# Supplementary Information (SI) for ChemComm.
# This journal is © The Royal Society of Chemistry 2024

####################################################################### 
# 
# 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_compound
_database_code_depnum_ccdc_archive 'CCDC 2377131'
loop_
_audit_author_name
_audit_author_address
'Vassilis Psycharis'
;Institute of Nanoscience and Nanotechology, NCSR  Demokritos 
Greece
;
_audit_update_record             
;
2024-10-03 deposited with the CCDC.	2024-10-08 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014/6
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C54.25 H60.50 Cl2.50 Dy F6 N6 O2 P Si2'
_chemical_formula_weight         1280.86

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Dy Dy -0.1892 4.4098 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Si Si 0.0817 0.0704 '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'

_space_group_crystal_system      monoclinic
_space_group_IT_number           7
_space_group_name_H-M_alt        'P n'
_space_group_name_Hall           'P -2yac'

_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.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'x+1/2, -y, z+1/2'

_cell_length_a                   20.8869(6)
_cell_length_b                   11.3031(4)
_cell_length_c                   23.5314(8)
_cell_angle_alpha                90
_cell_angle_beta                 98.8920(10)
_cell_angle_gamma                90
_cell_volume                     5488.7(3)
_cell_formula_units_Z            4
_cell_measurement_temperature    180(2)
_cell_measurement_reflns_used    31062
_cell_measurement_theta_min      3.025
_cell_measurement_theta_max      27.49

_exptl_crystal_description       paralelepiped
_exptl_crystal_colour            colorless
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.550
_exptl_crystal_F_000             2598
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.320
_exptl_crystal_size_mid          0.130
_exptl_crystal_size_min          0.090
_exptl_absorpt_coefficient_mu    1.624
_shelx_estimated_absorpt_T_min   0.625
_shelx_estimated_absorpt_T_max   0.868
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_correction_T_min  0.759
_exptl_absorpt_correction_T_max  1.000
_exptl_absorpt_process_details   'CrystalClear, Rigaku MSC, 2005'
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      180(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  'Rigaku R-AXIS SPIDER IPDS'
_diffrn_measurement_method       'θ scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            23012
_diffrn_reflns_av_unetI/netI     0.0436
_diffrn_reflns_v_R_equivalents   0.0593
_diffrn_reflns_limit_h_min       -26
_diffrn_reflns_limit_h_max       26
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_l_min       -27
_diffrn_reflns_limit_l_max       30
_diffrn_reflns_theta_min         3.024
_diffrn_reflns_theta_max         27.000
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measured_fraction_theta_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.998
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.998
_diffrn_reflns_point_group_measured_fraction_full 0.998
_reflns_number_total             23012
_reflns_number_gt                20201
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.999
_reflns_Friedel_fraction_max     0.998
_reflns_Friedel_fraction_full    0.998

_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 Structure factors included contributions from the .fab file.
 
 _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.
;

