# Supplementary Information (SI) for Dalton Transactions.
# This journal is © The Royal Society of Chemistry 2026

####################################################################### 
# 
# 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_ann154_0m
_database_code_depnum_ccdc_archive 'CCDC 2477288'
loop_
_audit_author_name
_audit_author_address
'Anna Vologzhanina'
;INEOS RAS
Russia
;
_audit_update_record             
;
2025-07-30 deposited with the CCDC.	2026-05-05 downloaded from the CCDC.
;
_audit_creation_date             2025-07-30
_audit_creation_method           
;
Olex2 1.5
(compiled 2025.05.31 svn.r86d253d1 for OlexSys, GUI svn.r7254)
;
_shelx_SHELXL_version_number     2018/3
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C32 H51 B9 Cl Dy K N3 O, 0.5(C4 H8 O)'
_chemical_formula_sum            'C34 H55 B9 Cl Dy K N3 O1.50'
_chemical_formula_weight         864.15
_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'
B B 0.0013 0.0007 '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'
K K 0.2009 0.2494 '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/n 1'
_space_group_name_Hall           '-P 2yn'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'

_cell_length_a                   16.6956(6)
_cell_length_b                   16.1043(5)
_cell_length_c                   18.3134(6)
_cell_angle_alpha                90
_cell_angle_beta                 111.7000(10)
_cell_angle_gamma                90
_cell_volume                     4575.0(3)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    892
_cell_measurement_temperature    140
_cell_measurement_theta_max      30.74
_cell_measurement_theta_min      2.51
_shelx_estimated_absorpt_T_max   0.736
_shelx_estimated_absorpt_T_min   0.640
_exptl_absorpt_coefficient_mu    1.812
_exptl_absorpt_correction_T_max  0.3393
_exptl_absorpt_correction_T_min  0.2421
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
SADABS-2016/2 (Bruker,2016/2) was used for absorption correction.
wR2(int) was 0.1202 before and 0.0430 after correction.
The Ratio of minimum to maximum transmission is 0.7135.
The λ/2 correction factor is Not present.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            'light gray'
_exptl_crystal_colour_modifier   light
_exptl_crystal_colour_primary    gray
_exptl_crystal_density_diffrn    1.255
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       prism
_exptl_crystal_F_000             1756
_exptl_crystal_size_max          0.27
_exptl_crystal_size_mid          0.21
_exptl_crystal_size_min          0.18
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0349
_diffrn_reflns_av_unetI/netI     0.0465
_diffrn_reflns_Laue_measured_fraction_full 0.995
_diffrn_reflns_Laue_measured_fraction_max 0.993
_diffrn_reflns_limit_h_max       25
_diffrn_reflns_limit_h_min       -25
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_k_min       -24
_diffrn_reflns_limit_l_max       27
_diffrn_reflns_limit_l_min       -27
_diffrn_reflns_number            57461
_diffrn_reflns_point_group_measured_fraction_full 0.995
_diffrn_reflns_point_group_measured_fraction_max 0.993
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         32.605
_diffrn_reflns_theta_min         2.433
_diffrn_ambient_temperature      140
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.995
_diffrn_measured_fraction_theta_max 0.993
_diffrn_measurement_device_type  'Bruker Apex II CCD area detector'
_diffrn_measurement_method       ?
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   ?
_diffrn_source_current           30.0
_diffrn_source_power             1.5
_diffrn_source_voltage           50.0
_diffrn_special_details          ?
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                12369
_reflns_number_total             16590
_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 1.5 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_structure_refinement  'XL  (Sheldrick, 2008)'
_computing_structure_solution    'SHELXT 2018/2 (Sheldrick, 2018)'
_refine_diff_density_max         1.843
_refine_diff_density_min         -1.450
_refine_diff_density_rms         0.132
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.002
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     488
_refine_ls_number_reflns         16590
_refine_ls_number_restraints     6
_refine_ls_R_factor_all          0.0552
_refine_ls_R_factor_gt           0.0359
_refine_ls_restrained_S_all      1.008
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0230P)²+14.4045P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0860
_refine_ls_wR_factor_ref         0.0910
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All H(H,H) groups, All B(H) groups, All C(H) groups, All C(H,H) groups, All
  C(H,H,H,H,H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2. Uiso/Uaniso restraints and constraints
Uanis(O1S) \\sim Ueq: with sigma of 0.002 and sigma for terminal atoms of 0.002
Uanis(C2S) = Uanis(O1S) = Uanis(C4S) = Uanis(C1S) = Uanis(C3S) = Uanis(C8S) =
Uanis(O2S) = Uanis(C5S) = Uanis(C7S) = Uanis(C6S)
3. Others
 Fixed Sof: O1S(0.25) C4S(0.25) H4SA(0.25) H4SB(0.25) C3S(0.25) H3SA(0.25)
 H3SB(0.25) C2S(0.25) H2SA(0.25) H2SB(0.25) C1S(0.25) H1SA(0.25) H1SB(0.25)
 O2S(0.25) C8S(0.25) H8SA(0.25) H8SB(0.25) C7S(0.25) H7SA(0.25) H7SB(0.25)
 C6S(0.25) H6SA(0.25) H6SB(0.25) C5S(0.25) H5SA(0.25) H5SB(0.25)
4.a Free rotating group:
 O1S(C4S,C3S,C2S,C1S), O2S(C8S,C7S,C6S,C5S)
4.b Secondary CH2 refined with riding coordinates:
 C12(H12A,H12B), C21(H21A,H21B), C30(H30A,H30B), C4S(H4SA,H4SB), C3S(H3SA,
 H3SB), C2S(H2SA,H2SB), C1S(H1SA,H1SB), C8S(H8SA,H8SB), C7S(H7SA,H7SB),
 C6S(H6SA,H6SB), C5S(H5SA,H5SB)
4.c Aromatic/amide H refined with riding coordinates:
 C8(H8), C9(H9), C10(H10), C11(H11), C17(H17), C18(H18), C19(H19), C20(H20),
 C26(H26), C27(H27), C28(H28), C29(H29)
4.d Idealised Me refined as rotating group:
 C1(H1A,H1B,H1C), C4(H4A,H4B,H4C), C13(H13A,H13B,H13C), C14(H14A,H14B,H14C),
 C22(H22A,H22B,H22C), C23(H23A,H23B,H23C), C31(H31A,H31B,H31C), C32(H32A,H32B,
 H32C)
;
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     dual
_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 0.67974(2) 0.26384(2) 0.26987(2) 0.01614(3) Uani 1 1 d . . . . .
Cl1 Cl 0.78610(5) 0.14112(5) 0.29500(4) 0.02539(14) Uani 1 1 d . . . . .
O1 O 0.65100(12) 0.32201(12) 0.35746(11) 0.0183(4) Uani 1 1 d . . . . .
N1 N 0.80563(15) 0.35751(15) 0.32845(14) 0.0199(5) Uani 1 1 d . . . . .
C1 C 0.7427(2) 0.1563(2) 0.07409(19) 0.0272(6) Uani 1 1 d . . . . .
H1A H 0.788927 0.157125 0.126124 0.041 Uiso 1 1 calc R U . . .
H1B H 0.767719 0.159268 0.033476 0.041 Uiso 1 1 calc R U . . .
H1C H 0.709483 0.104844 0.067812 0.041 Uiso 1 1 calc R U . . .
B1 B 0.6186(2) 0.2325(2) 0.11325(18) 0.0202(6) Uani 1 1 d . . . . .
N2 N 0.56581(16) 0.16484(16) 0.28209(15) 0.0226(5) Uani 1 1 d . . . . .
C2 C 0.68352(17) 0.23039(19) 0.06612(16) 0.0201(5) Uani 1 1 d . . . . .
B2 B 0.6082(2) 0.3359(2) 0.13736(19) 0.0218(6) Uani 1 1 d . . . . .
N3 N 0.48542(16) 0.52404(16) 0.29694(15) 0.0233(5) Uani 1 1 d . . . . .
C3 C 0.71924(18) 0.31907(19) 0.06205(17) 0.0224(6) Uani 1 1 d . . . . .
B3 B 0.6818(2) 0.3869(2) 0.1059(2) 0.0236(6) Uani 1 1 d . . . . .
C4 C 0.8108(2) 0.3269(2) 0.0634(2) 0.0347(8) Uani 1 1 d . . . . .
H4A H 0.851141 0.301027 0.111331 0.052 Uiso 1 1 calc R U . . .
H4B H 0.825332 0.385786 0.062594 0.052 Uiso 1 1 calc R U . . .
H4C H 0.814671 0.299056 0.017312 0.052 Uiso 1 1 calc R U . . .
B4 B 0.5755(2) 0.2213(2) 0.00869(19) 0.0209(6) Uani 1 1 d . . . . .
H4 H 0.553(2) 0.163(2) -0.019(2) 0.025 Uiso 1 1 d . U . . .
C5 C 0.66277(18) 0.32560(18) 0.43750(16) 0.0192(5) Uani 1 1 d . . . . .
B5 B 0.5263(2) 0.2912(2) 0.05420(19) 0.0209(6) Uani 1 1 d . . . . .
C6 C 0.73634(18) 0.38647(18) 0.48151(16) 0.0203(5) Uani 1 1 d . . . . .
B6 B 0.5690(2) 0.3924(2) 0.04977(19) 0.0215(6) Uani 1 1 d . . . . .
C7 C 0.81498(18) 0.38739(19) 0.46954(16) 0.0211(5) Uani 1 1 d . . . . .
B7 B 0.6406(2) 0.3829(2) 0.0002(2) 0.0247(7) Uani 1 1 d . . . . .
C8 C 0.8809(2) 0.4403(2) 0.51527(18) 0.0267(6) Uani 1 1 d . . . . .
H8 H 0.934028 0.440776 0.507369 0.032 Uiso 1 1 calc R U . . .
B8 B 0.6451(2) 0.2779(2) -0.02449(19) 0.0244(7) Uani 1 1 d . . . . .
H8A H 0.665(2) 0.256(2) -0.071(2) 0.029 Uiso 1 1 d . U . . .
C9 C 0.8709(2) 0.4920(2) 0.57185(19) 0.0314(7) Uani 1 1 d . . . . .
H9 H 0.916421 0.527694 0.601943 0.038 Uiso 1 1 calc R U . . .
B9 B 0.5456(2) 0.3217(2) -0.03234(19) 0.0229(6) Uani 1 1 d . . . . .
C10 C 0.7942(2) 0.4911(2) 0.58398(18) 0.0312(7) Uani 1 1 d . . . . .
H10 H 0.786576 0.526140 0.622679 0.037 Uiso 1 1 calc R U . . .
C11 C 0.7277(2) 0.4386(2) 0.53918(18) 0.0260(6) Uani 1 1 d . . . . .
H11 H 0.675156 0.438321 0.548102 0.031 Uiso 1 1 calc R U . . .
C12 C 0.83743(18) 0.33155(19) 0.41361(16) 0.0212(5) Uani 1 1 d . . . . .
H12A H 0.900993 0.326657 0.432753 0.025 Uiso 1 1 calc R U . . .
H12B H 0.814297 0.275512 0.416311 0.025 Uiso 1 1 calc R U . . .
C13 C 0.7827(2) 0.44649(18) 0.31752(17) 0.0236(6) Uani 1 1 d . . . . .
H13A H 0.764576 0.460768 0.261708 0.035 Uiso 1 1 calc R U . . .
H13B H 0.832868 0.480061 0.347991 0.035 Uiso 1 1 calc R U . . .
H13C H 0.735316 0.457651 0.335598 0.035 Uiso 1 1 calc R U . . .
C14 C 0.8740(2) 0.3412(2) 0.29682(19) 0.0281(6) Uani 1 1 d . . . . .
H14A H 0.891138 0.282727 0.305073 0.042 Uiso 1 1 calc R U . . .
H14B H 0.923992 0.376500 0.324020 0.042 Uiso 1 1 calc R U . . .
H14C H 0.852020 0.353680 0.240455 0.042 Uiso 1 1 calc R U . . .
C15 C 0.68764(18) 0.2366(2) 0.47150(16) 0.0218(5) Uani 1 1 d . . . . .
C16 C 0.63858(19) 0.16765(19) 0.43192(18) 0.0234(6) Uani 1 1 d . . . . .
C17 C 0.6604(2) 0.0890(2) 0.4655(2) 0.0304(7) Uani 1 1 d . . . . .
H17 H 0.627746 0.042256 0.439151 0.036 Uiso 1 1 calc R U . . .
C18 C 0.7292(2) 0.0776(2) 0.5371(2) 0.0344(8) Uani 1 1 d . . . . .
H18 H 0.742961 0.023615 0.559137 0.041 Uiso 1 1 calc R U . . .
C19 C 0.7766(2) 0.1450(2) 0.5751(2) 0.0322(7) Uani 1 1 d . . . . .
H19 H 0.823324 0.137669 0.623770 0.039 Uiso 1 1 calc R U . . .
C20 C 0.7565(2) 0.2237(2) 0.54289(18) 0.0275(6) Uani 1 1 d . . . . .
H20 H 0.790134 0.269784 0.569702 0.033 Uiso 1 1 calc R U . . .
C21 C 0.55681(19) 0.17559(19) 0.36002(17) 0.0236(6) Uani 1 1 d . . . . .
H21A H 0.515048 0.133866 0.363978 0.028 Uiso 1 1 calc R U . . .
H21B H 0.531761 0.231113 0.360965 0.028 Uiso 1 1 calc R U . . .
C22 C 0.4829(2) 0.1912(2) 0.22140(19) 0.0301(7) Uani 1 1 d . . . . .
H22A H 0.474678 0.250847 0.226618 0.045 Uiso 1 1 calc R U . . .
H22B H 0.435519 0.160486 0.228320 0.045 Uiso 1 1 calc R U . . .
H22C H 0.483619 0.179700 0.169096 0.045 Uiso 1 1 calc R U . . .
C23 C 0.5788(2) 0.0760(2) 0.2692(2) 0.0304(7) Uani 1 1 d . . . . .
H23A H 0.581976 0.068837 0.217163 0.046 Uiso 1 1 calc R U . . .
