 C1 120.5(4) . . ?
C11 C10 C9 118.3(5) . . ?
N1 C11 C10 127.6(5) . . ?
C3 C2 C1 121.7(6) . . ?
C4 C9 C10 117.8(6) . . ?
C8 C9 C10 125.2(6) . . ?
C8 C9 C4 117.0(6) . . ?
C3 C4 C9 118.3(6) . . ?
C5 C4 C9 117.8(8) . . ?
C5 C4 C3 123.2(7) . . ?
C2 C3 C4 122.5(6) . . ?
C7 C8 C9 123.0(8) . . ?
C6 C5 C4 123.7(9) . . ?
C8 C7 C6 119.8(9) . . ?
C5 C6 C7 118.5(7) . . ?
Dy1 O6 Dy1 114.31(12) 2_676 . ?
C28 O6 Dy1 152.4(3) . 2_676 ?
C28 O6 Dy1 91.6(3) . . ?
N2 C14 C13 113.3(4) . . ?
C15 N2 C14 122.7(4) . . ?
N2 C15 C16 126.6(4) . . ?
C15 C16 C25 119.9(4) . . ?
C15 C16 C17 120.2(4) . . ?
C25 C16 C17 119.9(4) . . ?
C12 C13 C14 111.1(4) . . ?
O2 C13 C12 110.8(4) . . ?
O2 C13 C14 111.3(4) . . ?
O2A C13 C12 110.8(8) . . ?
O2A C13 C14 102.4(8) . . ?
O2A C13 O2 110.2(9) . . ?
C24 C25 C16 118.8(4) . . ?
O3 C25 C16 121.3(4) . . ?
O3 C25 C24 119.9(4) . . ?
C18 C17 C16 123.7(5) . . ?
C18 C17 C22 117.3(4) . . ?
C22 C17 C16 119.1(4) . . ?
C23 C24 C25 120.9(5) . . ?
C19 C18 C17 121.2(6) . . ?
C17 C22 C23 119.0(4) . . ?
C21 C22 C17 119.7(5) . . ?
C21 C22 C23 121.4(5) . . ?
C24 C23 C22 122.3(5) . . ?
C18 C19 C20 120.3(6) . . ?
C20 C21 C22 122.3(6) . . ?
C21 C20 C19 119.3(6) . . ?
C25 O3 Dy1 146.7(3) . 1_655 ?

_olex2_submission_special_instructions 'No special instructions were received'
_oxdiff_exptl_absorpt_empirical_details 
;
Empirical correction (ABSPACK) includes:
- Absorption correction using spherical harmonics
- Frame scaling
;
_oxdiff_exptl_absorpt_empirical_full_max 1.728
_oxdiff_exptl_absorpt_empirical_full_min 0.677