_computing_data_collection       'CrystalClear, Rigaku MSC< 2005'
_computing_cell_refinement       'CrystalClear, Rigaku MSC< 2005'
_computing_data_reduction        'CrystalClear, Rigaku MSC< 2005'
_computing_structure_solution    'SHELXL-2014/6 (Sheldrick, 2014)'
_computing_structure_refinement  'SHELXL-2014/6 (Sheldrick, 2014)'
_computing_molecular_graphics    'Diamond ver.3.2'
_computing_publication_material  'publCIF J.Appl.Cryst. 2010, 43, 920'
_refine_special_details          
;
 Refined as a 2-component inversion twin.
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0238P)²+23.9876P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_abs_structure_details 
;
 Refined as an inversion twin.
;
_refine_ls_abs_structure_Flack   0.539(10)
_chemical_absolute_configuration ?
_refine_ls_number_reflns         23012
_refine_ls_number_parameters     1280
_refine_ls_number_restraints     2198
_refine_ls_R_factor_all          0.0630
_refine_ls_R_factor_gt           0.0511
_refine_ls_wR_factor_ref         0.1087
_refine_ls_wR_factor_gt          0.1012
_refine_ls_goodness_of_fit_ref   1.062
_refine_ls_restrained_S_all      1.022
_refine_ls_shift/su_max          0.016
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_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 0.78874(2) 0.57103(3) 0.25982(2) 0.02613(9) Uani 1 1 d . U . . .
N1 N 0.8519(4) 0.7307(8) 0.2125(4) 0.0398(18) Uani 1 1 d . U . . .
N2 N 0.7414(4) 0.6357(7) 0.1594(4) 0.0340(17) Uani 1 1 d . U . . .
N3 N 0.6950(4) 0.4511(7) 0.2104(4) 0.0344(16) Uani 1 1 d . U . . .
N4 N 0.7699(5) 0.3808(8) 0.3130(4) 0.045(2) Uani 1 1 d . U . . .
H4N H 0.7945 0.3178 0.2958 0.054 Uiso 1 1 calc R U . . .
N5 N 0.7976(4) 0.5954(9) 0.3755(4) 0.047(2) Uani 1 1 d . U . . .
H5N H 0.7665 0.6600 0.3812 0.056 Uiso 1 1 calc R U . . .
N6 N 0.9029(4) 0.6130(8) 0.3162(4) 0.0426(19) Uani 1 1 d . U . . .
H6N H 0.9209 0.5370 0.3337 0.051 Uiso 1 1 calc R U . . .
C1 C 0.8604(8) 0.8788(12) 0.1386(6) 0.070(4) Uani 1 1 d . U . . .
H1A H 0.8327 0.9042 0.1033 0.106 Uiso 1 1 calc R U . . .
H1B H 0.8682 0.9458 0.1652 0.106 Uiso 1 1 calc R U . . .
H1C H 0.9019 0.8501 0.1293 0.106 Uiso 1 1 calc R U . . .
C2 C 0.8267(6) 0.7784(10) 0.1670(5) 0.048(2) Uani 1 1 d . U . . .
C3 C 0.7639(6) 0.7355(10) 0.1365(5) 0.043(2) Uani 1 1 d . U . . .
C4 C 0.7306(6) 0.7866(10) 0.0867(5) 0.052(3) Uani 1 1 d . U . . .
H4 H 0.7463 0.8568 0.0715 0.062 Uiso 1 1 calc R U . . .
C5 C 0.6753(6) 0.7346(11) 0.0601(5) 0.055(3) Uani 1 1 d . U . . .
H5 H 0.6520 0.7685 0.0261 0.065 Uiso 1 1 calc R U . . .
C6 C 0.6528(6) 0.6321(10) 0.0826(5) 0.051(3) Uani 1 1 d . U . . .
H6 H 0.6143 0.5949 0.0643 0.061 Uiso 1 1 calc R U . . .
C7 C 0.6875(5) 0.5850(9) 0.1325(4) 0.039(2) Uani 1 1 d . U . . .
C8 C 0.6669(5) 0.4738(9) 0.1596(5) 0.039(2) Uani 1 1 d . U . . .
C9 C 0.6173(6) 0.3949(11) 0.1249(5) 0.054(3) Uani 1 1 d . U . . .
H9A H 0.6027 0.4312 0.0873 0.081 Uiso 1 1 calc R U . . .
H9B H 0.6368 0.3176 0.1195 0.081 Uiso 1 1 calc R U . . .
H9C H 0.5802 0.3846 0.1454 0.081 Uiso 1 1 calc R U . . .
C10 C 0.6781(6) 0.3417(9) 0.2381(5) 0.044(2) Uani 1 1 d . U . . .
H10A H 0.6978 0.2733 0.2211 0.053 Uiso 1 1 calc R U . . .
H10B H 0.6305 0.3312 0.2313 0.053 Uiso 1 1 calc R U . . .
C11 C 0.7015(7) 0.3455(12) 0.3011(6) 0.058(3) Uani 1 1 d . U . . .
H11A H 0.6750 0.4024 0.3194 0.070 Uiso 1 1 calc R U . . .
H11B H 0.6963 0.2664 0.3179 0.070 Uiso 1 1 calc R U . . .
C12 C 0.7946(7) 0.3802(12) 0.3751(5) 0.052(3) Uani 1 1 d . U . . .
H12A H 0.8425 0.3740 0.3810 0.062 Uiso 1 1 calc R U . . .
H12B H 0.7774 0.3102 0.3930 0.062 Uiso 1 1 calc R U . . .
C13 C 0.7751(6) 0.4914(12) 0.4037(5) 0.055(3) Uani 1 1 d . U . . .
H13A H 0.7274 0.4942 0.4011 0.066 Uiso 1 1 calc R U . . .
H13B H 0.7943 0.4911 0.4449 0.066 Uiso 1 1 calc R U . . .
C14 C 0.8605(7) 0.6360(12) 0.4044(5) 0.059(3) Uani 1 1 d . U . . .
H14A H 0.8858 0.5678 0.4221 0.071 Uiso 1 1 calc R U . . .
H14B H 0.8544 0.6922 0.4354 0.071 Uiso 1 1 calc R U . . .
C15 C 0.8967(6) 0.6952(11) 0.3627(5) 0.055(3) Uani 1 1 d . U . . .
H15A H 0.8732 0.7670 0.3470 0.066 Uiso 1 1 calc R U . . .
H15B H 0.9402 0.7191 0.3822 0.066 Uiso 1 1 calc R U . . .
C16 C 0.9467(5) 0.6558(11) 0.2760(5) 0.048(3) Uani 1 1 d . U . . .
H16A H 0.9889 0.6794 0.2982 0.058 Uiso 1 1 calc R U . . .
H16B H 0.9545 0.5912 0.2495 0.058 Uiso 1 1 calc R U . . .
C17 C 0.9171(5) 0.7580(11) 0.2425(5) 0.049(3) Uani 1 1 d . U . . .
H17A H 0.9147 0.8258 0.2687 0.059 Uiso 1 1 calc R U . . .
H17B H 0.9450 0.7814 0.2140 0.059 Uiso 1 1 calc R U . . .
O1 O 0.7172(3) 0.7054(6) 0.2743(3) 0.0346(14) Uani 1 1 d . U . . .
Si1 Si 0.68789(13) 0.8245(2) 0.29624(11) 0.0314(6) Uani 1 1 d . U . . .
C18 C 0.6354(5) 0.9078(8) 0.2376(4) 0.032(2) Uani 1 1 d . U . . .
C19 C 0.6163(5) 0.8589(8) 0.1830(4) 0.035(2) Uani 1 1 d . U . . .
H19 H 0.6302 0.7813 0.1755 0.042 Uiso 1 1 calc R U . . .
C20 C 0.5776(5) 0.9200(10) 0.1396(5) 0.043(2) Uani 1 1 d . U . . .
H20 H 0.5650 0.8843 0.1030 0.052 Uiso 1 1 calc R U . . .
C21 C 0.5573(5) 1.0347(9) 0.1500(5) 0.045(2) Uani 1 1 d . U . . .
H21 H 0.5316 1.0779 0.1202 0.055 Uiso 1 1 calc R U . . .
C22 C 0.5746(5) 1.0850(8) 0.2033(5) 0.043(2) Uani 1 1 d . U . . .
H22 H 0.5593 1.1618 0.2108 0.051 Uiso 1 1 calc R U . . .
C23 C 0.6145(5) 1.0235(8) 0.2462(5) 0.038(2) Uani 1 1 d . U . . .
H23 H 0.6279 1.0609 0.2822 0.045 Uiso 1 1 calc R U . . .
C24 C 0.7555(5) 0.9299(9) 0.3242(4) 0.039(2) Uani 1 1 d . U . . .
C25 C 0.7930(6) 0.9730(10) 0.2859(5) 0.048(3) Uani 1 1 d . U . . .
H25 H 0.7816 0.9527 0.2464 0.058 Uiso 1 1 calc R U . . .
C26 C 0.8475(6) 1.0455(10) 0.3018(6) 0.053(3) Uani 1 1 d . U . . .
H26 H 0.8733 1.0705 0.2741 0.064 Uiso 1 1 calc R U . . .
C27 C 0.8625(8) 1.0791(13) 0.3578(7) 0.069(4) Uani 1 1 d . U . . .
H27 H 0.8987 1.1289 0.3698 0.082 Uiso 1 1 calc R U . . .
C28 C 0.8252(7) 1.0407(16) 0.3964(6) 0.084(5) Uani 1 1 d . U . . .
H28 H 0.8345 1.0671 0.4351 0.100 Uiso 1 1 calc R U . . .
C29 C 0.7739(7) 0.9637(14) 0.3807(6) 0.065(4) Uani 1 1 d . U . . .
H29 H 0.7510 0.9336 0.4094 0.078 Uiso 1 1 calc R U . . .
C30 C 0.6352(5) 0.7930(8) 0.3534(4) 0.034(2) Uani 1 1 d . U . . .
C31 C 0.6100(5) 0.8818(9) 0.3831(5) 0.043(2) Uani 1 1 d . U . . .
H31 H 0.6231 0.9612 0.3782 0.052 Uiso 1 1 calc R U . . .
C32 C 0.5662(6) 0.8586(10) 0.4200(5) 0.046(3) Uani 1 1 d . U . . .
H32 H 0.5500 0.9218 0.4402 0.055 Uiso 1 1 calc R U . . .
C33 C 0.5458(6) 0.7445(10) 0.4278(5) 0.049(3) Uani 1 1 d . U . . .
H33 H 0.5149 0.7294 0.4526 0.058 Uiso 1 1 calc R U . . .
C34 C 0.5704(5) 0.6540(10) 0.3998(5) 0.047(2) Uani 1 1 d . U . . .
H34 H 0.5573 0.5749 0.4055 0.056 Uiso 1 1 calc R U . . .
C35 C 0.6148(5) 0.6775(9) 0.3627(4) 0.037(2) Uani 1 1 d . U . . .
H35 H 0.6316 0.6137 0.3433 0.045 Uiso 1 1 calc R U . . .
O2 O 0.8437(3) 0.4496(6) 0.2127(3) 0.0331(14) Uani 1 1 d . U . . .
Si2 Si 0.86844(14) 0.3655(2) 0.16659(13) 0.0347(6) Uani 1 1 d . U . . .
C36 C 0.8007(5) 0.2702(9) 0.1275(5) 0.036(2) Uani 1 1 d . U . . .
C37 C 0.7764(5) 0.1761(9) 0.1558(5) 0.042(2) Uani 1 1 d . U . . .
H37 H 0.7950 0.1584 0.1943 0.050 Uiso 1 1 calc R U . . .
C38 C 0.7244(6) 0.1063(11) 0.1281(6) 0.049(3) Uani 1 1 d . U . . .
H38 H 0.7075 0.0436 0.1483 0.059 Uiso 1 1 calc R U . . .
C39 C 0.6987(6) 0.1298(11) 0.0726(5) 0.055(3) Uani 1 1 d . U . . .
H39 H 0.6641 0.0826 0.0540 0.066 Uiso 1 1 calc R U . . .
C40 C 0.7220(6) 0.2197(11) 0.0434(6) 0.058(3) Uani 1 1 d . U . . .
H40 H 0.7039 0.2342 0.0045 0.070 Uiso 1 1 calc R U . . .
C41 C 0.7723(5) 0.2913(11) 0.0704(5) 0.048(3) Uani 1 1 d . U . . .
H41 H 0.7874 0.3550 0.0497 0.057 Uiso 1 1 calc R U . . .
C42 C 0.9021(5) 0.4486(9) 0.1080(5) 0.044(2) Uani 1 1 d . U . . .
C43 C 0.9560(6) 0.4112(12) 0.0840(6) 0.057(3) Uani 1 1 d . U . . .
H43 H 0.9786 0.3422 0.0987 0.068 Uiso 1 1 calc R U . . .
C44 C 0.9773(7) 0.4725(16) 0.0390(6) 0.071(4) Uani 1 1 d . U . . .
H44 H 1.0152 0.4473 0.0246 0.085 Uiso 1 1 calc R U . . .
C45 C 0.9437(8) 0.5689(15) 0.0156(6) 0.076(4) Uani 1 1 d . U . . .
H45 H 0.9575 0.6095 -0.0157 0.091 Uiso 1 1 calc R U . . .
C46 C 0.8919(9) 0.6058(14) 0.0364(7) 0.082(4) Uani 1 1 d . U . . .
H46 H 0.8695 0.6741 0.0204 0.098 Uiso 1 1 calc R U . . .
C47 C 0.8696(8) 0.5462(11) 0.0815(6) 0.068(4) Uani 1 1 d . U . . .
H47 H 0.8312 0.5731 0.0944 0.081 Uiso 1 1 calc R U . . .
C48 C 0.9322(5) 0.2621(9) 0.2033(5) 0.045(2) Uani 1 1 d . U . . .
C49 C 0.9517(6) 0.1610(10) 0.1764(6) 0.058(3) Uani 1 1 d . U . . .
H49 H 0.9327 0.1443 0.1379 0.069 Uiso 1 1 calc R U . . .
C50 C 0.9976(6) 0.0853(11) 0.2040(8) 0.073(4) Uani 1 1 d . U . . .
H50 H 1.0090 0.0165 0.1847 0.088 Uiso 1 1 calc R U . . .
C51 C 1.0270(7) 0.1069(14) 0.2588(9) 0.088(5) Uani 1 1 d . U . . .
H51 H 1.0600 0.0556 0.2769 0.106 Uiso 1 1 calc R U . . .
C52 C 1.0085(8) 0.2045(14) 0.2880(8) 0.088(5) Uani 1 1 d . U . . .
H52 H 1.0274 0.2197 0.3267 0.105 Uiso 1 1 calc R U . . .
C53 C 0.9610(6) 0.2806(11) 0.2588(7) 0.062(4) Uani 1 1 d . U . . .
H53 H 0.9483 0.3478 0.2786 0.074 Uiso 1 1 calc R U . . .
Dy2 Dy 0.30890(2) 0.09187(5) 0.22431(2) 0.04435(15) Uani 1 1 d . U . . .
N7 N 0.2057(6) 0.2178(10) 0.2041(6) 0.077(3) Uani 1 1 d . U . . .
N8 N 0.2317(5) 0.0473(9) 0.1292(4) 0.053(2) Uani 1 1 d . U . . .
N9 N 0.3419(6) -0.0828(9) 0.1568(4) 0.058(2) Uani 1 1 d . U . . .
N10 N 0.4260(6) 0.0098(10) 0.2468(4) 0.059(2) Uani 1 1 d . U . . .
H10N H 0.4510 0.0556 0.2212 0.071 Uiso 1 1 calc R U . . .
N11 N 0.3565(5) 0.0786(10) 0.3369(4) 0.055(2) Uani 1 1 d . U . . .
H11N H 0.3225 0.0378 0.3554 0.067 Uiso 1 1 calc R U . . .
N12 N 0.3107(6) 0.2930(9) 0.2852(5) 0.064(2) Uani 1 1 d . U . . .
H12N H 0.3503 0.3347 0.2766 0.076 Uiso 1 1 calc R U . . .
C54 C 0.1142(8) 0.2917(15) 0.1377(8) 0.088(5) Uani 1 1 d . U . . .
H54A H 0.0914 0.2701 0.0996 0.132 Uiso 1 1 calc R U . . .
H54B H 0.0840 0.2886 0.1657 0.132 Uiso 1 1 calc R U . . .
H54C H 0.1315 0.3721 0.1365 0.132 Uiso 1 1 calc R U . . .
C55 C 0.1677(6) 0.2084(13) 0.1549(6) 0.063(3) Uani 1 1 d . U . . .
C56 C 0.1782(7) 0.1074(12) 0.1183(6) 0.063(3) Uani 1 1 d . U . . .
C57 C 0.1279(8) 0.0728(15) 0.0738(8) 0.091(5) Uani 1 1 d . U . . .
H57 H 0.0878 0.1137 0.0665 0.109 Uiso 1 1 calc R U . . .
C58 C 0.1409(9) -0.0237(14) 0.0417(7) 0.090(5) Uani 1 1 d . U . . .
H58 H 0.1091 -0.0474 0.0105 0.108 Uiso 1 1 calc R U . . .
C59 C 0.1959(9) -0.0858(15) 0.0522(7) 0.089(5) Uani 1 1 d . U . . .
H59 H 0.2022 -0.1536 0.0299 0.107 Uiso 1 1 calc R U . . .
C60 C 0.2446(7) -0.0481(10) 0.0974(5) 0.055(3) Uani 1 1 d . U . . .
C61 C 0.3050(8) -0.1083(12) 0.1090(7) 0.060(3) Uani 1 1 d . U . . .
C62 C 0.3261(7) -0.1960(11) 0.0674(6) 0.066(4) Uani 1 1 d . U . . .
H62A H 0.2921 -0.2038 0.0339 0.099 Uiso 1 1 calc R U . . .
H62B H 0.3662 -0.1681 0.0548 0.099 Uiso 1 1 calc R U . . .
H62C H 0.3339 -0.2730 0.0863 0.099 Uiso 1 1 calc R U . . .
C63 C 0.4041(8) -0.1321(14) 0.1699(7) 0.074(4) Uani 1 1 d . U . . .
H63A H 0.4325 -0.0958 0.1447 0.089 Uiso 1 1 calc R U . . .
H63B H 0.4015 -0.2179 0.1614 0.089 Uiso 1 1 calc R U . . .
C64 C 0.4340(8) -0.1149(13) 0.2312(7) 0.074(4) Uani 1 1 d . U . . .
H64A H 0.4126 -0.1670 0.2564 0.089 Uiso 1 1 calc R U . . .
H64B H 0.4806 -0.1354 0.2362 0.089 Uiso 1 1 calc R U . . .
C65 C 0.4590(6) 0.0343(13) 0.3055(5) 0.060(3) Uani 1 1 d . U . . .
H65A H 0.4711 0.1189 0.3092 0.072 Uiso 1 1 calc R U . . .
H65B H 0.4990 -0.0137 0.3138 0.072 Uiso 1 1 calc R U . . .
C66 C 0.4137(6) 0.0038(13) 0.3477(5) 0.058(3) Uani 1 1 d . U . . .
H66A H 0.4008 -0.0804 0.3434 0.070 Uiso 1 1 calc R U . . .
H66B H 0.4360 0.0161 0.3875 0.070 Uiso 1 1 calc R U . . .
C67 C 0.3681(8) 0.1947(15) 0.3668(6) 0.075(4) Uani 1 1 d . U . . .
H67A H 0.3677 0.1830 0.4085 0.090 Uiso 1 1 calc R U . . .
H67B H 0.4117 0.2237 0.3621 0.090 Uiso 1 1 calc R U . . .
C68 C 0.3214(10) 0.2826(14) 0.3461(7) 0.087(5) Uani 1 1 d . U . . .
H68A H 0.2799 0.2631 0.3592 0.104 Uiso 1 1 calc R U . . .
H68B H 0.3362 0.3600 0.3630 0.104 Uiso 1 1 calc R U . . .
C69 C 0.2587(10) 0.3726(15) 0.2634(10) 0.128(8) Uani 1 1 d . U . . .
H69A H 0.2700 0.4150 0.2295 0.153 Uiso 1 1 calc R U . . .
H69B H 0.2536 0.4321 0.2932 0.153 Uiso 1 1 calc R U . . .
C70 C 0.1960(10) 0.3096(16) 0.2465(9) 0.112(6) Uani 1 1 d . U . . .
H70A H 0.1819 0.2728 0.2807 0.134 Uiso 1 1 calc R U . . .
H70B H 0.1621 0.3661 0.2295 0.134 Uiso 1 1 calc R U . . .
O3 O 0.3570(4) 0.2160(7) 0.1766(3) 0.0514(19) Uani 1 1 d . U . . .
Si3 Si 0.37596(14) 0.3134(3) 0.13255(13) 0.0411(7) Uani 1 1 d . U . . .
C71 C 0.1540(5) -0.2254(9) 0.2318(5) 0.039(2) Uani 1 1 d . U . . .
C72 C 0.1233(6) -0.1682(11) 0.1838(5) 0.051(3) Uani 1 1 d . U . . .
H72 H 0.1359 -0.0896 0.1763 0.061 Uiso 1 1 calc R U . . .
C73 C 0.0737(7) -0.2224(14) 0.1453(6) 0.069(4) Uani 1 1 d . U . . .
H73 H 0.0527 -0.1806 0.1126 0.082 Uiso 1 1 calc R U . . .
C74 C 0.0559(6) -0.3362(13) 0.1555(7) 0.068(3) Uani 1 1 d . U . . .
H74 H 0.0228 -0.3739 0.1295 0.082 Uiso 1 1 calc R U . . .
C75 C 0.0852(7) -0.3954(12) 0.2027(7) 0.063(3) Uani 1 1 d . U . . .
H75 H 0.0716 -0.4734 0.2098 0.076 Uiso 1 1 calc R U . . .
C76 C 0.1351(6) -0.3431(10) 0.2410(6) 0.051(3) Uani 1 1 d . U . . .
H76 H 0.1562 -0.3866 0.2730 0.061 Uiso 1 1 calc R U . . .
C77 C 0.1732(5) -0.0855(9) 0.3427(5) 0.041(2) Uani 1 1 d . U . . .
C78 C 0.1350(10) -0.1557(13) 0.3729(8) 0.100(6) Uani 1 1 d . U . . .
H78 H 0.1298 -0.2377 0.3647 0.120 Uiso 1 1 calc R U . . .
C79 C 0.1047(11) -0.1036(15) 0.4151(9) 0.115(7) Uani 1 1 d . U . . .
H79 H 0.0793 -0.1517 0.4361 0.138 Uiso 1 1 calc R U . . .
C80 C 0.1100(10) 0.0130(15) 0.4274(8) 0.099(6) Uani 1 1 d . U . . .
H80 H 0.0887 0.0455 0.4566 0.119 Uiso 1 1 calc R U . . .
C81 C 0.1449(6) 0.0819(12) 0.3988(6) 0.062(3) Uani 1 1 d . U . . .
H81 H 0.1469 0.1650 0.4050 0.074 Uiso 1 1 calc R U . . .
C82 C 0.1781(6) 0.0285(11) 0.3594(6) 0.052(3) Uani 1 1 d . U . . .
H82 H 0.2073 0.0769 0.3425 0.063 Uiso 1 1 calc R U . . .
C83 C 0.2797(6) -0.2566(9) 0.3164(5) 0.047(2) Uani 1 1 d . U . . .
C84 C 0.3167(6) -0.3116(12) 0.2801(7) 0.063(3) Uani 1 1 d . U . . .
H84 H 0.3072 -0.2989 0.2398 0.075 Uiso 1 1 calc R U . . .
C85 C 0.3687(7) -0.3870(13) 0.3028(9) 0.083(4) Uani 1 1 d . U . . .
H85 H 0.3935 -0.4248 0.2775 0.099 Uiso 1 1 calc R U . . .
C86 C 0.3833(9) -0.4054(13) 0.3592(11) 0.086(5) Uani 1 1 d . U . . .
H86 H 0.4198 -0.4526 0.3737 0.103 Uiso 1 1 calc R U . . .
C87 C 0.3471(8) -0.3581(13) 0.3963(8) 0.083(4) Uani 1 1 d . U . . .
H87 H 0.3560 -0.3764 0.4362 0.100 Uiso 1 1 calc R U . . .
C88 C 0.2957(6) -0.2808(11) 0.3747(6) 0.059(3) Uani 1 1 d . U . . .
H88 H 0.2714 -0.2444 0.4009 0.071 Uiso 1 1 calc R U . . .
O4 O 0.2488(4) -0.0396(7) 0.2560(3) 0.0447(18) Uani 1 1 d . U . . .
Si4 Si 0.21615(13) -0.1470(2) 0.28483(12) 0.0327(6) Uani 1 1 d . U . . .
C89 C 0.3023(6) 0.3963(15) 0.0972(6) 0.069(4) Uani 1 1 d . U . . .
C90 C 0.2818(7) 0.5001(15) 0.1217(10) 0.101(5) Uani 1 1 d . U . . .
H90 H 0.3074 0.5341 0.1545 0.121 Uiso 1 1 calc R U . . .
C91 C 0.2229(9) 0.554(2) 0.0971(13) 0.138(7) Uani 1 1 d . U . . .
H91 H 0.2081 0.6234 0.1136 0.166 Uiso 1 1 calc R U . . .
C92 C 0.1871(10) 0.503(3) 0.0487(13) 0.161(9) Uani 1 1 d . U . . .
H92 H 0.1488 0.5422 0.0311 0.193 Uiso 1 1 calc R U . . .
C93 C 0.2049(9) 0.398(3) 0.0250(9) 0.152(8) Uani 1 1 d . U . . .
H93 H 0.1780 0.3613 -0.0065 0.183 Uiso 1 1 calc R U . . .
C94 C 0.2641(6) 0.347(2) 0.0494(7) 0.110(5) Uani 1 1 d . U . . .
H94 H 0.2786 0.2773 0.0328 0.132 Uiso 1 1 calc R U . . .
C95 C 0.4150(5) 0.2410(10) 0.0758(4) 0.045(2) Uani 1 1 d . U . . .
C96 C 0.4600(6) 0.2927(10) 0.0469(5) 0.048(2) Uani 1 1 d . U . . .
H96 H 0.4715 0.3727 0.0554 0.057 Uiso 1 1 calc R U . . .
C97 C 0.4892(7) 0.2352(12) 0.0066(6) 0.065(3) Uani 1 1 d . U . . .
H97 H 0.5205 0.2743 -0.0121 0.079 Uiso 1 1 calc R U . . .
C98 C 0.4719(8) 0.1171(13) -0.0067(6) 0.072(4) Uani 1 1 d . U . . .
H98 H 0.4897 0.0765 -0.0360 0.087 Uiso 1 1 calc R U . . .
C99 C 0.4297(9) 0.0616(13) 0.0226(6) 0.084(5) Uani 1 1 d . U . . .
H99 H 0.4197 -0.0195 0.0155 0.100 Uiso 1 1 calc R U . . .
C100 C 0.4021(7) 0.1210(11) 0.0618(5) 0.062(3) Uani 1 1 d . U . . .
H100 H 0.3722 0.0800 0.0813 0.075 Uiso 1 1 calc R U . . .
C101 C 0.4369(4) 0.4218(8) 0.1703(4) 0.0317(19) Uani 1 1 d . U . . .
C102 C 0.4706(5) 0.3931(9) 0.2254(5) 0.038(2) Uani 1 1 d . U . . .
H102 H 0.4606 0.3226 0.2441 0.045 Uiso 1 1 calc R U . . .
C103 C 0.5187(5) 0.4698(10) 0.2522(5) 0.043(2) Uani 1 1 d . U . . .
H103 H 0.5411 0.4510 0.2894 0.052 Uiso 1 1 calc R U . . .
C104 C 0.5343(5) 0.5726(10) 0.2253(5) 0.047(3) Uani 1 1 d . U . . .
H104 H 0.5674 0.6234 0.2436 0.056 Uiso 1 1 calc R U . . .
C105 C 0.5013(5) 0.6004(10) 0.1717(5) 0.049(3) Uani 1 1 d . U . . .
H105 H 0.5114 0.6709 0.1530 0.059 Uiso 1 1 calc R U . . .
C106 C 0.4531(5) 0.5254(9) 0.1452(4) 0.038(2) Uani 1 1 d . U . . .
H106 H 0.4304 0.5464 0.1084 0.046 Uiso 1 1 calc R U . . .
P1 P 0.57895(14) 0.2654(2) 0.41323(13) 0.0411(6) Uani 1 1 d . U . . .
F1 F 0.5741(4) 0.2354(7) 0.3467(3) 0.072(2) Uani 1 1 d . U . . .
F2 F 0.5385(4) 0.1496(6) 0.4224(4) 0.074(2) Uani 1 1 d . U . . .
F3 F 0.5140(3) 0.3385(7) 0.3995(3) 0.0662(19) Uani 1 1 d . U . . .
F4 F 0.6447(4) 0.1927(7) 0.4252(4) 0.080(2) Uani 1 1 d . U . . .
F5 F 0.6192(4) 0.3808(6) 0.4034(4) 0.068(2) Uani 1 1 d . U . . .
F6 F 0.5839(4) 0.2943(8) 0.4792(3) 0.078(2) Uani 1 1 d . U . . .
P2 P 0.98062(16) 0.3310(3) 0.47721(14) 0.0514(7) Uani 1 1 d . U . . .
F7 F 0.9452(6) 0.2107(8) 0.4608(4) 0.108(3) Uani 1 1 d . U . . .
F8 F 0.9641(4) 0.3764(9) 0.4128(3) 0.078(2) Uani 1 1 d . U . . .
F9 F 0.9157(4) 0.3869(9) 0.4914(3) 0.084(3) Uani 1 1 d . U . . .
F10 F 1.0479(4) 0.2814(8) 0.4629(4) 0.085(3) Uani 1 1 d . U . . .
F11 F 1.0177(4) 0.4523(7) 0.4946(4) 0.081(2) Uani 1 1 d . U . . .
F12 F 0.9985(4) 0.2865(8) 0.5414(3) 0.082(2) Uani 1 1 d . U . . .