H23B H 0.530487 0.043594 0.272204 0.046 Uiso 1 1 calc R U . . .
H23C H 0.632683 0.056755 0.309612 0.046 Uiso 1 1 calc R U . . .
C24 C 0.57791(18) 0.35232(18) 0.44715(16) 0.0199(5) Uani 1 1 d . . . . .
C25 C 0.52780(18) 0.41996(19) 0.40574(17) 0.0214(5) Uani 1 1 d . . . . .
C26 C 0.4504(2) 0.4380(2) 0.41565(19) 0.0266(6) Uani 1 1 d . . . . .
H26 H 0.415640 0.482490 0.386734 0.032 Uiso 1 1 calc R U . . .
C27 C 0.4229(2) 0.3926(2) 0.4666(2) 0.0298(7) Uani 1 1 d . . . . .
H27 H 0.369475 0.405067 0.471432 0.036 Uiso 1 1 calc R U . . .
C28 C 0.4739(2) 0.3295(2) 0.5100(2) 0.0305(7) Uani 1 1 d . . . . .
H28 H 0.456998 0.299629 0.546648 0.037 Uiso 1 1 calc R U . . .
C29 C 0.5500(2) 0.3096(2) 0.50010(18) 0.0259(6) Uani 1 1 d . . . . .
H29 H 0.584464 0.265621 0.530223 0.031 Uiso 1 1 calc R U . . .
C30 C 0.55677(19) 0.4785(2) 0.35499(18) 0.0238(6) Uani 1 1 d . . . . .
H30A H 0.598390 0.518881 0.389461 0.029 Uiso 1 1 calc R U . . .
H30B H 0.587028 0.445936 0.327170 0.029 Uiso 1 1 calc R U . . .
C31 C 0.4350(2) 0.4692(2) 0.2334(2) 0.0380(8) Uani 1 1 d . . . . .
H31A H 0.471029 0.449287 0.205255 0.057 Uiso 1 1 calc R U . . .
H31B H 0.385500 0.499673 0.197025 0.057 Uiso 1 1 calc R U . . .
H31C H 0.414515 0.421793 0.255199 0.057 Uiso 1 1 calc R U . . .
C32 C 0.5192(2) 0.5922(2) 0.2646(2) 0.0390(8) Uani 1 1 d . . . . .
H32A H 0.548927 0.631838 0.306426 0.059 Uiso 1 1 calc R U . . .
H32B H 0.471526 0.620209 0.223474 0.059 Uiso 1 1 calc R U . . .
H32C H 0.559794 0.570364 0.242051 0.059 Uiso 1 1 calc R U . . .
K1 K 0.86999(4) 0.07896(4) 0.45848(4) 0.02553(13) Uani 1 1 d . . . . .
O1S O 0.2972(5) 0.1740(5) 0.2717(6) 0.0507(12) Uani 0.25 1 d G U P A -1
C4S C 0.3183(5) 0.2563(6) 0.3030(7) 0.0507(12) Uani 0.25 1 d G . P A -1
H4SA H 0.351712 0.285988 0.276363 0.061 Uiso 0.25 1 calc R U P A -1
H4SB H 0.353122 0.253976 0.360003 0.061 Uiso 0.25 1 calc R U P A -1
C3S C 0.2339(7) 0.3000(6) 0.2886(8) 0.0507(12) Uani 0.25 1 d G . P A -1
H3SA H 0.218534 0.297845 0.335856 0.061 Uiso 0.25 1 calc R U P A -1
H3SB H 0.236774 0.358772 0.273899 0.061 Uiso 0.25 1 calc R U P A -1
C2S C 0.1707(5) 0.2526(7) 0.2224(7) 0.0507(12) Uani 0.25 1 d G . P A -1
H2SA H 0.170201 0.272306 0.171016 0.061 Uiso 0.25 1 calc R U P A -1
H2SB H 0.111830 0.256673 0.223027 0.061 Uiso 0.25 1 calc R U P A -1
C1S C 0.2055(6) 0.1652(6) 0.2397(7) 0.0507(12) Uani 0.25 1 d G . P A -1
H1SA H 0.184931 0.138021 0.278007 0.061 Uiso 0.25 1 calc R U P A -1
H1SB H 0.187019 0.131576 0.191005 0.061 Uiso 0.25 1 calc R U P A -1
O2S O 0.5552(5) -0.0025(7) 0.5671(5) 0.0507(12) Uani 0.25 1 d G . P B -1
C8S C 0.5054(8) 0.0723(6) 0.5451(7) 0.0507(12) Uani 0.25 1 d G . P B -1
H8SA H 0.543062 0.120026 0.545738 0.061 Uiso 0.25 1 calc R U P B -1
H8SB H 0.475935 0.083880 0.581992 0.061 Uiso 0.25 1 calc R U P B -1
C7S C 0.4402(6) 0.0585(8) 0.4632(7) 0.0507(12) Uani 0.25 1 d G . P B -1
H7SA H 0.383943 0.041183 0.464674 0.061 Uiso 0.25 1 calc R U P B -1
H7SB H 0.432043 0.109510 0.431119 0.061 Uiso 0.25 1 calc R U P B -1
C6S C 0.4790(8) -0.0091(9) 0.4314(5) 0.0507(12) Uani 0.25 1 d G . P B -1
H6SA H 0.520433 0.013280 0.409313 0.061 Uiso 0.25 1 calc R U P B -1
H6SB H 0.434121 -0.041506 0.390540 0.061 Uiso 0.25 1 calc R U P B -1
C5S C 0.5239(7) -0.0607(6) 0.5039(7) 0.0507(12) Uani 0.25 1 d G . P B -1
H5SA H 0.483084 -0.100190 0.513076 0.061 Uiso 0.25 1 calc R U P B -1
H5SB H 0.572114 -0.092496 0.498428 0.061 Uiso 0.25 1 calc R U P B -1
H2 H 0.588(3) 0.357(3) 0.183(3) 0.061 Uiso 1 1 d . U . . .
H3 H 0.722(3) 0.443(3) 0.130(3) 0.061 Uiso 1 1 d . U . . .
H7 H 0.654(3) 0.429(3) -0.037(3) 0.061 Uiso 1 1 d . U . . .
H5 H 0.460(2) 0.278(2) 0.054(2) 0.025(9) Uiso 1 1 d . . . . .
H9A H 0.493(2) 0.333(2) -0.088(2) 0.029 Uiso 1 1 d . U . . .
H6 H 0.532(2) 0.448(2) 0.049(2) 0.029 Uiso 1 1 d . U . . .
H1 H 0.611(2) 0.176(2) 0.148(2) 0.028(9) Uiso 1 1 d . . . . .


_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 Cl1 2.5819(7) . ?
Dy1 O1 2.0615(18) . ?
Dy1 N1 2.485(2) . ?
Dy1 B1 2.713(3) . ?
Dy1 N2 2.554(2) . ?
Dy1 B2 2.553(3) . ?
Dy1 H2 2.31(5) . ?
Dy1 H1 2.53(4) . ?
Cl1 K1 2.9710(10) . ?
O1 C5 1.406(3) . ?
N1 C12 1.509(4) . ?
N1 C13 1.478(4) . ?
N1 C14 1.482(4) . ?
C1 H1A 0.9800 . ?
C1 H1B 0.9800 . ?
C1 H1C 0.9800 . ?
C1 C2 1.521(4) . ?
B1 C2 1.617(4) . ?
B1 B2 1.747(5) . ?
B1 B4 1.788(4) . ?
B1 B5 1.789(4) . ?
B1 H1 1.15(4) . ?
N2 C21 1.499(4) . ?
N2 C22 1.481(4) . ?
N2 C23 1.479(4) . ?
C2 C3 1.560(4) . ?
C2 B4 1.725(4) . ?
C2 B8 1.721(4) . ?
B2 B3 1.742(5) . ?
B2 B5 1.780(5) . ?
B2 B6 1.747(5) . ?
B2 H2 1.06(5) . ?
N3 C30 1.467(4) . ?
N3 C31 1.455(4) . ?
N3 C32 1.456(4) . ?
C3 B3 1.613(5) . ?
C3 C4 1.524(4) . ?
C3 B7 1.721(5) . ?
C3 B8 1.741(4) . ?
B3 B6 1.783(5) . ?
B3 B7 1.800(5) . ?
B3 K1 3.310(4) 2_655 ?
B3 H3 1.11(5) . ?
C4 H4A 0.9800 . ?
C4 H4B 0.9800 . ?
C4 H4C 0.9800 . ?
B4 H4 1.07(4) . ?
B4 B5 1.773(5) . ?
B4 B8 1.753(5) . ?
B4 B9 1.776(5) . ?
C5 C6 1.545(4) . ?
C5 C15 1.557(4) . ?
C5 C24 1.552(4) . ?
B5 B6 1.791(5) . ?
B5 B9 1.799(5) . ?
B5 K1 3.298(3) 4_565 ?
B5 H5 1.13(3) . ?
C6 C7 1.409(4) . ?
C6 C11 1.398(4) . ?
B6 B7 1.756(5) . ?
B6 B9 1.809(5) . ?
B6 K1 3.152(3) 4_565 ?
B6 K1 3.195(4) 2_655 ?
B6 H6 1.09(4) . ?
C7 C8 1.399(4) . ?
C7 C12 1.511(4) . ?
B7 B8 1.760(5) . ?
B7 B9 1.773(5) . ?
B7 K1 3.267(4) 2_655 ?
B7 H7 1.10(5) . ?
C8 H8 0.9500 . ?
C8 C9 1.387(5) . ?
B8 H8A 1.08(4) . ?
B8 B9 1.761(5) . ?
C9 H9 0.9500 . ?
C9 C10 1.379(5) . ?
B9 K1 3.289(4) 4_565 ?
B9 H9A 1.09(4) . ?
C10 H10 0.9500 . ?
C10 C11 1.395(5) . ?
C11 H11 0.9500 . ?
C12 H12A 0.9900 . ?
C12 H12B 0.9900 . ?
C13 H13A 0.9800 . ?
C13 H13B 0.9800 . ?
C13 H13C 0.9800 . ?
C14 H14A 0.9800 . ?
C14 H14B 0.9800 . ?
C14 H14C 0.9800 . ?
C15 C16 1.410(4) . ?
C15 C20 1.401(4) . ?
C16 C17 1.395(4) . ?
C16 C21 1.512(4) . ?
C17 H17 0.9500 . ?
C17 C18 1.400(5) . ?
C18 H18 0.9500 . ?
C18 C19 1.372(5) . ?
C18 K1 3.178(3) . ?
C19 H19 0.9500 . ?
C19 C20 1.386(4) . ?
C19 K1 3.254(3) . ?
C20 H20 0.9500 . ?
C21 H21A 0.9900 . ?
C21 H21B 0.9900 . ?
C22 H22A 0.9800 . ?
C22 H22B 0.9800 . ?
C22 H22C 0.9800 . ?
C23 H23A 0.9800 . ?
C23 H23B 0.9800 . ?
C23 H23C 0.9800 . ?
C24 C25 1.412(4) . ?
C24 C29 1.401(4) . ?
C25 C26 1.401(4) . ?
C25 C30 1.523(4) . ?
C26 H26 0.9500 . ?
C26 C27 1.390(4) . ?
C27 H27 0.9500 . ?
C27 C28 1.373(5) . ?
C28 H28 0.9500 . ?
C28 C29 1.387(4) . ?
C29 H29 0.9500 . ?
C30 H30A 0.9900 . ?
C30 H30B 0.9900 . ?
C31 H31A 0.9800 . ?
C31 H31B 0.9800 . ?
C31 H31C 0.9800 . ?
C32 H32A 0.9800 . ?
C32 H32B 0.9800 . ?
C32 H32C 0.9800 . ?
K1 K1 4.7690(13) 3_756 ?
O1S C4S 1.4352 . ?
O1S C1S 1.4295 . ?
C4S H4SA 0.9900 . ?
C4S H4SB 0.9900 . ?
C4S C3S 1.5077 . ?
C3S H3SA 0.9900 . ?
C3S H3SB 0.9900 . ?
C3S C2S 1.4896 . ?
C2S H2SA 0.9900 . ?
C2S H2SB 0.9900 . ?
C2S C1S 1.5114 . ?
C1S H1SA 0.9900 . ?
C1S H1SB 0.9900 . ?
O2S C8S 1.4351 . ?
O2S C5S 1.4294 . ?
C8S H8SA 0.9900 . ?
C8S H8SB 0.9900 . ?
C8S C7S 1.5076 . ?
C7S H7SA 0.9900 . ?
C7S H7SB 0.9900 . ?
C7S C6S 1.4897 . ?
C6S H6SA 0.9900 . ?
C6S H6SB 0.9900 . ?
C6S C5S 1.5106 . ?
C5S H5SA 0.9900 . ?
C5S H5SB 0.9900 . ?

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
Cl1 Dy1 B1 90.66(7) . . ?
Cl1 Dy1 H2 148.9(12) . . ?
Cl1 Dy1 H1 77.6(8) . . ?
O1 Dy1 Cl1 123.49(6) . . ?
O1 Dy1 N1 77.95(8) . . ?
O1 Dy1 B1 143.34(8) . . ?
O1 Dy1 N2 79.66(8) . . ?
O1 Dy1 B2 111.81(9) . . ?
O1 Dy1 H2 87.6(12) . . ?
O1 Dy1 H1 141.3(8) . . ?
N1 Dy1 Cl1 88.37(6) . . ?
N1 Dy1 B1 119.80(9) . . ?
N1 Dy1 N2 151.56(8) . . ?
N1 Dy1 B2 99.09(10) . . ?
N1 Dy1 H2 98.4(12) . . ?
N1 Dy1 H1 139.1(8) . . ?
B1 Dy1 H2 59.6(12) . . ?
B1 Dy1 H1 25.0(8) . . ?
N2 Dy1 Cl1 89.54(6) . . ?
N2 Dy1 B1 88.58(9) . . ?
N2 Dy1 H2 97.9(12) . . ?
N2 Dy1 H1 67.5(8) . . ?
B2 Dy1 Cl1 124.49(8) . . ?