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

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Dy1 O1 2.194(6) . ?
Dy1 O2 2.196(7) . ?
Dy1 N3 2.514(8) . ?
Dy1 N2 2.525(8) . ?
Dy1 N4 2.548(9) . ?
Dy1 N1 2.586(9) . ?
Dy1 N6 2.588(8) . ?
Dy1 N5 2.713(9) . ?
N1 C2 1.242(14) . ?
N1 C17 1.467(13) . ?
N2 C7 1.333(13) . ?
N2 C3 1.365(14) . ?
N3 C8 1.274(13) . ?
N3 C10 1.467(13) . ?
N4 C11 1.467(16) . ?
N4 C12 1.472(15) . ?
N5 C14 1.458(15) . ?
N5 C13 1.464(15) . ?
N6 C15 1.455(14) . ?
N6 C16 1.494(14) . ?
C1 C2 1.542(16) . ?
C2 C3 1.476(16) . ?
C3 C4 1.392(15) . ?
C4 C5 1.359(17) . ?
C5 C6 1.386(17) . ?
C6 C7 1.387(15) . ?
C7 C8 1.502(15) . ?
C8 C9 1.506(14) . ?
C10 C11 1.487(17) . ?
C12 C13 1.512(18) . ?
C14 C15 1.487(17) . ?
C16 C17 1.479(17) . ?
O1 Si1 1.597(7) . ?
Si1 C18 1.878(10) . ?
Si1 C24 1.887(11) . ?
Si1 C30 1.899(11) . ?
C18 C19 1.399(14) . ?
C18 C23 1.403(13) . ?
C19 C20 1.385(14) . ?
C20 C21 1.397(15) . ?
C21 C22 1.372(16) . ?
C22 C23 1.392(15) . ?
C24 C25 1.374(16) . ?
C24 C29 1.378(15) . ?
C25 C26 1.405(15) . ?
C26 C27 1.361(18) . ?
C27 C28 1.35(2) . ?
C28 C29 1.39(2) . ?
C30 C31 1.373(13) . ?
C30 C35 1.401(14) . ?
C31 C32 1.380(15) . ?
C32 C33 1.379(16) . ?
C33 C34 1.360(15) . ?
C34 C35 1.395(15) . ?
O2 Si2 1.588(7) . ?
Si2 C48 1.879(11) . ?
Si2 C42 1.890(11) . ?
Si2 C36 1.899(10) . ?
C36 C37 1.392(15) . ?
C36 C41 1.403(15) . ?
C37 C38 1.417(16) . ?
C38 C39 1.359(19) . ?
C39 C40 1.358(18) . ?
C40 C41 1.398(16) . ?
C42 C47 1.392(17) . ?
C42 C43 1.401(15) . ?
C43 C44 1.40(2) . ?
C44 C45 1.37(2) . ?
C45 C46 1.32(2) . ?
C46 C47 1.396(17) . ?
C48 C53 1.367(18) . ?
C48 C49 1.397(15) . ?
C49 C50 1.372(18) . ?
C50 C51 1.36(2) . ?
C51 C52 1.38(2) . ?
C52 C53 1.409(18) . ?
Dy2 O3 2.143(7) . ?
Dy2 O4 2.152(7) . ?
Dy2 N7 2.566(12) . ?
Dy2 N10 2.592(11) . ?
Dy2 N8 2.598(10) . ?
Dy2 N12 2.684(11) . ?
Dy2 N11 2.686(10) . ?
Dy2 N9 2.690(11) . ?
N7 C55 1.302(17) . ?
N7 C70 1.48(2) . ?
N8 C56 1.298(17) . ?
N8 C60 1.364(16) . ?
N9 C61 1.294(18) . ?
N9 C63 1.40(2) . ?
N10 C65 1.472(15) . ?
N10 C64 1.472(18) . ?
N11 C66 1.453(17) . ?
N11 C67 1.492(17) . ?
N12 C68 1.420(18) . ?
N12 C69 1.44(2) . ?
C54 C55 1.469(18) . ?
C55 C56 1.47(2) . ?
C56 C57 1.42(2) . ?
C57 C58 1.38(2) . ?
C58 C59 1.33(2) . ?
C59 C60 1.419(19) . ?
C60 C61 1.42(2) . ?
C61 C62 1.507(19) . ?
C63 C64 1.49(2) . ?
C65 C66 1.513(17) . ?
C67 C68 1.42(2) . ?
C69 C70 1.49(3) . ?
O3 Si3 1.602(8) . ?
Si3 C95 1.859(13) . ?
Si3 C89 1.882(13) . ?
Si3 C101 1.887(10) . ?
C71 C72 1.372(16) . ?
C71 C76 1.414(15) . ?
C71 Si4 1.878(11) . ?
C72 C73 1.406(16) . ?
C73 C74 1.37(2) . ?
C74 C75 1.36(2) . ?
C75 C76 1.398(18) . ?
C77 C82 1.347(15) . ?
C77 C78 1.396(17) . ?
C77 Si4 1.875(12) . ?
C78 C79 1.39(2) . ?
C79 C80 1.35(2) . ?
C80 C81 1.32(2) . ?
C81 C82 1.380(17) . ?
C83 C84 1.383(18) . ?
C83 C88 1.390(17) . ?
C83 Si4 1.882(12) . ?
C84 C85 1.42(2) . ?
C85 C86 1.33(3) . ?
C86 C87 1.35(3) . ?
C87 C88 1.417(18) . ?
O4 Si4 1.594(7) . ?
C89 C94 1.39(2) . ?
C89 C90 1.40(3) . ?
C90 C91 1.41(2) . ?
C91 C92 1.39(4) . ?
C92 C93 1.39(4) . ?
C93 C94 1.40(3) . ?
C95 C96 1.371(16) . ?
C95 C100 1.412(16) . ?
C96 C97 1.370(17) . ?
C97 C98 1.405(19) . ?
C98 C99 1.36(2) . ?
C99 C100 1.34(2) . ?
C101 C106 1.377(13) . ?
C101 C102 1.414(13) . ?
C102 C103 1.401(15) . ?
C103 C104 1.386(15) . ?
C104 C105 1.376(15) . ?
C105 C106 1.388(14) . ?
P1 F6 1.574(8) . ?
P1 F3 1.579(7) . ?
P1 F4 1.587(8) . ?
P1 F5 1.588(7) . ?
P1 F1 1.590(8) . ?
P1 F2 1.591(7) . ?
P2 F7 1.568(9) . ?
P2 F9 1.578(8) . ?
P2 F12 1.581(8) . ?
P2 F8 1.586(8) . ?
P2 F10 1.596(8) . ?
P2 F11 1.597(8) . ?

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 O2 158.8(3) . . ?
O1 Dy1 N3 86.8(3) . . ?
O2 Dy1 N3 81.9(3) . . ?
O1 Dy1 N2 76.5(3) . . ?
O2 Dy1 N2 82.4(3) . . ?
N3 Dy1 N2 63.8(3) . . ?
O1 Dy1 N4 110.3(3) . . ?
O2 Dy1 N4 81.6(3) . . ?
N3 Dy1 N4 66.7(3) . . ?
N2 Dy1 N4 129.5(3) . . ?
O1 Dy1 N1 89.3(3) . . ?
O2 Dy1 N1 83.0(3) . . ?
N3 Dy1 N1 126.1(3) . . ?
N2 Dy1 N1 63.1(3) . . ?
N4 Dy1 N1 158.1(3) . . ?
O1 Dy1 N6 112.9(3) . . ?
O2 Dy1 N6 82.0(3) . . ?
N3 Dy1 N6 157.9(3) . . ?
N2 Dy1 N6 128.6(3) . . ?
N4 Dy1 N6 95.9(3) . . ?
N1 Dy1 N6 66.5(3) . . ?
O1 Dy1 N5 73.6(3) . . ?
O2 Dy1 N5 127.6(3) . . ?
N3 Dy1 N5 116.5(3) . . ?
N2 Dy1 N5 150.0(3) . . ?
N4 Dy1 N5 65.5(3) . . ?
N1 Dy1 N5 113.6(3) . . ?
N6 Dy1 N5 63.4(3) . . ?
C2 N1 C17 124.2(10) . . ?
C2 N1 Dy1 119.9(8) . . ?
C17 N1 Dy1 115.9(7) . . ?
C7 N2 C3 119.0(9) . . ?
C7 N2 Dy1 120.0(7) . . ?
C3 N2 Dy1 120.0(7) . . ?
C8 N3 C10 118.7(9) . . ?
C8 N3 Dy1 122.6(7) . . ?
C10 N3 Dy1 118.2(6) . . ?
C11 N4 C12 111.7(10) . . ?
C11 N4 Dy1 110.8(7) . . ?
C12 N4 Dy1 115.7(7) . . ?
C14 N5 C13 111.7(9) . . ?
C14 N5 Dy1 114.7(7) . . ?
C13 N5 Dy1 113.4(7) . . ?
C15 N6 C16 113.8(9) . . ?
C15 N6 Dy1 108.7(7) . . ?
C16 N6 Dy1 109.9(6) . . ?
N1 C2 C3 120.2(10) . . ?
N1 C2 C1 122.1(11) . . ?
C3 C2 C1 117.6(11) . . ?
N2 C3 C4 121.2(11) . . ?
N2 C3 C2 114.4(10) . . ?
C4 C3 C2 124.3(11) . . ?
C5 C4 C3 119.1(11) . . ?
C4 C5 C6 120.0(11) . . ?
C5 C6 C7 118.7(11) . . ?
N2 C7 C6 122.0(10) . . ?
N2 C7 C8 115.8(9) . . ?
C6 C7 C8 122.2(10) . . ?
N3 C8 C7 116.4(9) . . ?
N3 C8 C9 124.6(10) . . ?
C7 C8 C9 118.9(10) . . ?
N3 C10 C11 110.8(9) . . ?
N4 C11 C10 111.0(11) . . ?
N4 C12 C13 111.2(10) . . ?
N5 C13 C12 109.7(10) . . ?
N5 C14 C15 110.3(10) . . ?
N6 C15 C14 108.8(10) . . ?
C17 C16 N6 110.2(9) . . ?
N1 C17 C16 111.8(9) . . ?
Si1 O1 Dy1 159.7(4) . . ?
O1 Si1 C18 113.2(4) . . ?
O1 Si1 C24 110.0(4) . . ?
C18 Si1 C24 105.1(4) . . ?
O1 Si1 C30 111.4(4) . . ?
C18 Si1 C30 106.1(4) . . ?
C24 Si1 C30 110.8(5) . . ?
C19 C18 C23 116.7(9) . . ?
C19 C18 Si1 121.9(7) . . ?
C23 C18 Si1 121.4(8) . . ?
C20 C19 C18 122.1(9) . . ?
C19 C20 C21 119.4(10) . . ?
C22 C21 C20 120.1(10) . . ?
C21 C22 C23 119.9(9) . . ?
C22 C23 C18 121.7(10) . . ?
C25 C24 C29 115.6(11) . . ?
C25 C24 Si1 117.8(8) . . ?
C29 C24 Si1 126.5(10) . . ?
C24 C25 C26 123.5(11) . . ?
C27 C26 C25 118.4(13) . . ?
C28 C27 C26 119.3(14) . . ?
C27 C28 C29 121.5(13) . . ?
C24 C29 C28 121.4(14) . . ?
C31 C30 C35 116.9(10) . . ?
C31 C30 Si1 122.2(8) . . ?
C35 C30 Si1 120.6(7) . . ?
C30 C31 C32 121.6(10) . . ?
C33 C32 C31 120.7(10) . . ?
C34 C33 C32 119.4(10) . . ?
C33 C34 C35 119.8(10) . . ?
C34 C35 C30 121.5(9) . . ?
Si2 O2 Dy1 165.9(4) . . ?
O2 Si2 C48 110.0(5) . . ?
O2 Si2 C42 113.4(4) . . ?
C48 Si2 C42 109.1(5) . . ?
O2 Si2 C36 111.9(4) . . ?
C48 Si2 C36 107.0(5) . . ?
C42 Si2 C36 105.2(5) . . ?
C37 C36 C41 117.1(10) . . ?
C37 C36 Si2 120.1(8) . . ?
C41 C36 Si2 122.8(8) . . ?
C36 C37 C38 121.1(11) . . ?
C39 C38 C37 119.5(12) . . ?
C40 C39 C38 120.9(12) . . ?
C39 C40 C41 120.4(12) . . ?
C40 C41 C36 120.9(11) . . ?
C47 C42 C43 115.1(11) . . ?
C47 C42 Si2 120.7(9) . . ?
C43 C42 Si2 123.9(10) . . ?
C44 C43 C42 121.9(14) . . ?
C45 C44 C43 119.8(14) . . ?
C46 C45 C44 120.1(14) . . ?
C45 C46 C47 121.3(16) . . ?
C42 C47 C46 121.7(13) . . ?
C53 C48 C49 116.3(11) . . ?
C53 C48 Si2 121.3(8) . . ?
C49 C48 Si2 122.4(10) . . ?
C50 C49 C48 121.7(13) . . ?
C51 C50 C49 121.1(13) . . ?
C50 C51 C52 119.5(13) . . ?
C51 C52 C53 118.3(15) . . ?
C48 C53 C52 123.0(13) . . ?
O3 Dy2 O4 168.6(3) . . ?
O3 Dy2 N7 89.3(4) . . ?
O4 Dy2 N7 85.9(4) . . ?
O3 Dy2 N10 80.6(3) . . ?
O4 Dy2 N10 105.4(3) . . ?
N7 Dy2 N10 167.3(4) . . ?
O3 Dy2 N8 87.4(3) . . ?
O4 Dy2 N8 81.2(3) . . ?
N7 Dy2 N8 63.6(4) . . ?
N10 Dy2 N8 123.1(3) . . ?
O3 Dy2 N12 75.9(3) . . ?
O4 Dy2 N12 111.1(3) . . ?
N7 Dy2 N12 64.6(4) . . ?
N10 Dy2 N12 105.1(4) . . ?
N8 Dy2 N12 125.4(3) . . ?
O3 Dy2 N11 114.9(3) . . ?
O4 Dy2 N11 76.5(3) . . ?
N7 Dy2 N11 112.7(4) . . ?
N10 Dy2 N11 65.5(3) . . ?
N8 Dy2 N11 157.6(3) . . ?
N12 Dy2 N11 63.2(3) . . ?
O3 Dy2 N9 89.2(3) . . ?
O4 Dy2 N9 85.1(3) . . ?
N7 Dy2 N9 125.6(4) . . ?
N10 Dy2 N9 62.5(4) . . ?
N8 Dy2 N9 62.0(4) . . ?
N12 Dy2 N9 162.4(3) . . ?
N11 Dy2 N9 116.9(4) . . ?
C55 N7 C70 122.0(13) . . ?
C55 N7 Dy2 119.9(10) . . ?
C70 N7 Dy2 117.6(9) . . ?
C56 N8 C60 122.9(12) . . ?
C56 N8 Dy2 118.0(9) . . ?
C60 N8 Dy2 118.5(8) . . ?
C61 N9 C63 120.6(13) . . ?
C61 N9 Dy2 120.3(10) . . ?
C63 N9 Dy2 118.4(9) . . ?
C65 N10 C64 111.1(11) . . ?
C65 N10 Dy2 114.5(8) . . ?
C64 N10 Dy2 115.6(9) . . ?
C66 N11 C67 111.1(10) . . ?
C66 N11 Dy2 111.9(7) . . ?
C67 N11 Dy2 115.1(8) . . ?
C68 N12 C69 113.8(16) . . ?
C68 N12 Dy2 117.1(9) . . ?
C69 N12 Dy2 113.0(9) . . ?
N7 C55 C56 117.3(12) . . ?
N7 C55 C54 121.7(15) . . ?
C56 C55 C54 120.9(14) . . ?
N8 C56 C57 121.1(14) . . ?
N8 C56 C55 119.6(12) . . ?
C57 C56 C55 119.1(14) . . ?
C58 C57 C56 115.9(15) . . ?
C59 C58 C57 123.5(15) . . ?
C58 C59 C60 118.5(15) . . ?
N8 C60 C59 117.9(14) . . ?
N8 C60 C61 121.2(11) . . ?
C59 C60 C61 120.9(13) . . ?
N9 C61 C60 116.9(13) . . ?
N9 C61 C62 121.1(15) . . ?
C60 C61 C62 122.0(13) . . ?
N9 C63 C64 113.2(15) . . ?
N10 C64 C63 108.6(13) . . ?
N10 C65 C66 108.9(10) . . ?
N11 C66 C65 109.5(10) . . ?
C68 C67 N11 113.5(12) . . ?
N12 C68 C67 113.4(15) . . ?
N12 C69 C70 112.3(14) . . ?
N7 C70 C69 108.0(18) . . ?
Si3 O3 Dy2 166.3(5) . . ?
O3 Si3 C95 110.0(5) . . ?
O3 Si3 C89 111.2(5) . . ?
C95 Si3 C89 108.7(6) . . ?
O3 Si3 C101 111.0(4) . . ?
C95 Si3 C101 106.5(5) . . ?
C89 Si3 C101 109.3(6) . . ?
C72 C71 C76 117.6(11) . . ?
C72 C71 Si4 120.8(8) . . ?
C76 C71 Si4 121.6(9) . . ?
C71 C72 C73 121.9(12) . . ?
C74 C73 C72 119.3(13) . . ?
C75 C74 C73 120.3(12) . . ?
C74 C75 C76 121.0(13) . . ?
C75 C76 C71 119.8(12) . . ?
C82 C77 C78 114.7(12) . . ?
C82 C77 Si4 123.0(9) . . ?
C78 C77 Si4 122.3(9) . . ?
C79 C78 C77 118.9(14) . . ?
C80 C79 C78 122.4(16) . . ?
C81 C80 C79 120.1(16) . . ?
C80 C81 C82 117.3(13) . . ?
C77 C82 C81 126.3(12) . . ?
C84 C83 C88 116.7(12) . . ?
C84 C83 Si4 118.7(10) . . ?
C88 C83 Si4 124.5(10) . . ?
C83 C84 C85 120.4(15) . . ?
C86 C85 C84 120.8(16) . . ?
C85 C86 C87 121.2(16) . . ?
C86 C87 C88 118.7(17) . . ?
C83 C88 C87 122.0(15) . . ?
Si4 O4 Dy2 169.8(5) . . ?
O4 Si4 C77 108.1(5) . . ?
O4 Si4 C71 112.0(5) . . ?
C77 Si4 C71 107.3(5) . . ?
O4 Si4 C83 110.3(5) . . ?
C77 Si4 C83 110.2(5) . . ?
C71 Si4 C83 108.9(5) . . ?
C94 C89 C90 119.6(15) . . ?
C94 C89 Si3 119.1(15) . . ?
C90 C89 Si3 121.0(12) . . ?
C89 C90 C91 119(2) . . ?
C92 C91 C90 119(3) . . ?
C91 C92 C93 122.7(19) . . ?
C92 C93 C94 117(2) . . ?
C89 C94 C93 122(2) . . ?
C96 C95 C100 114.5(12) . . ?
C96 C95 Si3 125.3(9) . . ?
C100 C95 Si3 120.1(9) . . ?
C97 C96 C95 123.6(11) . . ?
C96 C97 C98 118.6(13) . . ?
C99 C98 C97 119.4(14) . . ?
C100 C99 C98 120.1(14) . . ?
C99 C100 C95 123.7(13) . . ?
C106 C101 C102 117.9(9) . . ?
C106 C101 Si3 122.9(7) . . ?
C102 C101 Si3 119.1(7) . . ?
C103 C102 C101 119.4(9) . . ?
C104 C103 C102 121.0(10) . . ?
C105 C104 C103 119.4(10) . . ?
C104 C105 C106 119.9(10) . . ?
C101 C106 C105 122.4(10) . . ?
F6 P1 F3 91.0(5) . . ?
F6 P1 F4 90.5(5) . . ?
F3 P1 F4 178.3(5) . . ?
F6 P1 F5 91.0(5) . . ?
F3 P1 F5 89.9(4) . . ?
F4 P1 F5 89.3(4) . . ?
F6 P1 F1 179.6(5) . . ?
F3 P1 F1 89.3(5) . . ?
F4 P1 F1 89.2(5) . . ?
F5 P1 F1 89.2(4) . . ?
F6 P1 F2 89.5(5) . . ?
F3 P1 F2 90.1(4) . . ?
F4 P1 F2 90.7(5) . . ?
F5 P1 F2 179.4(5) . . ?
F1 P1 F2 90.2(4) . . ?
F7 P2 F9 90.7(6) . . ?
F7 P2 F12 89.6(5) . . ?
F9 P2 F12 90.5(5) . . ?
F7 P2 F8 91.2(5) . . ?
F9 P2 F8 90.3(4) . . ?
F12 P2 F8 178.9(5) . . ?
F7 P2 F10 92.3(6) . . ?
F9 P2 F10 176.9(6) . . ?
F12 P2 F10 90.2(5) . . ?
F8 P2 F10 88.9(5) . . ?
F7 P2 F11 179.0(6) . . ?
F9 P2 F11 90.0(5) . . ?
F12 P2 F11 89.7(5) . . ?
F8 P2 F11 89.6(5) . . ?
F10 P2 F11 87.0(5) . . ?