B2 Dy1 B1 38.60(10) . . ?
B2 Dy1 N2 105.39(10) . . ?
B2 Dy1 H2 24.5(12) . . ?
B2 Dy1 H1 61.1(8) . . ?
H2 Dy1 H1 77.5(14) . . ?
Dy1 Cl1 K1 118.32(3) . . ?
C5 O1 Dy1 147.85(17) . . ?
C12 N1 Dy1 101.32(16) . . ?
C13 N1 Dy1 113.23(17) . . ?
C13 N1 C12 112.5(2) . . ?
C13 N1 C14 108.5(2) . . ?
C14 N1 Dy1 111.99(18) . . ?
C14 N1 C12 109.1(2) . . ?
H1A C1 H1B 109.5 . . ?
H1A C1 H1C 109.5 . . ?
H1B C1 H1C 109.5 . . ?
C2 C1 H1A 109.5 . . ?
C2 C1 H1B 109.5 . . ?
C2 C1 H1C 109.5 . . ?
Dy1 B1 H1 68.7(18) . . ?
C2 B1 Dy1 120.25(18) . . ?
C2 B1 B2 107.7(3) . . ?
C2 B1 B4 60.63(17) . . ?
C2 B1 B5 106.6(2) . . ?
C2 B1 H1 120.8(18) . . ?
B2 B1 Dy1 65.76(14) . . ?
B2 B1 B4 109.2(2) . . ?
B2 B1 B5 60.42(19) . . ?
B2 B1 H1 125.3(18) . . ?
B4 B1 Dy1 175.0(2) . . ?
B4 B1 B5 59.42(17) . . ?
B4 B1 H1 115.5(18) . . ?
B5 B1 Dy1 116.38(18) . . ?
B5 B1 H1 120.6(18) . . ?
C21 N2 Dy1 110.57(17) . . ?
C22 N2 Dy1 105.96(18) . . ?
C22 N2 C21 106.6(2) . . ?
C23 N2 Dy1 115.55(18) . . ?
C23 N2 C21 109.6(2) . . ?
C23 N2 C22 108.0(3) . . ?
C1 C2 B1 120.4(3) . . ?
C1 C2 C3 118.5(2) . . ?
C1 C2 B4 119.1(2) . . ?
C1 C2 B8 116.0(2) . . ?
B1 C2 B4 64.60(18) . . ?
B1 C2 B8 114.9(2) . . ?
C3 C2 B1 110.5(2) . . ?
C3 C2 B4 112.4(2) . . ?
C3 C2 B8 63.88(19) . . ?
B8 C2 B4 61.16(18) . . ?
Dy1 B2 H2 65(3) . . ?
B1 B2 Dy1 75.64(15) . . ?
B1 B2 B5 60.98(19) . . ?
B1 B2 B6 107.6(2) . . ?
B1 B2 H2 126(3) . . ?
B3 B2 Dy1 112.91(19) . . ?
B3 B2 B1 102.6(2) . . ?
B3 B2 B5 108.7(2) . . ?
B3 B2 B6 61.48(19) . . ?
B3 B2 H2 126(3) . . ?
B5 B2 Dy1 124.8(2) . . ?
B5 B2 H2 115(3) . . ?
B6 B2 Dy1 173.8(2) . . ?
B6 B2 B5 61.04(19) . . ?
B6 B2 H2 116(3) . . ?
C31 N3 C30 110.5(3) . . ?
C31 N3 C32 109.2(3) . . ?
C32 N3 C30 109.8(2) . . ?
C2 C3 B3 111.7(2) . . ?
C2 C3 B7 111.5(2) . . ?
C2 C3 B8 62.57(19) . . ?
B3 C3 B7 65.3(2) . . ?
B3 C3 B8 115.8(2) . . ?
C4 C3 C2 118.3(3) . . ?
C4 C3 B3 120.4(3) . . ?
C4 C3 B7 118.5(3) . . ?
C4 C3 B8 114.7(3) . . ?
B7 C3 B8 61.08(19) . . ?
B2 B3 B6 59.40(19) . . ?
B2 B3 B7 107.7(2) . . ?
B2 B3 K1 115.79(18) . 2_655 ?
B2 B3 H3 130(2) . . ?
C3 B3 B2 107.2(2) . . ?
C3 B3 B6 105.5(2) . . ?
C3 B3 B7 60.3(2) . . ?
C3 B3 K1 123.6(2) . 2_655 ?
C3 B3 H3 117(2) . . ?
B6 B3 B7 58.67(19) . . ?
B6 B3 K1 70.56(16) . 2_655 ?
B6 B3 H3 123(2) . . ?
B7 B3 K1 72.80(16) . 2_655 ?
B7 B3 H3 113(2) . . ?
K1 B3 H3 55(2) 2_655 . ?
C3 C4 H4A 109.5 . . ?
C3 C4 H4B 109.5 . . ?
C3 C4 H4C 109.5 . . ?
H4A C4 H4B 109.5 . . ?
H4A C4 H4C 109.5 . . ?
H4B C4 H4C 109.5 . . ?
B1 B4 H4 122.0(19) . . ?
C2 B4 B1 54.77(16) . . ?
C2 B4 H4 117.8(19) . . ?
C2 B4 B5 102.7(2) . . ?
C2 B4 B8 59.31(18) . . ?
C2 B4 B9 104.3(2) . . ?
B5 B4 B1 60.32(18) . . ?
B5 B4 H4 130.0(19) . . ?
B5 B4 B9 60.89(19) . . ?
B8 B4 B1 105.2(2) . . ?
B8 B4 H4 116.8(19) . . ?
B8 B4 B5 108.3(2) . . ?
B8 B4 B9 59.87(19) . . ?
B9 B4 B1 107.4(2) . . ?
B9 B4 H4 127.4(19) . . ?
O1 C5 C6 110.3(2) . . ?
O1 C5 C15 107.0(2) . . ?
O1 C5 C24 110.4(2) . . ?
C6 C5 C15 109.4(2) . . ?
C6 C5 C24 110.4(2) . . ?
C24 C5 C15 109.2(2) . . ?
B1 B5 B6 103.9(2) . . ?
B1 B5 B9 106.4(2) . . ?
B1 B5 K1 172.4(2) . 4_565 ?
B1 B5 H5 122.0(18) . . ?
B2 B5 B1 58.61(18) . . ?
B2 B5 B6 58.58(18) . . ?
B2 B5 B9 108.2(2) . . ?
B2 B5 K1 113.92(18) . 4_565 ?
B2 B5 H5 121.7(18) . . ?
B4 B5 B1 60.26(18) . . ?
B4 B5 B2 108.4(2) . . ?
B4 B5 B6 107.2(2) . . ?
B4 B5 B9 59.64(19) . . ?
B4 B5 K1 124.48(18) . 4_565 ?
B4 B5 H5 120.1(18) . . ?
B6 B5 B9 60.53(19) . . ?
B6 B5 K1 69.46(14) . 4_565 ?
B6 B5 H5 125.3(18) . . ?
B9 B5 K1 73.91(15) . 4_565 ?
B9 B5 H5 122.8(18) . . ?
K1 B5 H5 62.1(18) 4_565 . ?
C7 C6 C5 122.2(2) . . ?
C11 C6 C5 119.4(3) . . ?
C11 C6 C7 118.3(3) . . ?
B2 B6 B3 59.12(19) . . ?
B2 B6 B5 60.38(19) . . ?
B2 B6 B7 109.5(2) . . ?
B2 B6 B9 109.2(2) . . ?
B2 B6 K1 121.83(19) . 4_565 ?
B2 B6 K1 121.00(19) . 2_655 ?
B2 B6 H6 117.4(19) . . ?
B3 B6 B5 106.3(2) . . ?
B3 B6 B9 107.8(2) . . ?
B3 B6 K1 173.9(2) . 4_565 ?
B3 B6 K1 77.68(16) . 2_655 ?
B3 B6 H6 121.0(19) . . ?
B5 B6 B9 59.94(19) . . ?
B5 B6 K1 78.39(15) . 4_565 ?
B5 B6 K1 175.21(19) . 2_655 ?
B5 B6 H6 121.7(19) . . ?
B7 B6 B3 61.15(19) . . ?
B7 B6 B5 107.6(2) . . ?
B7 B6 B9 59.61(19) . . ?
B7 B6 K1 76.51(17) . 2_655 ?
B7 B6 K1 121.64(18) . 4_565 ?
B7 B6 H6 123.6(19) . . ?
B9 B6 K1 77.91(15) . 4_565 ?
B9 B6 K1 121.76(19) . 2_655 ?
B9 B6 H6 124.5(19) . . ?
K1 B6 K1 97.42(9) 4_565 2_655 ?
K1 B6 H6 52.8(19) 4_565 . ?
K1 B6 H6 53.6(19) 2_655 . ?
C6 C7 C12 125.3(3) . . ?
C8 C7 C6 119.0(3) . . ?
C8 C7 C12 115.5(3) . . ?
C3 B7 B3 54.45(18) . . ?
C3 B7 B6 102.2(2) . . ?
C3 B7 B8 60.02(19) . . ?
C3 B7 B9 105.0(2) . . ?
C3 B7 K1 121.23(19) . 2_655 ?
C3 B7 H7 122(2) . . ?
B3 B7 K1 75.44(17) . 2_655 ?
B3 B7 H7 124(2) . . ?
B6 B7 B3 60.18(19) . . ?
B6 B7 B8 108.5(2) . . ?
B6 B7 B9 61.69(19) . . ?
B6 B7 K1 71.98(16) . 2_655 ?
B6 B7 H7 127(2) . . ?
B8 B7 B3 105.9(2) . . ?
B8 B7 B9 59.8(2) . . ?
B8 B7 K1 178.6(2) . 2_655 ?
B8 B7 H7 117(2) . . ?
B9 B7 B3 108.6(2) . . ?
B9 B7 K1 119.76(19) . 2_655 ?
B9 B7 H7 122(2) . . ?
K1 B7 H7 62(2) 2_655 . ?
C7 C8 H8 119.1 . . ?
C9 C8 C7 121.8(3) . . ?
C9 C8 H8 119.1 . . ?
C2 B8 C3 53.55(17) . . ?
C2 B8 B4 59.53(18) . . ?
C2 B8 B7 102.4(2) . . ?
C2 B8 H8A 120(2) . . ?
C2 B8 B9 105.1(2) . . ?
C3 B8 B4 102.8(2) . . ?
C3 B8 B7 58.90(19) . . ?
C3 B8 H8A 121(2) . . ?
C3 B8 B9 104.6(2) . . ?
B4 B8 B7 108.3(2) . . ?
B4 B8 H8A 123(2) . . ?
B4 B8 B9 60.71(19) . . ?
B7 B8 H8A 124.7(19) . . ?
B7 B8 B9 60.5(2) . . ?
B9 B8 H8A 128(2) . . ?
C8 C9 H9 120.3 . . ?
C10 C9 C8 119.4(3) . . ?
C10 C9 H9 120.3 . . ?
B4 B9 B5 59.47(18) . . ?
B4 B9 B6 106.3(2) . . ?
B4 B9 K1 124.76(19) . 4_565 ?
B4 B9 H9A 124(2) . . ?
B5 B9 B6 59.54(19) . . ?
B5 B9 K1 74.40(15) . 4_565 ?
B5 B9 H9A 121.3(19) . . ?
B6 B9 K1 69.56(15) . 4_565 ?
B6 B9 H9A 121.1(19) . . ?
B7 B9 B4 106.7(2) . . ?
B7 B9 B5 106.6(2) . . ?
B7 B9 B6 58.70(19) . . ?
B7 B9 K1 114.65(19) . 4_565 ?
B7 B9 H9A 122.4(19) . . ?
B8 B9 B4 59.42(19) . . ?
B8 B9 B5 106.8(2) . . ?
B8 B9 B6 106.1(2) . . ?
B8 B9 B7 59.7(2) . . ?
B8 B9 K1 174.4(2) . 4_565 ?
B8 B9 H9A 124.3(19) . . ?
K1 B9 H9A 57.6(19) 4_565 . ?
C9 C10 H10 120.1 . . ?
C9 C10 C11 119.7(3) . . ?
C11 C10 H10 120.1 . . ?
C6 C11 H11 119.1 . . ?
C10 C11 C6 121.8(3) . . ?
C10 C11 H11 119.1 . . ?
N1 C12 C7 117.1(2) . . ?
N1 C12 H12A 108.0 . . ?
N1 C12 H12B 108.0 . . ?
C7 C12 H12A 108.0 . . ?
C7 C12 H12B 108.0 . . ?
H12A C12 H12B 107.3 . . ?
N1 C13 H13A 109.5 . . ?
N1 C13 H13B 109.5 . . ?
N1 C13 H13C 109.5 . . ?
H13A C13 H13B 109.5 . . ?
H13A C13 H13C 109.5 . . ?
H13B C13 H13C 109.5 . . ?
N1 C14 H14A 109.5 . . ?
N1 C14 H14B 109.5 . . ?
N1 C14 H14C 109.5 . . ?
H14A C14 H14B 109.5 . . ?
H14A C14 H14C 109.5 . . ?
H14B C14 H14C 109.5 . . ?
C16 C15 C5 120.1(3) . . ?
C20 C15 C5 121.0(3) . . ?
C20 C15 C16 118.9(3) . . ?
C15 C16 C21 123.2(3) . . ?
C17 C16 C15 118.7(3) . . ?
C17 C16 C21 117.7(3) . . ?
C16 C17 H17 119.3 . . ?
C16 C17 C18 121.5(3) . . ?
C18 C17 H17 119.3 . . ?
C17 C18 H18 120.3 . . ?
C17 C18 K1 93.6(2) . . ?
C19 C18 C17 119.4(3) . . ?
C19 C18 H18 120.3 . . ?
C19 C18 K1 80.8(2) . . ?
K1 C18 H18 95.5 . . ?
C18 C19 H19 119.9 . . ?
C18 C19 C20 120.3(3) . . ?
C18 C19 K1 74.6(2) . . ?
C20 C19 H19 119.9 . . ?
C20 C19 K1 96.8(2) . . ?