_refine_diff_density_max         4.689
_refine_diff_density_min         -4.070
_refine_diff_density_rms         0.111

_shelxl_version_number           2014/6

# start Validation Reply Form

_vrf_PLAT881_compound            
;

PROBLEM: No Datum for _diffrn_reflns_av_R_equivalents ...     Please Do !     
  
RESPONSE:  We have given the value of av_R_equivalents
;


_vrf_PLAT971_compound            
;

PROBLEM: Check Calcd Resid. Dens.  0.84 Ang From Dy2             4.05 eA-3  
      
RESPONSE:  The residual density occurs within the range of 1.0 Ang to the Dy2 
atoms, a maximum value of Z*0.1*0.75 =4.95 eA-3 is allowed and not exceeded.
(DIFMX02 Type_1 test)

;

_vrf_PLAT910_compound            
;
PROBLEM: Missing # of FCF Reflection(s) Below Theta(Min).         20 Note   
  
RESPONSE:  This is probably due to instrument limitations
;

_vrf_PLAT972_compound            
;


PROBLEM: Check Calcd Resid. Dens.  0.69 Ang From Dy2           -2.94 eA-3  
      
RESPONSE:  The negative residual density occurs within the range of 
1.0 Ang to the Dy2 atoms, and is probably related to the limitations
of absorption correction caused by the thin size of the 
needle like crystal.
;

# end Validation Reply Form






####################################################################### 
# 
# 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_cu_230210c_0m
_database_code_depnum_ccdc_archive 'CCDC 2377167'
loop_
_audit_author_name
_audit_author_address
'Theocharis Stamatatos'
;University of Patras
Greece
;
_audit_update_record             
;
2024-08-13 deposited with the CCDC.	2024-10-08 downloaded from the CCDC.
;
_audit_creation_date             2023-02-10
_audit_creation_method           
;
Olex2 1.3
(compiled 2020.11.12 svn.r5f609507 for OlexSys, GUI svn.r6408)
;
_shelx_SHELXL_version_number     2018/3
_chemical_name_common            ?
_chemical_name_systematic        ?
_chemical_formula_moiety         'C53 H55 Dy N3 O5 Si2, F6 P'
_chemical_formula_sum            'C53 H55 Dy F6 N3 O5 P Si2'
_chemical_formula_weight         1177.65
_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 0.0181 0.0091 '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 -9.8046 9.8477 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0727 0.0534 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.2955 0.4335 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Si Si 0.2541 0.3302 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 1 21/c 1'
_space_group_name_Hall           '-P 2ybc'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'

_cell_length_a                   16.895(3)
_cell_length_b                   14.733(3)
_cell_length_c                   20.760(4)
_cell_angle_alpha                90
_cell_angle_beta                 97.425(7)
_cell_angle_gamma                90
_cell_volume                     5124.3(15)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    9529
_cell_measurement_temperature    173.0
_cell_measurement_theta_max      66.633
_cell_measurement_theta_min      4.295
_shelx_estimated_absorpt_T_max   0.838
_shelx_estimated_absorpt_T_min   0.711
_exptl_absorpt_coefficient_mu    9.160
_exptl_absorpt_correction_T_max  0.7528
_exptl_absorpt_correction_T_min  0.5143
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
SADABS-2016/2 (Bruker,2016/2) was used for absorption correction.
wR2(int) was 0.1021 before and 0.0523 after correction.
The Ratio of minimum to maximum transmission is 0.6832.
The λ/2 correction factor is Not present.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            'clear light colourless'
_exptl_crystal_colour_lustre     clear
_exptl_crystal_colour_modifier   light
_exptl_crystal_colour_primary    colourless
_exptl_crystal_density_diffrn    1.526
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       block
_exptl_crystal_F_000             2388
_exptl_crystal_size_max          0.04
_exptl_crystal_size_mid          0.035
_exptl_crystal_size_min          0.02
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0381
_diffrn_reflns_av_unetI/netI     0.0352
_diffrn_reflns_Laue_measured_fraction_full 0.983
_diffrn_reflns_Laue_measured_fraction_max 0.983
_diffrn_reflns_limit_h_max       20
_diffrn_reflns_limit_h_min       -19
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_l_max       24
_diffrn_reflns_limit_l_min       -24
_diffrn_reflns_number            32297
_diffrn_reflns_point_group_measured_fraction_full 0.983
_diffrn_reflns_point_group_measured_fraction_max 0.983
_diffrn_reflns_theta_full        66.628
_diffrn_reflns_theta_max         66.628
_diffrn_reflns_theta_min         2.637
_diffrn_ambient_temperature      173.0
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.983
_diffrn_measured_fraction_theta_max 0.983
_diffrn_measurement_device_type  'Bruker D8 VENTURE'
_diffrn_measurement_method       ?
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54178
_diffrn_source                   ?
_diffrn_source_current           1.1
_diffrn_source_power             0.055
_diffrn_source_voltage           50.0
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                7878
_reflns_number_total             8909
_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       'SAINT V8.40B (?, 2016)'
_computing_data_collection       ?
_computing_data_reduction        'SAINT V8.40B (?, 2016)'
_computing_molecular_graphics    'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL 2018/3 (Sheldrick, 2015)'
_computing_structure_solution    'SHELXT 2018/2 (Sheldrick, 2018)'
_refine_diff_density_max         0.458
_refine_diff_density_min         -1.320
_refine_diff_density_rms         0.085
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.088
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     642
_refine_ls_number_reflns         8909
_refine_ls_number_restraints     38
_refine_ls_R_factor_all          0.0359
_refine_ls_R_factor_gt           0.0306
_refine_ls_restrained_S_all      1.161
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0535P)²+0.7332P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0836
_refine_ls_wR_factor_ref         0.0868
_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. Restrained distances
 C10-C15
 1.23 with sigma of 0.02
 C42-C16
 1.23 with sigma of 0.02
3. Uiso/Uaniso restraints and constraints
P1 \\sim F1 \\sim F2 \\sim F3 \\sim F4 \\sim F5 \\sim F6: within 2A with sigma
of 0.004 and sigma for terminal atoms of 0.008 within 2A
4.a Secondary CH2 refined with riding coordinates:
 C2(H2A,H2B), C23(H23A,H23B), C29(H29A,H29B), C38(H38A,H38B), C41(H41A,H41B),
 C44(H44A,H44B), C46(H46A,H46B), C50(H50A,H50B)
4.b Aromatic/amide H refined with riding coordinates:
 C3(H3), C5(H5), C7(H7), C8(H8), C9(H9), C11(H11), C13(H13), C14(H14),
 C17(H17), C19(H19), C20(H20), C21(H21), C22(H22), C24(H24), C25(H25), C26(H26),
  C27(H27), C28(H28), C30(H30), C31(H31), C33(H33), C35(H35), C37(H37),
 C39(H39), C40(H40), C43(H43), C45(H45), C47(H47), C48(H48), C49(H49), C51(H51),
  C52(H52), C53(H53)
4.c Idealised Me refined as rotating group:
 C15(H15A,H15B,H15C), C42(H42A,H42B,H42C)
;
_atom_sites_solution_hydrogens   geom
_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 0.25740(2) 0.65895(2) 0.51297(2) 0.01549(7) Uani 1 1 d . . . . .
Si1 Si 0.41952(4) 0.73029(5) 0.41891(3) 0.01740(16) Uani 1 1 d . . . . .
Si2 Si 0.09197(5) 0.68187(5) 0.60903(4) 0.01947(17) Uani 1 1 d . . . . .
O1 O 0.35215(12) 0.68589(13) 0.45595(9) 0.0209(4) Uani 1 1 d . . . . .
O2 O 0.32614(13) 0.50651(14) 0.54340(9) 0.0269(5) Uani 1 1 d . . . . .
O3 O 0.23105(12) 0.51893(13) 0.43902(9) 0.0234(4) Uani 1 1 d . . . . .
O4 O 0.16211(12) 0.64217(13) 0.57224(10) 0.0219(4) Uani 1 1 d . . . . .
O5 O 0.34860(12) 0.64053(14) 0.62356(9) 0.0250(5) Uani 1 1 d . . . . .
N1 N 0.20548(14) 0.81493(16) 0.46851(11) 0.0187(5) Uani 1 1 d . . . . .
N2 N 0.30981(14) 0.80533(17) 0.57532(11) 0.0208(5) Uani 1 1 d . . . . .
N3 N 0.13724(15) 0.66241(15) 0.42405(12) 0.0202(5) Uani 1 1 d . . . . .
C1 C 0.24494(16) 0.8920(2) 0.48835(13) 0.0206(6) Uani 1 1 d . . . . .
C2 C 0.35239(18) 0.4594(2) 0.48924(14) 0.0265(7) Uani 1 1 d . . . . .
H2A H 0.380762 0.402887 0.504018 0.032 Uiso 1 1 calc R U . . .
H2B H 0.388998 0.498171 0.467673 0.032 Uiso 1 1 calc R U . . .
C3 C 0.4045(2) 1.0121(2) 0.38771(19) 0.0403(9) Uani 1 1 d . . . . .
H3 H 0.431496 1.064955 0.405098 0.048 Uiso 1 1 calc R U . . .
C4 C 0.14475(17) 0.82154(19) 0.42009(14) 0.0198(6) Uani 1 1 d . . . . .
C5 C 0.22593(19) 0.9759(2) 0.45935(15) 0.0290(7) Uani 1 1 d . . . . .
H5 H 0.254872 1.028883 0.474081 0.035 Uiso 1 1 calc R U . . .
C6 C 0.12738(17) 0.7877(2) 0.65476(14) 0.0242(6) Uani 1 1 d . . . . .
C7 C 0.51687(19) 0.7210(2) 0.54168(15) 0.0280(7) Uani 1 1 d . . . . .
H7 H 0.470228 0.696801 0.556315 0.034 Uiso 1 1 calc R U . . .
C8 C 0.15728(18) 0.7832(2) 0.72079(15) 0.0272(7) Uani 1 1 d . . . . .
H8 H 0.150495 0.728789 0.744013 0.033 Uiso 1 1 calc R U . . .
C9 C 0.5849(2) 0.7329(2) 0.58615(16) 0.0370(9) Uani 1 1 d . . . . .
H9 H 0.584140 0.717538 0.630507 0.044 Uiso 1 1 calc R U . . .
C10 C 0.30594(17) 0.8837(2) 0.54686(14) 0.0217(6) Uani 1 1 d D . . . .
C11 C 0.3413(2) 1.0199(2) 0.33890(19) 0.0441(10) Uani 1 1 d . . . . .
H11 H 0.324534 1.078010 0.322615 0.053 Uiso 1 1 calc R U . . .
C12 C 0.39121(18) 0.84731(18) 0.38682(14) 0.0214(6) Uani 1 1 d . . . . .
C13 C -0.1403(2) 0.7240(3) 0.46181(18) 0.0525(11) Uani 1 1 d . . . . .
H13 H -0.186997 0.730557 0.431308 0.063 Uiso 1 1 calc R U . . .
C14 C -0.00522(18) 0.6144(2) 0.70113(14) 0.0247(6) Uani 1 1 d . . . . .
H14 H -0.034439 0.668941 0.691930 0.030 Uiso 1 1 calc R U . . .
C15 C 0.3538(2) 0.9650(2) 0.57048(17) 0.0352(8) Uani 1 1 d D . . . .
H15A H 0.324390 1.000433 0.599543 0.053 Uiso 1 1 calc R U . . .
H15B H 0.363468 1.002606 0.533330 0.053 Uiso 1 1 calc R U . . .
H15C H 0.404956 0.945485 0.594066 0.053 Uiso 1 1 calc R U . . .
C16 C 0.10215(17) 0.73448(19) 0.40138(13) 0.0193(6) Uani 1 1 d D . . . .
C17 C 0.58557(18) 0.7783(2) 0.45706(16) 0.0285(7) Uani 1 1 d . . . . .
H17 H 0.586724 0.794273 0.412856 0.034 Uiso 1 1 calc R U . . .
C18 C 0.43767(17) 0.65697(18) 0.34823(14) 0.0193(6) Uani 1 1 d . . . . .
C19 C 0.1644(2) 0.9807(2) 0.40892(17) 0.0358(8) Uani 1 1 d . . . . .
H19 H 0.151163 1.036907 0.387788 0.043 Uiso 1 1 calc R U . . .
C20 C 0.39731(18) 0.57450(19) 0.33645(14) 0.0242(6) Uani 1 1 d . . . . .
H20 H 0.357233 0.558617 0.362578 0.029 Uiso 1 1 calc R U . . .
C21 C 0.1736(2) 0.9439(2) 0.65598(18) 0.0372(8) Uani 1 1 d . . . . .
H21 H 0.177824 0.999841 0.633970 0.045 Uiso 1 1 calc R U . . .
C22 C -0.03617(19) 0.6321(2) 0.51583(15) 0.0316(7) Uani 1 1 d . . . . .
H22 H -0.011849 0.574066 0.522089 0.038 Uiso 1 1 calc R U . . .
C23 C 0.3758(2) 0.4886(2) 0.60317(15) 0.0385(9) Uani 1 1 d . . . . .
H23A H 0.432539 0.500748 0.598817 0.046 Uiso 1 1 calc R U . . .
H23B H 0.370432 0.424694 0.616585 0.046 Uiso 1 1 calc R U . . .
C24 C 0.49424(19) 0.6785(2) 0.30660(15) 0.0260(7) Uani 1 1 d . . . . .
H24 H 0.521615 0.734906 0.311755 0.031 Uiso 1 1 calc R U . . .
C25 C -0.0402(2) 0.7888(3) 0.54058(19) 0.0443(9) Uani 1 1 d . . . . .
H25 H -0.019287 0.840557 0.564229 0.053 Uiso 1 1 calc R U . . .
C26 C 0.1224(2) 0.9031(2) 0.38944(16) 0.0318(7) Uani 1 1 d . . . . .
H26 H 0.078790 0.905409 0.355624 0.038 Uiso 1 1 calc R U . . .
C27 C 0.51116(19) 0.6191(2) 0.25788(14) 0.0292(7) Uani 1 1 d . . . . .
H27 H 0.550120 0.634786 0.230653 0.035 Uiso 1 1 calc R U . . .
C28 C 0.13621(19) 0.8709(2) 0.62290(16) 0.0305(7) Uani 1 1 d . . . . .
H28 H 0.116277 0.876986 0.578180 0.037 Uiso 1 1 calc R U . . .
C29 C 0.16094(18) 0.5074(2) 0.39296(14) 0.0249(7) Uani 1 1 d . . . . .
H29A H 0.140677 0.444513 0.394609 0.030 Uiso 1 1 calc R U . . .
H29B H 0.173145 0.519729 0.348414 0.030 Uiso 1 1 calc R U . . .
C30 C 0.1966(2) 0.8561(2) 0.75343(18) 0.0365(8) Uani 1 1 d . . . . .
H30 H 0.217821 0.850650 0.797935 0.044 Uiso 1 1 calc R U . . .
C31 C 0.42907(19) 0.9268(2) 0.41161(16) 0.0298(7) Uani 1 1 d . . . . .
H31 H 0.472449 0.922577 0.445488 0.036 Uiso 1 1 calc R U . . .
C32 C -0.00157(17) 0.7056(2) 0.55139(14) 0.0242(6) Uani 1 1 d . . . . .
C33 C 0.41364(19) 0.5151(2) 0.28806(15) 0.0313(7) Uani 1 1 d . . . . .
H33 H 0.385351 0.459418 0.281699 0.038 Uiso 1 1 calc R U . . .
C34 C 0.51486(17) 0.74359(18) 0.47595(14) 0.0206(6) Uani 1 1 d . . . . .
C35 C 0.0117(2) 0.4736(2) 0.75896(14) 0.0317(8) Uani 1 1 d . . . . .
H35 H -0.005664 0.431231 0.788676 0.038 Uiso 1 1 calc R U . . .
C36 C 0.06150(17) 0.5977(2) 0.66985(13) 0.0219(6) Uani 1 1 d . . . . .
C37 C 0.47095(19) 0.5371(2) 0.24932(14) 0.0320(8) Uani 1 1 d . . . . .
H37 H 0.482997 0.496103 0.216654 0.038 Uiso 1 1 calc R U . . .
C38 C 0.10024(18) 0.5733(2) 0.41101(15) 0.0268(7) Uani 1 1 d . . . . .
H38A H 0.055804 0.578216 0.375096 0.032 Uiso 1 1 calc R U . . .
H38B H 0.078186 0.551385 0.450109 0.032 Uiso 1 1 calc R U . . .
C39 C 0.3270(2) 0.8580(2) 0.33754(15) 0.0309(7) Uani 1 1 d . . . . .
H39 H 0.299524 0.805654 0.319763 0.037 Uiso 1 1 calc R U . . .
C40 C 0.2046(2) 0.9364(2) 0.72048(19) 0.0400(9) Uani 1 1 d . . . . .
H40 H 0.231577 0.986456 0.742290 0.048 Uiso 1 1 calc R U . . .
C41 C 0.3467(2) 0.5520(2) 0.65152(14) 0.0331(8) Uani 1 1 d . . . . .
H41A H 0.291736 0.535965 0.659001 0.040 Uiso 1 1 calc R U . . .
H41B H 0.381912 0.549274 0.693484 0.040 Uiso 1 1 calc R U . . .
C42 C 0.02336(18) 0.7403(2) 0.35896(16) 0.0312(7) Uani 1 1 d D . . . .
H42A H 0.032442 0.748609 0.313654 0.047 Uiso 1 1 calc R U . . .
H42B H -0.007037 0.791975 0.372589 0.047 Uiso 1 1 calc R U . . .
H42C H -0.006783 0.684215 0.362932 0.047 Uiso 1 1 calc R U . . .
C43 C 0.3026(2) 0.9429(3) 0.31397(16) 0.0418(9) Uani 1 1 d . . . . .
H43 H 0.258852 0.948013 0.280440 0.050 Uiso 1 1 calc R U . . .
C44 C 0.27934(18) 0.43827(19) 0.44373(15) 0.0264(7) Uani 1 1 d . . . . .
H44A H 0.293635 0.421423 0.400533 0.032 Uiso 1 1 calc R U . . .
H44B H 0.250012 0.387074 0.460489 0.032 Uiso 1 1 calc R U . . .