K1 C19 H19 98.5 . . ?
C15 C20 H20 119.4 . . ?
C19 C20 C15 121.2(3) . . ?
C19 C20 H20 119.4 . . ?
N2 C21 C16 116.3(2) . . ?
N2 C21 H21A 108.2 . . ?
N2 C21 H21B 108.2 . . ?
C16 C21 H21A 108.2 . . ?
C16 C21 H21B 108.2 . . ?
H21A C21 H21B 107.4 . . ?
N2 C22 H22A 109.5 . . ?
N2 C22 H22B 109.5 . . ?
N2 C22 H22C 109.5 . . ?
H22A C22 H22B 109.5 . . ?
H22A C22 H22C 109.5 . . ?
H22B C22 H22C 109.5 . . ?
N2 C23 H23A 109.5 . . ?
N2 C23 H23B 109.5 . . ?
N2 C23 H23C 109.5 . . ?
H23A C23 H23B 109.5 . . ?
H23A C23 H23C 109.5 . . ?
H23B C23 H23C 109.5 . . ?
C25 C24 C5 122.5(2) . . ?
C29 C24 C5 119.6(3) . . ?
C29 C24 C25 117.9(3) . . ?
C24 C25 C30 123.1(2) . . ?
C26 C25 C24 118.9(3) . . ?
C26 C25 C30 117.9(3) . . ?
C25 C26 H26 119.1 . . ?
C27 C26 C25 121.8(3) . . ?
C27 C26 H26 119.1 . . ?
C26 C27 H27 120.3 . . ?
C28 C27 C26 119.3(3) . . ?
C28 C27 H27 120.3 . . ?
C27 C28 H28 120.1 . . ?
C27 C28 C29 119.8(3) . . ?
C29 C28 H28 120.1 . . ?
C24 C29 H29 118.9 . . ?
C28 C29 C24 122.1(3) . . ?
C28 C29 H29 118.9 . . ?
N3 C30 C25 113.3(2) . . ?
N3 C30 H30A 108.9 . . ?
N3 C30 H30B 108.9 . . ?
C25 C30 H30A 108.9 . . ?
C25 C30 H30B 108.9 . . ?
H30A C30 H30B 107.7 . . ?
N3 C31 H31A 109.5 . . ?
N3 C31 H31B 109.5 . . ?
N3 C31 H31C 109.5 . . ?
H31A C31 H31B 109.5 . . ?
H31A C31 H31C 109.5 . . ?
H31B C31 H31C 109.5 . . ?
N3 C32 H32A 109.5 . . ?
N3 C32 H32B 109.5 . . ?
N3 C32 H32C 109.5 . . ?
H32A C32 H32B 109.5 . . ?
H32A C32 H32C 109.5 . . ?
H32B C32 H32C 109.5 . . ?
Cl1 K1 B3 89.55(6) . 2_645 ?
Cl1 K1 B5 107.92(6) . 4_666 ?
Cl1 K1 B6 119.79(7) . 4_666 ?
Cl1 K1 B6 108.00(6) . 2_645 ?
Cl1 K1 B7 120.88(7) . 2_645 ?
Cl1 K1 B9 88.10(6) . 4_666 ?
Cl1 K1 C18 107.86(7) . . ?
Cl1 K1 C19 112.93(6) . . ?
Cl1 K1 K1 122.37(3) . 3_756 ?
B3 K1 K1 72.67(6) 2_645 3_756 ?
B5 K1 B3 146.42(9) 4_666 2_645 ?
B5 K1 K1 73.76(6) 4_666 3_756 ?
B6 K1 B3 31.76(8) 2_645 2_645 ?
B6 K1 B3 114.27(9) 4_666 2_645 ?
B6 K1 B5 114.70(8) 2_645 4_666 ?
B6 K1 B5 32.15(9) 4_666 4_666 ?
B6 K1 B6 82.58(9) 4_666 2_645 ?
B6 K1 B7 31.51(9) 2_645 2_645 ?
B6 K1 B7 98.96(9) 4_666 2_645 ?
B6 K1 B9 99.54(9) 2_645 4_666 ?
B6 K1 B9 32.53(9) 4_666 4_666 ?
B6 K1 C18 124.87(10) 4_666 . ?
B6 K1 C19 125.24(9) 2_645 . ?
B6 K1 C19 105.72(9) 4_666 . ?
B6 K1 K1 40.95(6) 2_645 3_756 ?
B6 K1 K1 41.63(6) 4_666 3_756 ?
B7 K1 B3 31.77(8) 2_645 2_645 ?
B7 K1 B5 126.14(9) 2_645 4_666 ?
B7 K1 B9 125.58(9) 2_645 4_666 ?
B7 K1 K1 62.08(6) 2_645 3_756 ?
B9 K1 B3 125.66(9) 4_666 2_645 ?
B9 K1 B5 31.69(8) 4_666 4_666 ?
B9 K1 K1 63.50(6) 4_666 3_756 ?
C18 K1 B3 90.88(9) . 2_645 ?
C18 K1 B5 109.66(10) . 4_666 ?
C18 K1 B6 108.49(9) . 2_645 ?
C18 K1 B7 77.03(9) . 2_645 ?
C18 K1 B9 140.80(10) . 4_666 ?
C18 K1 C19 24.59(10) . . ?
C18 K1 K1 126.18(7) . 3_756 ?
C19 K1 B3 114.45(9) . 2_645 ?
C19 K1 B5 85.48(9) . 4_666 ?
C19 K1 B7 94.78(9) . 2_645 ?
C19 K1 B9 116.25(9) . 4_666 ?
C19 K1 K1 124.44(6) . 3_756 ?
C1S O1S C4S 108.8 . . ?
O1S C4S H4SA 110.4 . . ?
O1S C4S H4SB 110.4 . . ?
O1S C4S C3S 106.6 . . ?
H4SA C4S H4SB 108.6 . . ?
C3S C4S H4SA 110.4 . . ?
C3S C4S H4SB 110.4 . . ?
C4S C3S H3SA 111.0 . . ?
C4S C3S H3SB 111.0 . . ?
H3SA C3S H3SB 109.0 . . ?
C2S C3S C4S 103.8 . . ?
C2S C3S H3SA 111.0 . . ?
C2S C3S H3SB 111.0 . . ?
C3S C2S H2SA 111.4 . . ?
C3S C2S H2SB 111.4 . . ?
C3S C2S C1S 101.8 . . ?
H2SA C2S H2SB 109.3 . . ?
C1S C2S H2SA 111.4 . . ?
C1S C2S H2SB 111.4 . . ?
O1S C1S C2S 105.3 . . ?
O1S C1S H1SA 110.7 . . ?
O1S C1S H1SB 110.7 . . ?
C2S C1S H1SA 110.7 . . ?
C2S C1S H1SB 110.7 . . ?
H1SA C1S H1SB 108.8 . . ?
C5S O2S C8S 108.8 . . ?
O2S C8S H8SA 110.4 . . ?
O2S C8S H8SB 110.4 . . ?
O2S C8S C7S 106.6 . . ?
H8SA C8S H8SB 108.6 . . ?
C7S C8S H8SA 110.4 . . ?
C7S C8S H8SB 110.4 . . ?
C8S C7S H7SA 111.0 . . ?
C8S C7S H7SB 111.0 . . ?
H7SA C7S H7SB 109.0 . . ?
C6S C7S C8S 103.8 . . ?
C6S C7S H7SA 111.0 . . ?
C6S C7S H7SB 111.0 . . ?
C7S C6S H6SA 111.4 . . ?
C7S C6S H6SB 111.4 . . ?
C7S C6S C5S 101.8 . . ?
H6SA C6S H6SB 109.3 . . ?
C5S C6S H6SA 111.4 . . ?
C5S C6S H6SB 111.4 . . ?
O2S C5S C6S 105.3 . . ?
O2S C5S H5SA 110.7 . . ?
O2S C5S H5SB 110.7 . . ?
C6S C5S H5SA 110.7 . . ?
C6S C5S H5SB 110.7 . . ?
H5SA C5S H5SB 108.8 . . ?

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 C5 C6 93.6(4) . . . . ?
Dy1 O1 C5 C15 -25.4(4) . . . . ?
Dy1 O1 C5 C24 -144.2(3) . . . . ?
Dy1 N1 C12 C7 -102.1(2) . . . . ?
Dy1 B1 C2 C1 75.4(3) . . . . ?
Dy1 B1 C2 C3 -68.5(3) . . . . ?
Dy1 B1 C2 B4 -174.3(2) . . . . ?
Dy1 B1 C2 B8 -138.3(2) . . . . ?
Dy1 B1 B2 B3 110.8(2) . . . . ?
Dy1 B1 B2 B5 -144.69(18) . . . . ?
Dy1 B1 B2 B6 174.5(2) . . . . ?
Dy1 B1 B5 B2 36.04(19) . . . . ?
Dy1 B1 B5 B4 176.9(2) . . . . ?
Dy1 B1 B5 B6 74.8(2) . . . . ?
Dy1 B1 B5 B9 137.7(2) . . . . ?
Dy1 N2 C21 C16 -54.4(3) . . . . ?
Dy1 B2 B3 C3 84.7(2) . . . . ?
Dy1 B2 B3 B6 -177.1(2) . . . . ?
Dy1 B2 B3 B7 148.3(2) . . . . ?
Dy1 B2 B3 K1 -132.74(13) . . . 2_655 ?
Dy1 B2 B5 B1 -43.0(2) . . . . ?
Dy1 B2 B5 B4 -78.3(3) . . . . ?
Dy1 B2 B5 B6 -177.6(3) . . . . ?
Dy1 B2 B5 B9 -141.5(2) . . . . ?
Dy1 B2 B5 K1 138.48(15) . . . 4_565 ?
O1 C5 C6 C7 -44.3(3) . . . . ?
O1 C5 C6 C11 140.2(3) . . . . ?
O1 C5 C15 C16 -48.8(3) . . . . ?
O1 C5 C15 C20 133.7(3) . . . . ?
O1 C5 C24 C25 -46.7(4) . . . . ?
O1 C5 C24 C29 134.9(3) . . . . ?
C1 C2 C3 B3 -144.4(3) . . . . ?
C1 C2 C3 C4 2.1(4) . . . . ?
C1 C2 C3 B7 144.6(3) . . . . ?
C1 C2 C3 B8 106.8(3) . . . . ?
C1 C2 B4 B1 112.1(3) . . . . ?
C1 C2 B4 B5 150.7(3) . . . . ?
C1 C2 B4 B8 -105.4(3) . . . . ?
C1 C2 B4 B9 -146.5(3) . . . . ?
C1 C2 B8 C3 -110.6(3) . . . . ?
C1 C2 B8 B4 110.5(3) . . . . ?
C1 C2 B8 B7 -145.4(3) . . . . ?
C1 C2 B8 B9 152.2(3) . . . . ?
B1 C2 C3 B3 0.2(3) . . . . ?
B1 C2 C3 C4 146.7(3) . . . . ?
B1 C2 C3 B7 -70.7(3) . . . . ?
B1 C2 C3 B8 -108.5(2) . . . . ?
B1 C2 B4 B5 38.6(2) . . . . ?
B1 C2 B4 B8 142.5(3) . . . . ?
B1 C2 B4 B9 101.4(2) . . . . ?
B1 C2 B8 C3 101.6(3) . . . . ?
B1 C2 B8 B4 -37.3(2) . . . . ?
B1 C2 B8 B7 66.8(3) . . . . ?
B1 C2 B8 B9 4.4(3) . . . . ?
B1 B2 B3 C3 5.2(3) . . . . ?
B1 B2 B3 B6 103.4(2) . . . . ?
B1 B2 B3 B7 68.7(3) . . . . ?
B1 B2 B3 K1 147.71(17) . . . 2_655 ?
B1 B2 B5 B4 -35.3(2) . . . . ?
B1 B2 B5 B6 -134.6(2) . . . . ?
B1 B2 B5 B9 -98.5(2) . . . . ?
B1 B2 B5 K1 -178.5(2) . . . 4_565 ?
B1 B2 B6 B3 -95.0(3) . . . . ?
B1 B2 B6 B5 40.8(2) . . . . ?
B1 B2 B6 B7 -58.9(3) . . . . ?
B1 B2 B6 B9 4.6(3) . . . . ?
B1 B2 B6 K1 92.1(2) . . . 4_565 ?
B1 B2 B6 K1 -144.55(19) . . . 2_655 ?
B1 B4 B5 B2 34.6(2) . . . . ?
B1 B4 B5 B6 96.5(2) . . . . ?
B1 B4 B5 B9 135.4(2) . . . . ?
B1 B4 B5 K1 173.0(2) . . . 4_565 ?
B1 B4 B8 C2 31.0(2) . . . . ?
B1 B4 B8 C3 -1.8(3) . . . . ?
B1 B4 B8 B7 -62.9(3) . . . . ?
B1 B4 B8 B9 -101.6(2) . . . . ?
B1 B4 B9 B5 -39.8(2) . . . . ?
B1 B4 B9 B6 -1.5(3) . . . . ?
B1 B4 B9 B7 59.9(3) . . . . ?
B1 B4 B9 B8 97.8(2) . . . . ?
B1 B4 B9 K1 -77.7(3) . . . 4_565 ?
B1 B5 B6 B2 -38.7(2) . . . . ?
B1 B5 B6 B3 -0.2(3) . . . . ?
B1 B5 B6 B7 64.1(3) . . . . ?
B1 B5 B6 B9 101.2(2) . . . . ?
B1 B5 B6 K1 -176.16(18) . . . 4_565 ?
B1 B5 B9 B4 39.5(2) . . . . ?
B1 B5 B9 B6 -97.0(2) . . . . ?
B1 B5 B9 B7 -60.5(3) . . . . ?
B1 B5 B9 B8 2.2(3) . . . . ?
B1 B5 B9 K1 -172.1(2) . . . 4_565 ?
C2 B1 B2 Dy1 -115.87(19) . . . . ?
C2 B1 B2 B3 -5.1(3) . . . . ?
C2 B1 B2 B5 99.4(2) . . . . ?
C2 B1 B2 B6 58.6(3) . . . . ?