C45 C 0.6539(2) 0.7900(2) 0.50101(19) 0.0373(8) Uani 1 1 d . . . . .
H45 H 0.701031 0.813591 0.486813 0.045 Uiso 1 1 calc R U . . .
C46 C 0.34288(19) 0.7113(2) 0.67006(13) 0.0283(7) Uani 1 1 d . . . . .
H46A H 0.381684 0.700911 0.709349 0.034 Uiso 1 1 calc R U . . .
H46B H 0.288537 0.713006 0.683037 0.034 Uiso 1 1 calc R U . . .
C47 C 0.0786(2) 0.4553(2) 0.72941(15) 0.0325(8) Uani 1 1 d . . . . .
H47 H 0.108066 0.401106 0.739621 0.039 Uiso 1 1 calc R U . . .
C48 C 0.10302(18) 0.5165(2) 0.68448(14) 0.0249(7) Uani 1 1 d . . . . .
H48 H 0.148400 0.502872 0.663579 0.030 Uiso 1 1 calc R U . . .
C49 C -0.1047(2) 0.6406(3) 0.47174(17) 0.0436(9) Uani 1 1 d . . . . .
H49 H -0.126832 0.589041 0.448533 0.052 Uiso 1 1 calc R U . . .
C50 C 0.36081(19) 0.7983(2) 0.63821(14) 0.0284(7) Uani 1 1 d . . . . .
H50A H 0.350454 0.850115 0.666294 0.034 Uiso 1 1 calc R U . . .
H50B H 0.417726 0.799890 0.631429 0.034 Uiso 1 1 calc R U . . .
C51 C -0.1085(2) 0.7977(3) 0.4960(2) 0.0567(11) Uani 1 1 d . . . . .
H51 H -0.133342 0.855430 0.489127 0.068 Uiso 1 1 calc R U . . .
C52 C -0.03021(19) 0.5535(2) 0.74536(14) 0.0293(7) Uani 1 1 d . . . . .
H52 H -0.075783 0.566546 0.766157 0.035 Uiso 1 1 calc R U . . .
C53 C 0.6533(2) 0.7670(2) 0.56583(19) 0.0415(9) Uani 1 1 d . . . . .
H53 H 0.700040 0.774846 0.596064 0.050 Uiso 1 1 calc R U . . .
P1 P -0.25334(6) 0.77368(7) 0.27221(5) 0.0458(3) Uani 1 1 d . U . . .
F1 F -0.24579(17) 0.85577(14) 0.22349(13) 0.0610(7) Uani 1 1 d . U . . .
F2 F -0.16156(16) 0.7804(2) 0.29859(15) 0.0893(9) Uani 1 1 d . U . A 1
F3 F -0.34481(16) 0.7654(2) 0.24405(15) 0.0969(11) Uani 1 1 d . U . B 1
F4 F -0.2722(2) 0.8425(2) 0.32597(16) 0.0942(10) Uani 1 1 d . U . C 1
F5 F -0.2325(2) 0.70534(18) 0.21684(14) 0.0893(9) Uani 1 1 d . U . D 1
F6 F -0.2618(2) 0.6920(2) 0.31981(15) 0.1061(12) Uani 1 1 d . U . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Dy1 O1 2.147(2) . ?
Dy1 O2 2.569(2) . ?
Dy1 O3 2.5757(19) . ?
Dy1 O4 2.163(2) . ?
Dy1 O5 2.608(2) . ?
Dy1 N1 2.587(2) . ?
Dy1 N2 2.610(2) . ?
Dy1 N3 2.562(2) . ?
Si1 O1 1.594(2) . ?
Si1 C12 1.888(3) . ?
Si1 C18 1.879(3) . ?
Si1 C34 1.882(3) . ?
Si2 O4 1.601(2) . ?
Si2 C6 1.883(3) . ?
Si2 C32 1.887(3) . ?
Si2 C36 1.888(3) . ?
O2 C2 1.439(3) . ?
O2 C23 1.430(4) . ?
O3 C29 1.433(3) . ?
O3 C44 1.438(3) . ?
O5 C41 1.430(4) . ?
O5 C46 1.433(3) . ?
N1 C1 1.354(4) . ?
N1 C4 1.344(4) . ?
N2 C10 1.295(4) . ?
N2 C50 1.472(4) . ?
N3 C16 1.276(4) . ?
N3 C38 1.465(3) . ?
C1 C5 1.394(4) . ?
C1 C10 1.493(4) . ?
C2 H2A 0.9900 . ?
C2 H2B 0.9900 . ?
C2 C44 1.487(4) . ?
C3 H3 0.9500 . ?
C3 C11 1.380(5) . ?
C3 C31 1.393(4) . ?
C4 C16 1.497(4) . ?
C4 C26 1.389(4) . ?
C5 H5 0.9500 . ?
C5 C19 1.378(5) . ?
C6 C8 1.400(4) . ?
C6 C28 1.410(4) . ?
C7 H7 0.9500 . ?
C7 C9 1.389(4) . ?
C7 C34 1.401(4) . ?
C8 H8 0.9500 . ?
C8 C30 1.392(4) . ?
C9 H9 0.9500 . ?
C9 C53 1.376(5) . ?
C10 C15 1.493(4) . ?
C11 H11 0.9500 . ?
C11 C43 1.376(6) . ?
C12 C31 1.401(4) . ?
C12 C39 1.400(4) . ?
C13 H13 0.9500 . ?
C13 C49 1.373(6) . ?
C13 C51 1.368(6) . ?
C14 H14 0.9500 . ?
C14 C36 1.393(4) . ?
C14 C52 1.388(4) . ?
C15 H15A 0.9800 . ?
C15 H15B 0.9800 . ?
C15 H15C 0.9800 . ?
C16 C42 1.501(4) . ?
C17 H17 0.9500 . ?
C17 C34 1.401(4) . ?
C17 C45 1.387(4) . ?
C18 C20 1.399(4) . ?
C18 C24 1.405(4) . ?
C19 H19 0.9500 . ?
C19 C26 1.379(5) . ?
C20 H20 0.9500 . ?
C20 C33 1.387(4) . ?
C21 H21 0.9500 . ?
C21 C28 1.383(5) . ?
C21 C40 1.378(5) . ?
C22 H22 0.9500 . ?
C22 C32 1.395(4) . ?
C22 C49 1.386(5) . ?
C23 H23A 0.9900 . ?
C23 H23B 0.9900 . ?
C23 C41 1.500(4) . ?
C24 H24 0.9500 . ?
C24 C27 1.395(4) . ?
C25 H25 0.9500 . ?
C25 C32 1.393(5) . ?
C25 C51 1.391(5) . ?
C26 H26 0.9500 . ?
C27 H27 0.9500 . ?
C27 C37 1.386(5) . ?
C28 H28 0.9500 . ?
C29 H29A 0.9900 . ?
C29 H29B 0.9900 . ?
C29 C38 1.494(4) . ?
C30 H30 0.9500 . ?
C30 C40 1.382(5) . ?
C31 H31 0.9500 . ?
C33 H33 0.9500 . ?
C33 C37 1.375(5) . ?
C35 H35 0.9500 . ?
C35 C47 1.381(5) . ?
C35 C52 1.383(5) . ?
C36 C48 1.400(4) . ?
C37 H37 0.9500 . ?
C38 H38A 0.9900 . ?
C38 H38B 0.9900 . ?
C39 H39 0.9500 . ?
C39 C43 1.387(5) . ?
C40 H40 0.9500 . ?
C41 H41A 0.9900 . ?
C41 H41B 0.9900 . ?
C42 H42A 0.9800 . ?
C42 H42B 0.9800 . ?
C42 H42C 0.9800 . ?
C43 H43 0.9500 . ?
C44 H44A 0.9900 . ?
C44 H44B 0.9900 . ?
C45 H45 0.9500 . ?
C45 C53 1.389(5) . ?
C46 H46A 0.9900 . ?
C46 H46B 0.9900 . ?
C46 C50 1.491(4) . ?
C47 H47 0.9500 . ?
C47 C48 1.398(4) . ?
C48 H48 0.9500 . ?
C49 H49 0.9500 . ?
C50 H50A 0.9900 . ?
C50 H50B 0.9900 . ?
C51 H51 0.9500 . ?
C52 H52 0.9500 . ?
C53 H53 0.9500 . ?
P1 F1 1.592(2) . ?
P1 F2 1.579(3) . ?
P1 F3 1.585(3) . ?
P1 F4 1.570(3) . ?
P1 F5 1.601(3) . ?
P1 F6 1.575(3) . ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
O1 Dy1 O2 87.23(7) . . ?
O1 Dy1 O3 84.45(7) . . ?
O1 Dy1 O4 175.83(7) . . ?
O1 Dy1 O5 96.13(7) . . ?
O1 Dy1 N1 83.20(7) . . ?
O1 Dy1 N2 83.76(7) . . ?
O1 Dy1 N3 100.19(8) . . ?
O2 Dy1 O3 58.96(6) . . ?
O2 Dy1 O5 59.73(6) . . ?
O2 Dy1 N1 170.32(7) . . ?
O2 Dy1 N2 119.12(7) . . ?
O3 Dy1 O5 118.57(6) . . ?
O3 Dy1 N1 118.31(7) . . ?
O3 Dy1 N2 168.15(7) . . ?
O4 Dy1 O2 96.10(7) . . ?
O4 Dy1 O3 99.41(7) . . ?
O4 Dy1 O5 83.45(7) . . ?
O4 Dy1 N1 93.52(7) . . ?
O4 Dy1 N2 92.41(7) . . ?
O4 Dy1 N3 80.41(8) . . ?
O5 Dy1 N2 61.68(7) . . ?
N1 Dy1 O5 122.74(7) . . ?
N1 Dy1 N2 61.36(8) . . ?
N3 Dy1 O2 119.04(7) . . ?
N3 Dy1 O3 61.74(7) . . ?
N3 Dy1 O5 163.58(8) . . ?
N3 Dy1 N1 61.62(7) . . ?
N3 Dy1 N2 121.82(7) . . ?
O1 Si1 C12 112.39(12) . . ?
O1 Si1 C18 109.86(12) . . ?
O1 Si1 C34 110.21(12) . . ?
C18 Si1 C12 108.00(12) . . ?
C18 Si1 C34 109.78(13) . . ?
C34 Si1 C12 106.51(13) . . ?
O4 Si2 C6 109.67(12) . . ?
O4 Si2 C32 112.08(12) . . ?
O4 Si2 C36 111.21(12) . . ?
C6 Si2 C32 110.61(14) . . ?
C6 Si2 C36 107.63(13) . . ?
C32 Si2 C36 105.49(13) . . ?
Si1 O1 Dy1 166.28(12) . . ?
C2 O2 Dy1 113.85(16) . . ?
C23 O2 Dy1 124.77(18) . . ?
C23 O2 C2 112.6(2) . . ?
C29 O3 Dy1 123.84(16) . . ?
C29 O3 C44 111.1(2) . . ?
C44 O3 Dy1 124.66(16) . . ?
Si2 O4 Dy1 151.73(12) . . ?
C41 O5 Dy1 114.25(17) . . ?
C41 O5 C46 112.5(2) . . ?
C46 O5 Dy1 115.71(16) . . ?
C1 N1 Dy1 120.39(18) . . ?
C4 N1 Dy1 121.47(18) . . ?
C4 N1 C1 117.7(2) . . ?
C10 N2 Dy1 121.09(18) . . ?
C10 N2 C50 117.2(2) . . ?
C50 N2 Dy1 120.24(19) . . ?
C16 N3 Dy1 124.71(18) . . ?
C16 N3 C38 120.7(2) . . ?
C38 N3 Dy1 113.26(17) . . ?
N1 C1 C5 122.4(3) . . ?
N1 C1 C10 116.0(2) . . ?
C5 C1 C10 121.4(3) . . ?
O2 C2 H2A 110.4 . . ?
O2 C2 H2B 110.4 . . ?
O2 C2 C44 106.5(2) . . ?
H2A C2 H2B 108.6 . . ?
C44 C2 H2A 110.4 . . ?
C44 C2 H2B 110.4 . . ?
C11 C3 H3 119.9 . . ?
C11 C3 C31 120.2(3) . . ?
C31 C3 H3 119.9 . . ?
N1 C4 C16 115.3(2) . . ?
N1 C4 C26 122.8(3) . . ?
C26 C4 C16 121.9(3) . . ?
C1 C5 H5 120.6 . . ?
C19 C5 C1 118.9(3) . . ?
C19 C5 H5 120.6 . . ?
C8 C6 Si2 120.4(2) . . ?
C8 C6 C28 117.0(3) . . ?
C28 C6 Si2 122.0(2) . . ?
C9 C7 H7 118.9 . . ?
C9 C7 C34 122.1(3) . . ?
C34 C7 H7 118.9 . . ?
C6 C8 H8 119.0 . . ?
C30 C8 C6 122.0(3) . . ?
C30 C8 H8 119.0 . . ?
C7 C9 H9 120.1 . . ?
C53 C9 C7 119.9(3) . . ?
C53 C9 H9 120.1 . . ?
N2 C10 C1 115.7(2) . . ?
N2 C10 C15 124.9(3) . . ?
C15 C10 C1 119.2(3) . . ?
C3 C11 H11 120.2 . . ?
C43 C11 C3 119.5(3) . . ?
C43 C11 H11 120.2 . . ?
C31 C12 Si1 123.5(2) . . ?
C39 C12 Si1 119.8(2) . . ?
C39 C12 C31 116.6(3) . . ?
C49 C13 H13 120.1 . . ?
C51 C13 H13 120.1 . . ?
C51 C13 C49 119.8(4) . . ?
C36 C14 H14 119.1 . . ?
C52 C14 H14 119.1 . . ?
C52 C14 C36 121.9(3) . . ?
C10 C15 H15A 109.5 . . ?
C10 C15 H15B 109.5 . . ?
C10 C15 H15C 109.5 . . ?
H15A C15 H15B 109.5 . . ?
H15A C15 H15C 109.5 . . ?
H15B C15 H15C 109.5 . . ?
N3 C16 C4 115.6(2) . . ?
N3 C16 C42 126.8(3) . . ?
C4 C16 C42 117.6(2) . . ?
C34 C17 H17 119.0 . . ?
C45 C17 H17 119.0 . . ?
C45 C17 C34 121.9(3) . . ?
C20 C18 Si1 120.7(2) . . ?
C20 C18 C24 116.3(3) . . ?
C24 C18 Si1 122.9(2) . . ?
C5 C19 H19 120.3 . . ?
C5 C19 C26 119.3(3) . . ?
C26 C19 H19 120.3 . . ?
C18 C20 H20 118.8 . . ?
C33 C20 C18 122.5(3) . . ?
C33 C20 H20 118.8 . . ?
C28 C21 H21 119.6 . . ?
C40 C21 H21 119.6 . . ?
C40 C21 C28 120.8(3) . . ?
C32 C22 H22 118.8 . . ?
C49 C22 H22 118.8 . . ?
C49 C22 C32 122.4(3) . . ?
O2 C23 H23A 110.7 . . ?
O2 C23 H23B 110.7 . . ?
O2 C23 C41 105.1(2) . . ?
H23A C23 H23B 108.8 . . ?
C41 C23 H23A 110.7 . . ?
C41 C23 H23B 110.7 . . ?
C18 C24 H24 119.2 . . ?
C27 C24 C18 121.6(3) . . ?
C27 C24 H24 119.2 . . ?
C32 C25 H25 119.3 . . ?
C51 C25 H25 119.3 . . ?
C51 C25 C32 121.5(4) . . ?
C4 C26 H26 120.5 . . ?
C19 C26 C4 118.9(3) . . ?
C19 C26 H26 120.5 . . ?
C24 C27 H27 120.1 . . ?
C37 C27 C24 119.8(3) . . ?
C37 C27 H27 120.1 . . ?
C6 C28 H28 119.6 . . ?
C21 C28 C6 120.8(3) . . ?
C21 C28 H28 119.6 . . ?
O3 C29 H29A 110.3 . . ?
O3 C29 H29B 110.3 . . ?
O3 C29 C38 106.9(2) . . ?
H29A C29 H29B 108.6 . . ?
C38 C29 H29A 110.3 . . ?
C38 C29 H29B 110.3 . . ?
C8 C30 H30 120.3 . . ?
C40 C30 C8 119.4(3) . . ?
C40 C30 H30 120.3 . . ?
C3 C31 C12 121.5(3) . . ?
C3 C31 H31 119.3 . . ?
C12 C31 H31 119.3 . . ?
C22 C32 Si2 116.8(2) . . ?
C25 C32 Si2 126.9(2) . . ?
C25 C32 C22 116.3(3) . . ?
C20 C33 H33 120.1 . . ?
C37 C33 C20 119.7(3) . . ?
C37 C33 H33 120.1 . . ?
C7 C34 Si1 120.0(2) . . ?
C7 C34 C17 116.4(3) . . ?
C17 C34 Si1 123.6(2) . . ?
C47 C35 H35 119.9 . . ?
C47 C35 C52 120.1(3) . . ?
C52 C35 H35 119.9 . . ?
C14 C36 Si2 120.2(2) . . ?
C14 C36 C48 117.5(3) . . ?
C48 C36 Si2 122.3(2) . . ?
C27 C37 H37 120.0 . . ?
C33 C37 C27 120.1(3) . . ?
C33 C37 H37 120.0 . . ?
N3 C38 C29 109.8(2) . . ?
N3 C38 H38A 109.7 . . ?
N3 C38 H38B 109.7 . . ?
C29 C38 H38A 109.7 . . ?
C29 C38 H38B 109.7 . . ?
H38A C38 H38B 108.2 . . ?
C12 C39 H39 119.1 . . ?
C43 C39 C12 121.8(3) . . ?
C43 C39 H39 119.1 . . ?
C21 C40 C30 120.0(3) . . ?
C21 C40 H40 120.0 . . ?
C30 C40 H40 120.0 . . ?
O5 C41 C23 105.6(3) . . ?
O5 C41 H41A 110.6 . . ?
O5 C41 H41B 110.6 . . ?
C23 C41 H41A 110.6 . . ?
C23 C41 H41B 110.6 . . ?
H41A C41 H41B 108.7 . . ?
C16 C42 H42A 109.5 . . ?
C16 C42 H42B 109.5 . . ?
C16 C42 H42C 109.5 . . ?
H42A C42 H42B 109.5 . . ?
H42A C42 H42C 109.5 . . ?
H42B C42 H42C 109.5 . . ?
C11 C43 C39 120.3(3) . . ?
C11 C43 H43 119.8 . . ?
C39 C43 H43 119.8 . . ?
O3 C44 C2 106.7(2) . . ?
O3 C44 H44A 110.4 . . ?
O3 C44 H44B 110.4 . . ?
C2 C44 H44A 110.4 . . ?
C2 C44 H44B 110.4 . . ?
H44A C44 H44B 108.6 . . ?
C17 C45 H45 120.1 . . ?
C17 C45 C53 119.8(3) . . ?
C53 C45 H45 120.1 . . ?
O5 C46 H46A 110.3 . . ?
O5 C46 H46B 110.3 . . ?
O5 C46 C50 106.9(2) . . ?
H46A C46 H46B 108.6 . . ?
C50 C46 H46A 110.3 . . ?
C50 C46 H46B 110.3 . . ?
C35 C47 H47 120.0 . . ?
C35 C47 C48 120.0(3) . . ?
C48 C47 H47 120.0 . . ?
C36 C48 H48 119.5 . . ?
C47 C48 C36 120.9(3) . . ?
C47 C48 H48 119.5 . . ?
C13 C49 C22 119.6(4) . . ?
C13 C49 H49 120.2 . . ?
C22 C49 H49 120.2 . . ?
N2 C50 C46 109.0(2) . . ?
N2 C50 H50A 109.9 . . ?
N2 C50 H50B 109.9 . . ?
C46 C50 H50A 109.9 . . ?
C46 C50 H50B 109.9 . . ?
H50A C50 H50B 108.3 . . ?
C13 C51 C25 120.4(4) . . ?
C13 C51 H51 119.8 . . ?
C25 C51 H51 119.8 . . ?
C14 C52 H52 120.2 . . ?
C35 C52 C14 119.6(3) . . ?
C35 C52 H52 120.2 . . ?
C9 C53 C45 119.8(3) . . ?
C9 C53 H53 120.1 . . ?
C45 C53 H53 120.1 . . ?
F1 P1 F5 88.76(16) . . ?
F2 P1 F1 90.99(16) . . ?
F2 P1 F3 178.4(2) . . ?
F2 P1 F5 89.46(18) . . ?
F3 P1 F1 88.76(15) . . ?
F3 P1 F5 88.94(19) . . ?
F4 P1 F1 90.09(16) . . ?
F4 P1 F2 89.64(19) . . ?
F4 P1 F3 92.0(2) . . ?
F4 P1 F5 178.53(19) . . ?
F4 P1 F6 90.2(2) . . ?
F6 P1 F1 179.26(16) . . ?
F6 P1 F2 89.68(17) . . ?
F6 P1 F3 90.56(17) . . ?
F6 P1 F5 90.93(19) . . ?