C2 B1 B4 B5 -135.5(3) . . . . ?
C2 B1 B4 B8 -32.8(2) . . . . ?
C2 B1 B4 B9 -95.5(2) . . . . ?
C2 B1 B5 B2 -101.2(3) . . . . ?
C2 B1 B5 B4 39.6(2) . . . . ?
C2 B1 B5 B6 -62.5(3) . . . . ?
C2 B1 B5 B9 0.4(3) . . . . ?
C2 C3 B3 B2 -3.6(3) . . . . ?
C2 C3 B3 B6 -65.8(3) . . . . ?
C2 C3 B3 B7 -104.5(3) . . . . ?
C2 C3 B3 K1 -142.5(2) . . . 2_655 ?
C2 C3 B7 B3 104.9(3) . . . . ?
C2 C3 B7 B6 66.1(3) . . . . ?
C2 C3 B7 B8 -38.4(2) . . . . ?
C2 C3 B7 B9 2.5(3) . . . . ?
C2 C3 B7 K1 142.27(19) . . . 2_655 ?
C2 C3 B8 B4 35.5(2) . . . . ?
C2 C3 B8 B7 139.3(2) . . . . ?
C2 C3 B8 B9 98.2(2) . . . . ?
C2 B4 B5 B1 -35.9(2) . . . . ?
C2 B4 B5 B2 -1.3(3) . . . . ?
C2 B4 B5 B6 60.5(3) . . . . ?
C2 B4 B5 B9 99.4(2) . . . . ?
C2 B4 B5 K1 137.06(19) . . . 4_565 ?
C2 B4 B8 C3 -32.8(2) . . . . ?
C2 B4 B8 B7 -93.9(2) . . . . ?
C2 B4 B8 B9 -132.6(2) . . . . ?
C2 B4 B9 B5 -96.8(2) . . . . ?
C2 B4 B9 B6 -58.6(3) . . . . ?
C2 B4 B9 B7 2.9(3) . . . . ?
C2 B4 B9 B8 40.8(2) . . . . ?
C2 B4 B9 K1 -134.70(19) . . . 4_565 ?
C2 B8 B9 B4 -41.1(2) . . . . ?
C2 B8 B9 B5 -3.8(3) . . . . ?
C2 B8 B9 B6 58.6(3) . . . . ?
C2 B8 B9 B7 96.0(2) . . . . ?
B2 B1 C2 C1 147.2(3) . . . . ?
B2 B1 C2 C3 3.3(3) . . . . ?
B2 B1 C2 B4 -102.5(2) . . . . ?
B2 B1 C2 B8 -66.5(3) . . . . ?
B2 B1 B4 C2 99.9(3) . . . . ?
B2 B1 B4 B5 -35.6(2) . . . . ?
B2 B1 B4 B8 67.1(3) . . . . ?
B2 B1 B4 B9 4.5(3) . . . . ?
B2 B1 B5 B4 140.8(2) . . . . ?
B2 B1 B5 B6 38.7(2) . . . . ?
B2 B1 B5 B9 101.6(3) . . . . ?
B2 B3 B6 B5 -39.2(2) . . . . ?
B2 B3 B6 B7 -140.6(3) . . . . ?
B2 B3 B6 B9 -102.1(3) . . . . ?
B2 B3 B6 K1 138.14(18) . . . 2_655 ?
B2 B3 B7 C3 -100.1(3) . . . . ?
B2 B3 B7 B6 35.0(2) . . . . ?
B2 B3 B7 B8 -67.6(3) . . . . ?
B2 B3 B7 B9 -4.7(3) . . . . ?
B2 B3 B7 K1 112.3(2) . . . 2_655 ?
B2 B5 B6 B3 38.6(2) . . . . ?
B2 B5 B6 B7 102.8(2) . . . . ?
B2 B5 B6 B9 140.0(2) . . . . ?
B2 B5 B6 K1 -137.41(18) . . . 4_565 ?
B2 B5 B9 B4 101.1(2) . . . . ?
B2 B5 B9 B6 -35.3(2) . . . . ?
B2 B5 B9 B7 1.2(3) . . . . ?
B2 B5 B9 B8 63.8(3) . . . . ?
B2 B5 B9 K1 -110.4(2) . . . 4_565 ?
B2 B6 B7 C3 0.7(3) . . . . ?
B2 B6 B7 B3 -35.3(2) . . . . ?
B2 B6 B7 B8 62.9(3) . . . . ?
B2 B6 B7 B9 101.3(3) . . . . ?
B2 B6 B7 K1 -118.5(2) . . . 2_655 ?
B2 B6 B9 B4 -1.9(3) . . . . ?
B2 B6 B9 B5 36.3(2) . . . . ?
B2 B6 B9 B7 -101.9(3) . . . . ?
B2 B6 B9 B8 -64.0(3) . . . . ?
B2 B6 B9 K1 119.8(2) . . . 4_565 ?
C3 C2 B4 B1 -102.9(3) . . . . ?
C3 C2 B4 B5 -64.3(3) . . . . ?
C3 C2 B4 B8 39.6(2) . . . . ?
C3 C2 B4 B9 -1.5(3) . . . . ?
C3 C2 B8 B4 -138.9(2) . . . . ?
C3 C2 B8 B7 -34.9(2) . . . . ?
C3 C2 B8 B9 -97.2(2) . . . . ?
C3 B3 B6 B2 101.1(3) . . . . ?
C3 B3 B6 B5 62.0(3) . . . . ?
C3 B3 B6 B7 -39.5(2) . . . . ?
C3 B3 B6 B9 -1.0(3) . . . . ?
C3 B3 B6 K1 -120.7(2) . . . 2_655 ?
C3 B3 B7 B6 135.1(3) . . . . ?
C3 B3 B7 B8 32.5(2) . . . . ?
C3 B3 B7 B9 95.5(3) . . . . ?
C3 B3 B7 K1 -147.57(19) . . . 2_655 ?
C3 B7 B8 C2 32.47(19) . . . . ?
C3 B7 B8 B4 94.2(2) . . . . ?
C3 B7 B8 B9 132.9(2) . . . . ?
C3 B7 B9 B4 -3.3(3) . . . . ?
C3 B7 B9 B5 59.1(3) . . . . ?
C3 B7 B9 B6 96.0(2) . . . . ?
C3 B7 B9 B8 -41.0(2) . . . . ?
C3 B7 B9 K1 139.17(18) . . . 4_565 ?
C3 B8 B9 B4 -96.7(2) . . . . ?
C3 B8 B9 B5 -59.3(3) . . . . ?
C3 B8 B9 B6 3.0(3) . . . . ?
C3 B8 B9 B7 40.4(2) . . . . ?
B3 B2 B5 B1 94.3(2) . . . . ?
B3 B2 B5 B4 59.0(3) . . . . ?
B3 B2 B5 B6 -40.3(2) . . . . ?
B3 B2 B5 B9 -4.2(3) . . . . ?
B3 B2 B5 K1 -84.2(2) . . . 4_565 ?
B3 B2 B6 B5 135.8(2) . . . . ?
B3 B2 B6 B7 36.1(2) . . . . ?
B3 B2 B6 B9 99.7(3) . . . . ?
B3 B2 B6 K1 -172.9(2) . . . 4_565 ?
B3 B2 B6 K1 -49.5(2) . . . 2_655 ?
B3 C3 B7 B6 -38.8(2) . . . . ?
B3 C3 B7 B8 -143.3(3) . . . . ?
B3 C3 B7 B9 -102.4(3) . . . . ?
B3 C3 B7 K1 37.4(2) . . . 2_655 ?
B3 C3 B8 C2 -102.3(3) . . . . ?
B3 C3 B8 B4 -66.8(3) . . . . ?
B3 C3 B8 B7 37.1(3) . . . . ?
B3 C3 B8 B9 -4.1(3) . . . . ?
B3 B6 B7 C3 36.0(2) . . . . ?
B3 B6 B7 B8 98.1(3) . . . . ?
B3 B6 B7 B9 136.6(2) . . . . ?
B3 B6 B7 K1 -83.21(16) . . . 2_655 ?
B3 B6 B9 B4 60.8(3) . . . . ?
B3 B6 B9 B5 99.0(2) . . . . ?
B3 B6 B9 B7 -39.2(2) . . . . ?
B3 B6 B9 B8 -1.4(3) . . . . ?
B3 B6 B9 K1 -177.6(2) . . . 4_565 ?
B3 B7 B8 C2 2.1(3) . . . . ?
B3 B7 B8 C3 -30.3(2) . . . . ?
B3 B7 B8 B4 63.8(3) . . . . ?
B3 B7 B8 B9 102.6(3) . . . . ?
B3 B7 B9 B4 -60.2(3) . . . . ?
B3 B7 B9 B5 2.1(3) . . . . ?
B3 B7 B9 B6 39.0(2) . . . . ?
B3 B7 B9 B8 -98.0(3) . . . . ?
B3 B7 B9 K1 82.2(2) . . . 4_565 ?
C4 C3 B3 B2 -149.3(3) . . . . ?
C4 C3 B3 B6 148.5(3) . . . . ?
C4 C3 B3 B7 109.8(3) . . . . ?
C4 C3 B3 K1 71.8(3) . . . 2_655 ?
C4 C3 B7 B3 -112.6(3) . . . . ?
C4 C3 B7 B6 -151.4(3) . . . . ?
C4 C3 B7 B8 104.1(3) . . . . ?
C4 C3 B7 B9 145.0(3) . . . . ?
C4 C3 B7 K1 -75.2(3) . . . 2_655 ?
C4 C3 B8 C2 110.4(3) . . . . ?
C4 C3 B8 B4 145.9(3) . . . . ?
C4 C3 B8 B7 -110.2(3) . . . . ?
C4 C3 B8 B9 -151.4(3) . . . . ?
B4 B1 C2 C1 -110.3(3) . . . . ?
B4 B1 C2 C3 105.8(2) . . . . ?
B4 B1 C2 B8 36.0(2) . . . . ?
B4 B1 B2 Dy1 179.9(2) . . . . ?
B4 B1 B2 B3 -69.4(3) . . . . ?
B4 B1 B2 B5 35.2(2) . . . . ?
B4 B1 B2 B6 -5.6(3) . . . . ?
B4 B1 B5 B2 -140.8(2) . . . . ?
B4 B1 B5 B6 -102.1(2) . . . . ?
B4 B1 B5 B9 -39.2(2) . . . . ?
B4 C2 C3 B3 70.3(3) . . . . ?
B4 C2 C3 C4 -143.2(3) . . . . ?
B4 C2 C3 B7 -0.7(3) . . . . ?
B4 C2 C3 B8 -38.5(2) . . . . ?
B4 C2 B8 C3 138.9(2) . . . . ?
B4 C2 B8 B7 104.1(2) . . . . ?
B4 C2 B8 B9 41.7(2) . . . . ?
B4 B5 B6 B2 -101.5(2) . . . . ?
B4 B5 B6 B3 -62.9(3) . . . . ?
B4 B5 B6 B7 1.3(3) . . . . ?
B4 B5 B6 B9 38.5(2) . . . . ?
B4 B5 B6 K1 121.12(19) . . . 4_565 ?
B4 B5 B9 B6 -136.4(2) . . . . ?
B4 B5 B9 B7 -100.0(3) . . . . ?
B4 B5 B9 B8 -37.3(2) . . . . ?
B4 B5 B9 K1 148.41(17) . . . 4_565 ?
B4 B8 B9 B5 37.3(2) . . . . ?
B4 B8 B9 B6 99.7(2) . . . . ?
B4 B8 B9 B7 137.1(2) . . . . ?
C5 C6 C7 C8 -175.7(3) . . . . ?
C5 C6 C7 C12 0.5(4) . . . . ?
C5 C6 C11 C10 176.1(3) . . . . ?
C5 C15 C16 C17 -177.4(3) . . . . ?
C5 C15 C16 C21 -5.2(4) . . . . ?
C5 C15 C20 C19 177.1(3) . . . . ?
C5 C24 C25 C26 177.6(3) . . . . ?
C5 C24 C25 C30 -6.9(4) . . . . ?
C5 C24 C29 C28 -178.6(3) . . . . ?
B5 B1 C2 C1 -149.3(3) . . . . ?
B5 B1 C2 C3 66.8(3) . . . . ?
B5 B1 C2 B4 -39.0(2) . . . . ?
B5 B1 C2 B8 -3.0(3) . . . . ?
B5 B1 B2 Dy1 144.69(18) . . . . ?
B5 B1 B2 B3 -104.5(2) . . . . ?
B5 B1 B2 B6 -40.8(2) . . . . ?
B5 B1 B4 C2 135.5(3) . . . . ?
B5 B1 B4 B8 102.7(3) . . . . ?
B5 B1 B4 B9 40.0(2) . . . . ?
B5 B2 B3 C3 -58.1(3) . . . . ?
B5 B2 B3 B6 40.1(2) . . . . ?
B5 B2 B3 B7 5.4(3) . . . . ?
B5 B2 B3 K1 84.4(2) . . . 2_655 ?
B5 B2 B6 B3 -135.8(2) . . . . ?
B5 B2 B6 B7 -99.7(3) . . . . ?
B5 B2 B6 B9 -36.1(2) . . . . ?
B5 B2 B6 K1 51.3(2) . . . 4_565 ?
B5 B2 B6 K1 174.7(2) . . . 2_655 ?
B5 B4 B8 C2 94.2(2) . . . . ?
B5 B4 B8 C3 61.4(3) . . . . ?
B5 B4 B8 B7 0.3(3) . . . . ?
B5 B4 B8 B9 -38.3(2) . . . . ?
B5 B4 B9 B6 38.2(2) . . . . ?
B5 B4 B9 B7 99.7(2) . . . . ?
B5 B4 B9 B8 137.6(2) . . . . ?
B5 B4 B9 K1 -37.9(2) . . . 4_565 ?
B5 B6 B7 C3 -63.3(3) . . . . ?
B5 B6 B7 B3 -99.3(2) . . . . ?
B5 B6 B7 B8 -1.2(3) . . . . ?
B5 B6 B7 B9 37.3(2) . . . . ?
B5 B6 B7 K1 177.5(2) . . . 2_655 ?
B5 B6 B9 B4 -38.2(2) . . . . ?
B5 B6 B9 B7 -138.2(2) . . . . ?
B5 B6 B9 B8 -100.3(2) . . . . ?
B5 B6 B9 K1 83.47(15) . . . 4_565 ?
C6 C5 C15 C16 -168.3(2) . . . . ?
C6 C5 C15 C20 14.1(4) . . . . ?
C6 C5 C24 C25 75.5(3) . . . . ?
C6 C5 C24 C29 -102.9(3) . . . . ?
C6 C7 C8 C9 -0.2(5) . . . . ?
C6 C7 C12 N1 82.8(4) . . . . ?
B6 B2 B3 C3 -98.2(3) . . . . ?
B6 B2 B3 B7 -34.7(2) . . . . ?
B6 B2 B3 K1 44.33(19) . . . 2_655 ?
B6 B2 B5 B1 134.6(2) . . . . ?
B6 B2 B5 B4 99.3(3) . . . . ?
B6 B2 B5 B9 36.1(2) . . . . ?
B6 B2 B5 K1 -43.89(18) . . . 4_565 ?
B6 B3 B7 C3 -135.1(3) . . . . ?
B6 B3 B7 B8 -102.6(3) . . . . ?
B6 B3 B7 B9 -39.7(2) . . . . ?
B6 B3 B7 K1 77.32(16) . . . 2_655 ?
B6 B5 B9 B4 136.4(2) . . . . ?
B6 B5 B9 B7 36.5(2) . . . . ?
B6 B5 B9 B8 99.1(2) . . . . ?
B6 B5 B9 K1 -75.14(15) . . . 4_565 ?
B6 B7 B8 C2 -61.2(3) . . . . ?
B6 B7 B8 C3 -93.6(2) . . . . ?
B6 B7 B8 B4 0.6(3) . . . . ?
B6 B7 B8 B9 39.3(2) . . . . ?
B6 B7 B9 B4 -99.2(2) . . . . ?
B6 B7 B9 B5 -36.9(2) . . . . ?
B6 B7 B9 B8 -137.0(2) . . . . ?
B6 B7 B9 K1 43.22(19) . . . 4_565 ?
C7 C6 C11 C10 0.4(4) . . . . ?
C7 C8 C9 C10 0.5(5) . . . . ?
B7 C3 B3 B2 100.9(2) . . . . ?
B7 C3 B3 B6 38.7(2) . . . . ?
B7 C3 B3 K1 -38.0(2) . . . 2_655 ?
B7 C3 B8 C2 -139.3(2) . . . . ?
B7 C3 B8 B4 -103.8(2) . . . . ?
B7 C3 B8 B9 -41.2(2) . . . . ?
B7 B3 B6 B2 140.6(3) . . . . ?
B7 B3 B6 B5 101.5(3) . . . . ?
B7 B3 B6 B9 38.5(2) . . . . ?
B7 B3 B6 K1 -81.24(17) . . . 2_655 ?
B7 B6 B9 B4 100.0(2) . . . . ?
B7 B6 B9 B5 138.2(2) . . . . ?
B7 B6 B9 B8 37.8(2) . . . . ?
B7 B6 B9 K1 -138.37(19) . . . 4_565 ?
B7 B8 B9 B4 -137.1(2) . . . . ?
B7 B8 B9 B5 -99.7(3) . . . . ?
B7 B8 B9 B6 -37.4(2) . . . . ?
C8 C7 C12 N1 -100.9(3) . . . . ?
C8 C9 C10 C11 -0.2(5) . . . . ?
B8 C2 C3 B3 108.7(3) . . . . ?
B8 C2 C3 C4 -104.8(3) . . . . ?
B8 C2 C3 B7 37.8(2) . . . . ?
B8 C2 B4 B1 -142.5(3) . . . . ?
B8 C2 B4 B5 -103.9(2) . . . . ?
B8 C2 B4 B9 -41.1(2) . . . . ?
B8 C3 B3 B2 65.4(3) . . . . ?
B8 C3 B3 B6 3.2(3) . . . . ?
B8 C3 B3 B7 -35.5(2) . . . . ?
B8 C3 B3 K1 -73.5(3) . . . 2_655 ?
B8 C3 B7 B3 143.3(3) . . . . ?
B8 C3 B7 B6 104.5(2) . . . . ?
B8 C3 B7 B9 40.9(2) . . . . ?
B8 C3 B7 K1 -179.3(2) . . . 2_655 ?
B8 B4 B5 B1 -97.5(2) . . . . ?
B8 B4 B5 B2 -62.8(3) . . . . ?
B8 B4 B5 B6 -1.0(3) . . . . ?
B8 B4 B5 B9 37.9(2) . . . . ?
B8 B4 B5 K1 75.5(3) . . . 4_565 ?
B8 B4 B9 B5 -137.6(2) . . . . ?
B8 B4 B9 B6 -99.4(2) . . . . ?
B8 B4 B9 B7 -37.9(2) . . . . ?
B8 B4 B9 K1 -175.5(2) . . . 4_565 ?
B8 B7 B9 B4 37.8(2) . . . . ?
B8 B7 B9 B5 100.1(2) . . . . ?
B8 B7 B9 B6 137.0(2) . . . . ?
B8 B7 B9 K1 -179.8(2) . . . 4_565 ?
C9 C10 C11 C6 -0.2(5) . . . . ?
B9 B4 B5 B1 -135.4(2) . . . . ?
B9 B4 B5 B2 -100.7(3) . . . . ?
B9 B4 B5 B6 -38.9(2) . . . . ?
B9 B4 B5 K1 37.6(2) . . . 4_565 ?
B9 B4 B8 C2 132.6(2) . . . . ?
B9 B4 B8 C3 99.8(2) . . . . ?
B9 B4 B8 B7 38.6(2) . . . . ?
B9 B5 B6 B2 -140.0(2) . . . . ?
B9 B5 B6 B3 -101.4(2) . . . . ?
B9 B5 B6 B7 -37.1(2) . . . . ?
B9 B5 B6 K1 82.63(15) . . . 4_565 ?
B9 B6 B7 C3 -100.6(2) . . . . ?
B9 B6 B7 B3 -136.6(2) . . . . ?
B9 B6 B7 B8 -38.5(2) . . . . ?
B9 B6 B7 K1 140.19(18) . . . 2_655 ?
B9 B7 B8 C2 -100.5(2) . . . . ?
B9 B7 B8 C3 -132.9(2) . . . . ?
B9 B7 B8 B4 -38.7(2) . . . . ?
C11 C6 C7 C8 -0.2(4) . . . . ?
C11 C6 C7 C12 176.0(3) . . . . ?
C12 C7 C8 C9 -176.8(3) . . . . ?
C13 N1 C12 C7 19.2(3) . . . . ?
C14 N1 C12 C7 139.7(3) . . . . ?
C15 C5 C6 C7 73.2(3) . . . . ?
C15 C5 C6 C11 -102.3(3) . . . . ?
C15 C5 C24 C25 -164.1(3) . . . . ?
C15 C5 C24 C29 17.4(4) . . . . ?
C15 C16 C17 C18 0.2(4) . . . . ?
C15 C16 C21 N2 97.2(3) . . . . ?
C16 C15 C20 C19 -0.4(4) . . . . ?
C16 C17 C18 C19 -0.2(5) . . . . ?
C16 C17 C18 K1 -81.7(3) . . . . ?
C17 C16 C21 N2 -90.5(3) . . . . ?
C17 C18 C19 C20 -0.1(5) . . . . ?
C17 C18 C19 K1 -89.0(3) . . . . ?
C18 C19 C20 C15 0.4(5) . . . . ?
C20 C15 C16 C17 0.2(4) . . . . ?
C20 C15 C16 C21 172.4(3) . . . . ?
C21 C16 C17 C18 -172.5(3) . . . . ?
C22 N2 C21 C16 -169.1(3) . . . . ?
C23 N2 C21 C16 74.2(3) . . . . ?
C24 C5 C6 C7 -166.6(3) . . . . ?
C24 C5 C6 C11 18.0(3) . . . . ?
C24 C5 C15 C16 70.7(3) . . . . ?
C24 C5 C15 C20 -106.8(3) . . . . ?
C24 C25 C26 C27 1.8(5) . . . . ?
C24 C25 C30 N3 159.5(3) . . . . ?
C25 C24 C29 C28 2.9(5) . . . . ?
C25 C26 C27 C28 1.6(5) . . . . ?
C26 C25 C30 N3 -25.0(4) . . . . ?
C26 C27 C28 C29 -2.7(5) . . . . ?
C27 C28 C29 C24 0.4(5) . . . . ?
C29 C24 C25 C26 -3.9(4) . . . . ?
C29 C24 C25 C30 171.6(3) . . . . ?
C30 C25 C26 C27 -174.0(3) . . . . ?
C31 N3 C30 C25 -73.3(3) . . . . ?
C32 N3 C30 C25 166.2(3) . . . . ?
K1 B3 B6 B2 -138.14(18) 2_655 . . . ?
K1 B3 B6 B5 -177.3(2) 2_655 . . . ?
K1 B3 B6 B7 81.24(17) 2_655 . . . ?
K1 B3 B6 B9 119.7(2) 2_655 . . . ?
K1 B3 B7 C3 147.57(19) 2_655 . . . ?
K1 B3 B7 B6 -77.32(16) 2_655 . . . ?
K1 B3 B7 B8 -179.9(2) 2_655 . . . ?
K1 B3 B7 B9 -117.0(2) 2_655 . . . ?
K1 B5 B6 B2 137.41(18) 4_565 . . . ?
K1 B5 B6 B3 176.0(2) 4_565 . . . ?
K1 B5 B6 B7 -119.8(2) 4_565 . . . ?
K1 B5 B6 B9 -82.63(15) 4_565 . . . ?
K1 B5 B9 B4 -148.41(17) 4_565 . . . ?
K1 B5 B9 B6 75.14(15) 4_565 . . . ?
K1 B5 B9 B7 111.6(2) 4_565 . . . ?
K1 B5 B9 B8 174.3(2) 4_565 . . . ?
K1 B6 B7 C3 119.18(19) 2_655 . . . ?
K1 B6 B7 C3 -150.36(18) 4_565 . . . ?
K1 B6 B7 B3 83.21(16) 2_655 . . . ?
K1 B6 B7 B3 173.7(2) 4_565 . . . ?
K1 B6 B7 B8 -88.2(3) 4_565 . . . ?
K1 B6 B7 B8 -178.7(2) 2_655 . . . ?
K1 B6 B7 B9 -49.7(2) 4_565 . . . ?
K1 B6 B7 B9 -140.19(18) 2_655 . . . ?
K1 B6 B7 K1 90.47(17) 4_565 . . 2_655 ?
K1 B6 B9 B4 147.04(18) 2_655 . . . ?
K1 B6 B9 B4 -121.7(2) 4_565 . . . ?
K1 B6 B9 B5 -174.8(2) 2_655 . . . ?
K1 B6 B9 B5 -83.47(15) 4_565 . . . ?
K1 B6 B9 B7 138.37(19) 4_565 . . . ?
K1 B6 B9 B7 47.1(2) 2_655 . . . ?
K1 B6 B9 B8 84.9(2) 2_655 . . . ?
K1 B6 B9 B8 176.2(2) 4_565 . . . ?
K1 B6 B9 K1 -91.30(16) 2_655 . . 4_565 ?
K1 B7 B9 B4 -143.76(19) 2_655 . . . ?
K1 B7 B9 B5 -81.4(2) 2_655 . . . ?
K1 B7 B9 B6 -44.54(19) 2_655 . . . ?
K1 B7 B9 B8 178.5(2) 2_655 . . . ?
K1 B7 B9 K1 -1.3(3) 2_655 . . 4_565 ?
K1 C18 C19 C20 88.9(3) . . . . ?
K1 C19 C20 C15 76.5(3) . . . . ?
O1S C4S C3S C2S -22.2 . . . . ?
C4S O1S C1S C2S 22.6 . . . . ?
C4S C3S C2S C1S 34.7 . . . . ?
C3S C2S C1S O1S -35.7 . . . . ?
C1S O1S C4S C3S -0.3 . . . . ?
O2S C8S C7S C6S -22.2 . . . . ?
C8S O2S C5S C6S 22.6 . . . . ?
C8S C7S C6S C5S 34.6 . . . . ?
C7S C6S C5S O2S -35.6 . . . . ?
C5S O2S C8S C7S -0.4 . . . . ?

_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_a
_database_code_depnum_ccdc_archive 'CCDC 2477287'
loop_
_audit_author_name
_audit_author_address
'Anna Vologzhanina'
;INEOS RAS
Russia
;
_audit_update_record             
;
2025-07-30 deposited with the CCDC.	2026-05-05 downloaded from the CCDC.
;
_audit_creation_date             2025-02-24
_audit_creation_method           
;
Olex2 1.5
(compiled 2024.02.16 svn.r378c4104 for OlexSys, GUI svn.r6928)
;
_shelx_SHELXL_version_number     2018/3
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C32 H44 Cl2 Dy N3 O2'
_chemical_formula_sum            'C32 H44 Cl2 Dy N3 O2'
_chemical_formula_weight         736.10
_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'
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'
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/n 1'
_space_group_name_Hall           '-P 2yn'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'

_cell_length_a                   10.0997(2)
_cell_length_b                   15.8966(3)
_cell_length_c                   20.4614(4)
_cell_angle_alpha                90
_cell_angle_beta                 94.5890(10)
_cell_angle_gamma                90
_cell_volume                     3274.56(11)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    9897
_cell_measurement_temperature    100
_cell_measurement_theta_max      30.53
_cell_measurement_theta_min      2.18
_shelx_estimated_absorpt_T_max   0.790
_shelx_estimated_absorpt_T_min   0.708
_exptl_absorpt_coefficient_mu    2.477
_exptl_absorpt_correction_T_max  0.3368
_exptl_absorpt_correction_T_min  0.1725
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
SADABS-2016/2 (Bruker,2016/2) was used for absorption correction.
wR2(int) was 0.1644 before and 0.0774 after correction.