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 O2 C2 C44 -62.9(3) . . . . ?
Dy1 O2 C23 C41 27.3(4) . . . . ?
Dy1 O3 C29 C38 -17.0(3) . . . . ?
Dy1 O3 C44 C2 -10.4(3) . . . . ?
Dy1 O5 C41 C23 60.9(3) . . . . ?
Dy1 O5 C46 C50 -56.5(3) . . . . ?
Dy1 N1 C1 C5 170.9(2) . . . . ?
Dy1 N1 C1 C10 -13.9(3) . . . . ?
Dy1 N1 C4 C16 9.0(3) . . . . ?
Dy1 N1 C4 C26 -171.3(2) . . . . ?
Dy1 N2 C10 C1 22.4(3) . . . . ?
Dy1 N2 C10 C15 -161.3(2) . . . . ?
Dy1 N2 C50 C46 -26.8(3) . . . . ?
Dy1 N3 C16 C4 11.8(4) . . . . ?
Dy1 N3 C16 C42 -167.7(2) . . . . ?
Dy1 N3 C38 C29 -56.9(3) . . . . ?
Si1 C12 C31 C3 -178.0(2) . . . . ?
Si1 C12 C39 C43 177.9(3) . . . . ?
Si1 C18 C20 C33 -174.7(2) . . . . ?
Si1 C18 C24 C27 174.5(2) . . . . ?
Si2 C6 C8 C30 168.6(2) . . . . ?
Si2 C6 C28 C21 -170.1(2) . . . . ?
Si2 C36 C48 C47 -179.5(2) . . . . ?
O1 Si1 C12 C31 111.0(3) . . . . ?
O1 Si1 C12 C39 -66.1(3) . . . . ?
O1 Si1 C18 C20 -2.9(3) . . . . ?
O1 Si1 C18 C24 -179.7(2) . . . . ?
O1 Si1 C34 C7 -4.0(3) . . . . ?
O1 Si1 C34 C17 178.1(2) . . . . ?
O2 C2 C44 O3 44.4(3) . . . . ?
O2 C23 C41 O5 -53.8(3) . . . . ?
O3 C29 C38 N3 46.1(3) . . . . ?
O4 Si2 C6 C8 -95.9(3) . . . . ?
O4 Si2 C6 C28 74.5(3) . . . . ?
O4 Si2 C32 C22 59.5(3) . . . . ?
O4 Si2 C32 C25 -120.7(3) . . . . ?
O4 Si2 C36 C14 -171.9(2) . . . . ?
O4 Si2 C36 C48 6.8(3) . . . . ?
O5 C46 C50 N2 51.9(3) . . . . ?
N1 C1 C5 C19 0.4(5) . . . . ?
N1 C1 C10 N2 -5.4(4) . . . . ?
N1 C1 C10 C15 178.1(3) . . . . ?
N1 C4 C16 N3 -13.1(4) . . . . ?
N1 C4 C16 C42 166.4(3) . . . . ?
N1 C4 C26 C19 0.6(5) . . . . ?
C1 N1 C4 C16 -178.6(2) . . . . ?
C1 N1 C4 C26 1.2(4) . . . . ?
C1 C5 C19 C26 1.4(5) . . . . ?
C2 O2 C23 C41 172.6(3) . . . . ?
C3 C11 C43 C39 -0.2(5) . . . . ?
C4 N1 C1 C5 -1.7(4) . . . . ?
C4 N1 C1 C10 173.5(2) . . . . ?
C5 C1 C10 N2 169.8(3) . . . . ?
C5 C1 C10 C15 -6.7(4) . . . . ?
C5 C19 C26 C4 -1.8(5) . . . . ?
C6 Si2 O4 Dy1 -45.0(3) . . . . ?
C6 Si2 C32 C22 -177.8(2) . . . . ?
C6 Si2 C32 C25 2.0(3) . . . . ?
C6 Si2 C36 C14 67.9(2) . . . . ?
C6 Si2 C36 C48 -113.3(2) . . . . ?
C6 C8 C30 C40 1.9(5) . . . . ?
C7 C9 C53 C45 0.4(5) . . . . ?
C8 C6 C28 C21 0.6(5) . . . . ?
C8 C30 C40 C21 0.2(5) . . . . ?
C9 C7 C34 Si1 -177.5(2) . . . . ?
C9 C7 C34 C17 0.5(4) . . . . ?
C10 N2 C50 C46 166.9(3) . . . . ?
C10 C1 C5 C19 -174.5(3) . . . . ?
C11 C3 C31 C12 0.5(5) . . . . ?
C12 Si1 O1 Dy1 -35.1(5) . . . . ?
C12 Si1 C18 C20 -125.8(2) . . . . ?
C12 Si1 C18 C24 57.4(3) . . . . ?
C12 Si1 C34 C7 118.2(2) . . . . ?
C12 Si1 C34 C17 -59.7(3) . . . . ?
C12 C39 C43 C11 -0.1(5) . . . . ?
C14 C36 C48 C47 -0.7(4) . . . . ?
C16 N3 C38 C29 135.4(3) . . . . ?
C16 C4 C26 C19 -179.7(3) . . . . ?
C17 C45 C53 C9 -0.1(5) . . . . ?
C18 Si1 O1 Dy1 -155.3(5) . . . . ?
C18 Si1 C12 C31 -127.7(3) . . . . ?
C18 Si1 C12 C39 55.2(3) . . . . ?
C18 Si1 C34 C7 -125.2(2) . . . . ?
C18 Si1 C34 C17 57.0(3) . . . . ?
C18 C20 C33 C37 -0.6(5) . . . . ?
C18 C24 C27 C37 0.8(5) . . . . ?
C20 C18 C24 C27 -2.4(4) . . . . ?
C20 C33 C37 C27 -1.2(5) . . . . ?
C23 O2 C2 C44 147.9(3) . . . . ?
C24 C18 C20 C33 2.3(4) . . . . ?
C24 C27 C37 C33 1.0(5) . . . . ?
C26 C4 C16 N3 167.2(3) . . . . ?
C26 C4 C16 C42 -13.3(4) . . . . ?
C28 C6 C8 C30 -2.3(5) . . . . ?
C28 C21 C40 C30 -1.9(5) . . . . ?
C29 O3 C44 C2 176.5(2) . . . . ?
C31 C3 C11 C43 0.0(5) . . . . ?
C31 C12 C39 C43 0.6(5) . . . . ?
C32 Si2 O4 Dy1 78.3(3) . . . . ?
C32 Si2 C6 C8 140.0(2) . . . . ?
C32 Si2 C6 C28 -49.7(3) . . . . ?
C32 Si2 C36 C14 -50.2(3) . . . . ?
C32 Si2 C36 C48 128.6(2) . . . . ?
C32 C22 C49 C13 0.4(5) . . . . ?
C32 C25 C51 C13 0.8(6) . . . . ?
C34 Si1 O1 Dy1 83.6(5) . . . . ?
C34 Si1 C12 C31 -9.8(3) . . . . ?
C34 Si1 C12 C39 173.1(2) . . . . ?
C34 Si1 C18 C20 118.5(2) . . . . ?
C34 Si1 C18 C24 -58.3(3) . . . . ?
C34 C7 C9 C53 -0.7(5) . . . . ?
C34 C17 C45 C53 0.0(5) . . . . ?
C35 C47 C48 C36 1.5(4) . . . . ?
C36 Si2 O4 Dy1 -163.9(2) . . . . ?
C36 Si2 C6 C8 25.2(3) . . . . ?
C36 Si2 C6 C28 -164.4(2) . . . . ?
C36 Si2 C32 C22 -61.7(3) . . . . ?
C36 Si2 C32 C25 118.1(3) . . . . ?
C36 C14 C52 C35 -0.3(4) . . . . ?
C38 N3 C16 C4 177.9(2) . . . . ?
C38 N3 C16 C42 -1.6(5) . . . . ?
C39 C12 C31 C3 -0.8(5) . . . . ?
C40 C21 C28 C6 1.5(5) . . . . ?
C41 O5 C46 C50 169.6(3) . . . . ?
C44 O3 C29 C38 156.2(2) . . . . ?
C45 C17 C34 Si1 177.8(2) . . . . ?
C45 C17 C34 C7 -0.2(4) . . . . ?
C46 O5 C41 C23 -164.6(3) . . . . ?
C47 C35 C52 C14 1.0(4) . . . . ?
C49 C13 C51 C25 0.2(6) . . . . ?
C49 C22 C32 Si2 -179.7(3) . . . . ?
C49 C22 C32 C25 0.5(5) . . . . ?
C50 N2 C10 C1 -171.4(2) . . . . ?
C50 N2 C10 C15 4.8(4) . . . . ?
C51 C13 C49 C22 -0.7(6) . . . . ?
C51 C25 C32 Si2 179.2(3) . . . . ?
C51 C25 C32 C22 -1.0(5) . . . . ?
C52 C14 C36 Si2 179.0(2) . . . . ?
C52 C14 C36 C48 0.1(4) . . . . ?
C52 C35 C47 C48 -1.6(4) . . . . ?

_olex2_submission_special_instructions 'No special instructions were received'