The Ratio of minimum to maximum transmission is 0.5122.
The λ/2 correction factor is Not present.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            colourless
_exptl_crystal_colour_primary    colourless
_exptl_crystal_density_diffrn    1.493
_exptl_crystal_density_meas      .
_exptl_crystal_density_method    ?
_exptl_crystal_description       prism
_exptl_crystal_F_000             1492
_exptl_crystal_size_max          0.15
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.1
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0693
_diffrn_reflns_av_unetI/netI     0.0552
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.999
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_limit_l_min       -27
_diffrn_reflns_number            39447
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.999
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         27.999
_diffrn_reflns_theta_min         1.624
_diffrn_ambient_temperature      100.00
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Bruker Quest D8'
_diffrn_measurement_method       'φ and ω scans'
_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                6701
_reflns_number_total             7891
_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 1.5 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_structure_refinement  'XL  (Sheldrick, 2008)'
_computing_structure_solution    'SHELXT 2014/4 (Sheldrick, 2014)'
_refine_diff_density_max         1.416
_refine_diff_density_min         -0.874
_refine_diff_density_rms         0.121
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.033
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     367
_refine_ls_number_reflns         7891
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0416
_refine_ls_R_factor_gt           0.0320
_refine_ls_restrained_S_all      1.033
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0326P)²+1.4827P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0781
_refine_ls_wR_factor_ref         0.0832
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2.a Secondary CH2 refined with riding coordinates:
 C8(H8A,H8B), C17(H17A,H17B), C26(H26A,H26B), C29(H29A,H29B), C30(H30A,H30B),
 C31(H31A,H31B), C32(H32A,H32B)
2.b Aromatic/amide H refined with riding coordinates:
 C4(H4), C5(H5), C6(H6), C7(H7), C13(H13), C14(H14), C15(H15), C16(H16),
 C22(H22), C23(H23), C24(H24), C25(H25)
2.c Idealised Me refined as rotating group:
 C9(H9A,H9B,H9C), C10(H10A,H10B,H10C), C18(H18A,H18B,H18C), C19(H19A,H19B,
 H19C), C27(H27A,H27B,H27C), C28(H28C,H28A,H28B)
;
_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 0.45475(2) 0.79996(2) 0.60423(2) 0.01681(5) Uani 1 1 d . . . . .
Cl1 Cl 0.29640(8) 0.91570(5) 0.55287(4) 0.03059(19) Uani 1 1 d . . . . .
O1 O 0.52882(19) 0.71636(12) 0.67338(10) 0.0159(4) Uani 1 1 d . . . . .
N1 N 0.2812(3) 0.68442(18) 0.58498(15) 0.0247(6) Uani 1 1 d . . . . .
C1 C 0.5499(3) 0.65389(18) 0.72097(14) 0.0159(6) Uani 1 1 d . . . . .
Cl2 Cl 0.55478(8) 0.75658(5) 0.49631(4) 0.02615(17) Uani 1 1 d . . . . .
O2 O 0.6470(2) 0.88604(14) 0.61739(11) 0.0242(5) Uani 1 1 d . . . . .
N2 N 0.4026(3) 0.87149(17) 0.71448(13) 0.0226(6) Uani 1 1 d . . . . .
C2 C 0.5089(3) 0.56819(19) 0.68897(15) 0.0183(6) Uani 1 1 d . . . . .
N3 N 0.8729(2) 0.60480(19) 0.59343(13) 0.0258(6) Uani 1 1 d . . . . .
C3 C 0.3877(3) 0.5592(2) 0.65036(15) 0.0205(6) Uani 1 1 d . . . . .
C4 C 0.3579(3) 0.4805(2) 0.62216(17) 0.0270(7) Uani 1 1 d . . . . .
H4 H 0.275868 0.473486 0.596654 0.032 Uiso 1 1 calc R U . . .
C5 C 0.4433(4) 0.4128(2) 0.63002(18) 0.0299(8) Uani 1 1 d . . . . .
H5 H 0.421802 0.360895 0.608769 0.036 Uiso 1 1 calc R U . . .
C6 C 0.5592(4) 0.4215(2) 0.66882(19) 0.0306(8) Uani 1 1 d . . . . .
H6 H 0.617672 0.374967 0.675764 0.037 Uiso 1 1 calc R U . . .
C7 C 0.5912(3) 0.4985(2) 0.69804(17) 0.0255(7) Uani 1 1 d . . . . .
H7 H 0.671746 0.503640 0.725049 0.031 Uiso 1 1 calc R U . . .
C8 C 0.2802(3) 0.6259(2) 0.64268(16) 0.0227(7) Uani 1 1 d . . . . .
H8A H 0.193069 0.597012 0.640113 0.027 Uiso 1 1 calc R U . . .
H8B H 0.286029 0.660508 0.683034 0.027 Uiso 1 1 calc R U . . .
C9 C 0.2898(4) 0.6361(2) 0.52386(17) 0.0314(8) Uani 1 1 d . . . . .
H9A H 0.283848 0.674610 0.486368 0.047 Uiso 1 1 calc R U . . .
H9B H 0.216504 0.595539 0.519001 0.047 Uiso 1 1 calc R U . . .
H9C H 0.374619 0.605911 0.525644 0.047 Uiso 1 1 calc R U . . .
C10 C 0.1508(3) 0.7289(3) 0.5801(2) 0.0356(9) Uani 1 1 d . . . . .
H10A H 0.141288 0.760604 0.620571 0.053 Uiso 1 1 calc R U . . .
H10B H 0.078815 0.687691 0.573792 0.053 Uiso 1 1 calc R U . . .
H10C H 0.146659 0.767766 0.542814 0.053 Uiso 1 1 calc R U . . .
C11 C 0.4626(3) 0.6702(2) 0.77864(15) 0.0188(6) Uani 1 1 d . . . . .
C12 C 0.4324(3) 0.7515(2) 0.79981(15) 0.0210(6) Uani 1 1 d . . . . .
C13 C 0.3580(3) 0.7590(2) 0.85457(17) 0.0282(8) Uani 1 1 d . . . . .
H13 H 0.337690 0.813704 0.869521 0.034 Uiso 1 1 calc R U . . .
C14 C 0.3132(3) 0.6904(2) 0.88763(18) 0.0314(8) Uani 1 1 d . . . . .
H14 H 0.261846 0.698012 0.924101 0.038 Uiso 1 1 calc R U . . .
C15 C 0.3437(3) 0.6109(2) 0.86724(17) 0.0312(8) Uani 1 1 d . . . . .
H15 H 0.314890 0.562993 0.889922 0.037 Uiso 1 1 calc R U . . .
C16 C 0.4173(3) 0.6013(2) 0.81294(16) 0.0243(7) Uani 1 1 d . . . . .
H16 H 0.437302 0.546117 0.798806 0.029 Uiso 1 1 calc R U . . .
C17 C 0.4825(3) 0.8334(2) 0.77238(16) 0.0222(6) Uani 1 1 d . . . . .
H17A H 0.488523 0.875454 0.808180 0.027 Uiso 1 1 calc R U . . .
H17B H 0.573795 0.823683 0.759688 0.027 Uiso 1 1 calc R U . . .
C18 C 0.2587(3) 0.8691(2) 0.72401(18) 0.0314(8) Uani 1 1 d . . . . .
H18A H 0.208652 0.893914 0.685756 0.047 Uiso 1 1 calc R U . . .
H18B H 0.241686 0.901233 0.763354 0.047 Uiso 1 1 calc R U . . .
H18C H 0.230678 0.810649 0.729228 0.047 Uiso 1 1 calc R U . . .
C19 C 0.4418(4) 0.9608(2) 0.71122(19) 0.0311(8) Uani 1 1 d . . . . .
H19A H 0.538434 0.964672 0.710033 0.047 Uiso 1 1 calc R U . . .
H19B H 0.414641 0.990476 0.749928 0.047 Uiso 1 1 calc R U . . .
H19C H 0.398417 0.986408 0.671547 0.047 Uiso 1 1 calc R U . . .
C20 C 0.6990(3) 0.65612(18) 0.74544(15) 0.0169(6) Uani 1 1 d . . . . .
C21 C 0.7982(3) 0.65446(18) 0.70020(15) 0.0175(6) Uani 1 1 d . . . . .
C22 C 0.9297(3) 0.6636(2) 0.72411(17) 0.0238(7) Uani 1 1 d . . . . .
H22 H 0.996446 0.663356 0.693910 0.029 Uiso 1 1 calc R U . . .
C23 C 0.9680(3) 0.6731(2) 0.79045(18) 0.0265(7) Uani 1 1 d . . . . .
H23 H 1.059101 0.679547 0.805122 0.032 Uiso 1 1 calc R U . . .
C24 C 0.8716(3) 0.6730(2) 0.83484(17) 0.0248(7) Uani 1 1 d . . . . .
H24 H 0.895965 0.678766 0.880431 0.030 Uiso 1 1 calc R U . . .
C25 C 0.7390(3) 0.6645(2) 0.81229(16) 0.0208(6) Uani 1 1 d . . . . .
H25 H 0.673427 0.664249 0.843089 0.025 Uiso 1 1 calc R U . . .
C26 C 0.7670(3) 0.6465(2) 0.62678(16) 0.0197(6) Uani 1 1 d . . . . .
H26A H 0.683662 0.614137 0.618290 0.024 Uiso 1 1 calc R U . . .
H26B H 0.752054 0.703350 0.607885 0.024 Uiso 1 1 calc R U . . .
C27 C 0.8802(4) 0.5155(2) 0.60996(19) 0.0355(9) Uani 1 1 d . . . . .
H27A H 0.895949 0.509022 0.657581 0.053 Uiso 1 1 calc R U . . .
H27B H 0.953256 0.489412 0.588499 0.053 Uiso 1 1 calc R U . . .
H27C H 0.796381 0.488051 0.594897 0.053 Uiso 1 1 calc R U . . .
C28 C 0.8466(3) 0.6154(3) 0.52297(17) 0.0371(9) Uani 1 1 d . . . . .
H28C H 0.851818 0.675182 0.511848 0.056 Uiso 1 1 calc R U . . .
H28A H 0.757629 0.594100 0.509303 0.056 Uiso 1 1 calc R U . . .
H28B H 0.912760 0.583958 0.500286 0.056 Uiso 1 1 calc R U . . .
C29 C 0.7642(3) 0.8740(2) 0.66103(19) 0.0324(8) Uani 1 1 d . . . . .
H29A H 0.765154 0.817289 0.680971 0.039 Uiso 1 1 calc R U . . .
H29B H 0.769517 0.916688 0.696407 0.039 Uiso 1 1 calc R U . . .
C30 C 0.8777(4) 0.8842(3) 0.6177(2) 0.0447(11) Uani 1 1 d . . . . .
H30A H 0.895243 0.831054 0.594697 0.054 Uiso 1 1 calc R U . . .
H30B H 0.959833 0.902325 0.643460 0.054 Uiso 1 1 calc R U . . .
C31 C 0.8280(4) 0.9517(3) 0.5697(3) 0.0576(14) Uani 1 1 d . . . . .
H31A H 0.861190 1.007722 0.584475 0.069 Uiso 1 1 calc R U . . .
H31B H 0.858001 0.940408 0.525611 0.069 Uiso 1 1 calc R U . . .
C32 C 0.6784(3) 0.9484(2) 0.56805(19) 0.0302(8) Uani 1 1 d . . . . .
H32A H 0.642228 1.004154 0.578673 0.036 Uiso 1 1 calc R U . . .
H32B H 0.639849 0.931296 0.524038 0.036 Uiso 1 1 calc R 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 Cl1 2.6035(8) . ?
Dy1 O1 2.039(2) . ?
Dy1 N1 2.548(3) . ?
Dy1 Cl2 2.5943(8) . ?
Dy1 O2 2.373(2) . ?
Dy1 N2 2.617(3) . ?
O1 C1 1.395(3) . ?
N1 C8 1.504(4) . ?
N1 C9 1.476(4) . ?
N1 C10 1.491(4) . ?
C1 C2 1.553(4) . ?
C1 C11 1.551(4) . ?
C1 C20 1.548(4) . ?
O2 C29 1.438(4) . ?
O2 C32 1.467(4) . ?
N2 C17 1.506(4) . ?
N2 C18 1.482(4) . ?
N2 C19 1.476(4) . ?
C2 C3 1.410(4) . ?
C2 C7 1.388(4) . ?
N3 C26 1.472(4) . ?
N3 C27 1.460(5) . ?
N3 C28 1.455(4) . ?
C3 C4 1.400(4) . ?
C3 C8 1.516(4) . ?
C4 H4 0.9500 . ?
C4 C5 1.381(5) . ?
C5 H5 0.9500 . ?
C5 C6 1.368(5) . ?
C6 H6 0.9500 . ?
C6 C7 1.389(5) . ?
C7 H7 0.9500 . ?
C8 H8A 0.9900 . ?
C8 H8B 0.9900 . ?
C9 H9A 0.9800 . ?
C9 H9B 0.9800 . ?
C9 H9C 0.9800 . ?
C10 H10A 0.9800 . ?
C10 H10B 0.9800 . ?
C10 H10C 0.9800 . ?
C11 C12 1.404(4) . ?
C11 C16 1.398(4) . ?
C12 C13 1.403(4) . ?
C12 C17 1.520(5) . ?
C13 H13 0.9500 . ?
C13 C14 1.379(5) . ?
C14 H14 0.9500 . ?
C14 C15 1.373(5) . ?
C15 H15 0.9500 . ?
C15 C16 1.394(4) . ?
C16 H16 0.9500 . ?
C17 H17A 0.9900 . ?
C17 H17B 0.9900 . ?
C18 H18A 0.9800 . ?
C18 H18B 0.9800 . ?
C18 H18C 0.9800 . ?
C19 H19A 0.9800 . ?
C19 H19B 0.9800 . ?
C19 H19C 0.9800 . ?
C20 C21 1.418(4) . ?
C20 C25 1.401(4) . ?
C21 C22 1.386(4) . ?
C21 C26 1.515(4) . ?
C22 H22 0.9500 . ?
C22 C23 1.390(5) . ?
C23 H23 0.9500 . ?
C23 C24 1.384(5) . ?
C24 H24 0.9500 . ?
C24 C25 1.387(4) . ?
C25 H25 0.9500 . ?
C26 H26A 0.9900 . ?
C26 H26B 0.9900 . ?
C27 H27A 0.9800 . ?
C27 H27B 0.9800 . ?
C27 H27C 0.9800 . ?
C28 H28C 0.9800 . ?
C28 H28A 0.9800 . ?
C28 H28B 0.9800 . ?
C29 H29A 0.9900 . ?
C29 H29B 0.9900 . ?
C29 C30 1.513(6) . ?
C30 H30A 0.9900 . ?
C30 H30B 0.9900 . ?
C30 C31 1.513(6) . ?
C31 H31A 0.9900 . ?
C31 H31B 0.9900 . ?
C31 C32 1.509(5) . ?
C32 H32A 0.9900 . ?
C32 H32B 0.9900 . ?

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
Cl1 Dy1 N2 83.19(6) . . ?
O1 Dy1 Cl1 156.93(6) . . ?
O1 Dy1 N1 81.20(9) . . ?
O1 Dy1 Cl2 105.73(6) . . ?
O1 Dy1 O2 92.62(8) . . ?
O1 Dy1 N2 76.89(8) . . ?
N1 Dy1 Cl1 93.11(7) . . ?
N1 Dy1 Cl2 89.24(7) . . ?
N1 Dy1 N2 105.25(9) . . ?
Cl2 Dy1 Cl1 96.47(3) . . ?
Cl2 Dy1 N2 165.51(6) . . ?
O2 Dy1 Cl1 96.25(6) . . ?
O2 Dy1 N1 168.47(8) . . ?
O2 Dy1 Cl2 83.05(6) . . ?
O2 Dy1 N2 82.59(8) . . ?
C1 O1 Dy1 167.22(18) . . ?
C8 N1 Dy1 111.87(19) . . ?
C9 N1 Dy1 114.9(2) . . ?
C9 N1 C8 110.3(3) . . ?
C9 N1 C10 107.6(3) . . ?
C10 N1 Dy1 105.1(2) . . ?
C10 N1 C8 106.5(3) . . ?
O1 C1 C2 108.0(2) . . ?
O1 C1 C11 110.3(2) . . ?
O1 C1 C20 107.4(2) . . ?
C11 C1 C2 108.6(2) . . ?
C20 C1 C2 112.1(2) . . ?
C20 C1 C11 110.4(2) . . ?
C29 O2 Dy1 128.3(2) . . ?
C29 O2 C32 107.7(3) . . ?
C32 O2 Dy1 122.09(19) . . ?
C17 N2 Dy1 111.80(18) . . ?
C18 N2 Dy1 111.7(2) . . ?
C18 N2 C17 110.8(3) . . ?
C19 N2 Dy1 107.8(2) . . ?
C19 N2 C17 107.0(3) . . ?
C19 N2 C18 107.4(3) . . ?
C3 C2 C1 121.0(3) . . ?
C7 C2 C1 120.5(3) . . ?
C7 C2 C3 118.5(3) . . ?
C27 N3 C26 110.8(3) . . ?
C28 N3 C26 109.0(3) . . ?
C28 N3 C27 110.1(3) . . ?
C2 C3 C8 124.8(3) . . ?
C4 C3 C2 118.0(3) . . ?
C4 C3 C8 116.9(3) . . ?
C3 C4 H4 118.8 . . ?
C5 C4 C3 122.5(3) . . ?
C5 C4 H4 118.8 . . ?
C4 C5 H5 120.4 . . ?
C6 C5 C4 119.1(3) . . ?
C6 C5 H5 120.4 . . ?
C5 C6 H6 120.1 . . ?
C5 C6 C7 119.8(3) . . ?
C7 C6 H6 120.1 . . ?
C2 C7 C6 122.0(3) . . ?
C2 C7 H7 119.0 . . ?
C6 C7 H7 119.0 . . ?
N1 C8 C3 117.6(3) . . ?
N1 C8 H8A 107.9 . . ?
N1 C8 H8B 107.9 . . ?
C3 C8 H8A 107.9 . . ?
C3 C8 H8B 107.9 . . ?
H8A C8 H8B 107.2 . . ?
N1 C9 H9A 109.5 . . ?
N1 C9 H9B 109.5 . . ?
N1 C9 H9C 109.5 . . ?
H9A C9 H9B 109.5 . . ?
H9A C9 H9C 109.5 . . ?
H9B C9 H9C 109.5 . . ?
N1 C10 H10A 109.5 . . ?
N1 C10 H10B 109.5 . . ?
N1 C10 H10C 109.5 . . ?
H10A C10 H10B 109.5 . . ?
H10A C10 H10C 109.5 . . ?
H10B C10 H10C 109.5 . . ?
C12 C11 C1 122.6(3) . . ?
C16 C11 C1 118.7(3) . . ?
C16 C11 C12 118.6(3) . . ?
C11 C12 C17 126.0(3) . . ?
C13 C12 C11 117.9(3) . . ?
C13 C12 C17 115.9(3) . . ?
C12 C13 H13 118.6 . . ?
C14 C13 C12 122.9(3) . . ?
C14 C13 H13 118.6 . . ?
C13 C14 H14 120.4 . . ?
C15 C14 C13 119.2(3) . . ?
C15 C14 H14 120.4 . . ?
C14 C15 H15 120.3 . . ?
C14 C15 C16 119.4(3) . . ?
C16 C15 H15 120.3 . . ?
C11 C16 H16 119.0 . . ?
C15 C16 C11 122.0(3) . . ?
C15 C16 H16 119.0 . . ?
N2 C17 C12 117.5(3) . . ?
N2 C17 H17A 107.9 . . ?
N2 C17 H17B 107.9 . . ?
C12 C17 H17A 107.9 . . ?
C12 C17 H17B 107.9 . . ?
H17A C17 H17B 107.2 . . ?
N2 C18 H18A 109.5 . . ?
N2 C18 H18B 109.5 . . ?
N2 C18 H18C 109.5 . . ?
H18A C18 H18B 109.5 . . ?
H18A C18 H18C 109.5 . . ?
H18B C18 H18C 109.5 . . ?
N2 C19 H19A 109.5 . . ?
N2 C19 H19B 109.5 . . ?
N2 C19 H19C 109.5 . . ?
H19A C19 H19B 109.5 . . ?
H19A C19 H19C 109.5 . . ?
H19B C19 H19C 109.5 . . ?
C21 C20 C1 120.5(3) . . ?
C25 C20 C1 121.0(3) . . ?
C25 C20 C21 118.4(3) . . ?
C20 C21 C26 123.2(3) . . ?
C22 C21 C20 118.4(3) . . ?
C22 C21 C26 118.4(3) . . ?
C21 C22 H22 118.6 . . ?
C21 C22 C23 122.7(3) . . ?
C23 C22 H22 118.6 . . ?
C22 C23 H23 120.5 . . ?
C24 C23 C22 119.0(3) . . ?
C24 C23 H23 120.5 . . ?
C23 C24 H24 120.2 . . ?
C23 C24 C25 119.5(3) . . ?
C25 C24 H24 120.2 . . ?
C20 C25 H25 119.0 . . ?
C24 C25 C20 121.9(3) . . ?
C24 C25 H25 119.0 . . ?
N3 C26 C21 113.3(2) . . ?
N3 C26 H26A 108.9 . . ?
N3 C26 H26B 108.9 . . ?
C21 C26 H26A 108.9 . . ?
C21 C26 H26B 108.9 . . ?
H26A C26 H26B 107.7 . . ?
N3 C27 H27A 109.5 . . ?
N3 C27 H27B 109.5 . . ?
N3 C27 H27C 109.5 . . ?
H27A C27 H27B 109.5 . . ?
H27A C27 H27C 109.5 . . ?
H27B C27 H27C 109.5 . . ?
N3 C28 H28C 109.5 . . ?
N3 C28 H28A 109.5 . . ?
N3 C28 H28B 109.5 . . ?
H28C C28 H28A 109.5 . . ?
H28C C28 H28B 109.5 . . ?
H28A C28 H28B 109.5 . . ?
O2 C29 H29A 110.9 . . ?
O2 C29 H29B 110.9 . . ?
O2 C29 C30 104.3(3) . . ?
H29A C29 H29B 108.9 . . ?
C30 C29 H29A 110.9 . . ?
C30 C29 H29B 110.9 . . ?
C29 C30 H30A 111.1 . . ?
C29 C30 H30B 111.1 . . ?
C29 C30 C31 103.3(3) . . ?
H30A C30 H30B 109.1 . . ?
C31 C30 H30A 111.1 . . ?
C31 C30 H30B 111.1 . . ?
C30 C31 H31A 110.6 . . ?
C30 C31 H31B 110.6 . . ?
H31A C31 H31B 108.8 . . ?
C32 C31 C30 105.6(3) . . ?
C32 C31 H31A 110.6 . . ?
C32 C31 H31B 110.6 . . ?
O2 C32 C31 106.3(3) . . ?
O2 C32 H32A 110.5 . . ?
O2 C32 H32B 110.5 . . ?
C31 C32 H32A 110.5 . . ?
C31 C32 H32B 110.5 . . ?
H32A C32 H32B 108.7 . . ?

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 C1 C2 63.7(9) . . . . ?
Dy1 O1 C1 C11 -54.8(9) . . . . ?
Dy1 O1 C1 C20 -175.2(7) . . . . ?
Dy1 N1 C8 C3 -78.6(3) . . . . ?
Dy1 O2 C29 C30 130.5(3) . . . . ?
Dy1 O2 C32 C31 -147.1(3) . . . . ?
Dy1 N2 C17 C12 -81.0(3) . . . . ?
O1 C1 C2 C3 -47.0(3) . . . . ?
O1 C1 C2 C7 133.2(3) . . . . ?
O1 C1 C11 C12 -34.3(4) . . . . ?
O1 C1 C11 C16 148.8(3) . . . . ?
O1 C1 C20 C21 -50.9(3) . . . . ?
O1 C1 C20 C25 125.6(3) . . . . ?
C1 C2 C3 C4 179.0(3) . . . . ?
C1 C2 C3 C8 -7.6(5) . . . . ?
C1 C2 C7 C6 -178.4(3) . . . . ?
C1 C11 C12 C13 -176.8(3) . . . . ?
C1 C11 C12 C17 -2.3(5) . . . . ?
C1 C11 C16 C15 176.9(3) . . . . ?
C1 C20 C21 C22 174.7(3) . . . . ?
C1 C20 C21 C26 -2.9(4) . . . . ?
C1 C20 C25 C24 -175.0(3) . . . . ?
O2 C29 C30 C31 35.5(4) . . . . ?
C2 C1 C11 C12 -152.5(3) . . . . ?
C2 C1 C11 C16 30.6(4) . . . . ?
C2 C1 C20 C21 67.6(3) . . . . ?
C2 C1 C20 C25 -115.9(3) . . . . ?
C2 C3 C4 C5 -1.0(5) . . . . ?
C2 C3 C8 N1 94.1(4) . . . . ?
C3 C2 C7 C6 1.9(5) . . . . ?
C3 C4 C5 C6 2.6(5) . . . . ?
C4 C3 C8 N1 -92.5(3) . . . . ?
C4 C5 C6 C7 -1.9(5) . . . . ?
C5 C6 C7 C2 -0.3(5) . . . . ?
C7 C2 C3 C4 -1.2(4) . . . . ?
C7 C2 C3 C8 172.2(3) . . . . ?
C8 C3 C4 C5 -174.9(3) . . . . ?
C9 N1 C8 C3 50.6(4) . . . . ?
C10 N1 C8 C3 167.1(3) . . . . ?
C11 C1 C2 C3 72.6(3) . . . . ?
C11 C1 C2 C7 -107.1(3) . . . . ?
C11 C1 C20 C21 -171.2(3) . . . . ?
C11 C1 C20 C25 5.2(4) . . . . ?
C11 C12 C13 C14 -0.5(5) . . . . ?
C11 C12 C17 N2 87.8(4) . . . . ?
C12 C11 C16 C15 -0.1(5) . . . . ?
C12 C13 C14 C15 1.1(5) . . . . ?
C13 C12 C17 N2 -97.6(3) . . . . ?
C13 C14 C15 C16 -1.1(5) . . . . ?
C14 C15 C16 C11 0.6(5) . . . . ?
C16 C11 C12 C13 0.0(4) . . . . ?
C16 C11 C12 C17 174.6(3) . . . . ?
C17 C12 C13 C14 -175.6(3) . . . . ?
C18 N2 C17 C12 44.3(4) . . . . ?
C19 N2 C17 C12 161.2(3) . . . . ?
C20 C1 C2 C3 -165.2(3) . . . . ?
C20 C1 C2 C7 15.0(4) . . . . ?
C20 C1 C11 C12 84.3(3) . . . . ?
C20 C1 C11 C16 -92.6(3) . . . . ?
C20 C21 C22 C23 0.9(5) . . . . ?
C20 C21 C26 N3 -151.0(3) . . . . ?
C21 C20 C25 C24 1.5(5) . . . . ?
C21 C22 C23 C24 0.4(5) . . . . ?
C22 C21 C26 N3 31.4(4) . . . . ?
C22 C23 C24 C25 -0.7(5) . . . . ?
C23 C24 C25 C20 -0.2(5) . . . . ?
C25 C20 C21 C22 -1.8(4) . . . . ?
C25 C20 C21 C26 -179.4(3) . . . . ?
C26 C21 C22 C23 178.6(3) . . . . ?
C27 N3 C26 C21 70.1(3) . . . . ?
C28 N3 C26 C21 -168.5(3) . . . . ?
C29 O2 C32 C31 18.5(4) . . . . ?
C29 C30 C31 C32 -24.1(5) . . . . ?
C30 C31 C32 O2 4.4(5) . . . . ?
C32 O2 C29 C30 -33.9(4) . . . . ?

_olex2_submission_special_instructions 'No special instructions were received'
