# Electronic Supplementary Material (ESI) for Inorganic Chemistry Frontiers.
# This journal is © the Partner Organisations 2019

####################################################################### 
# 
# 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_ifdo547
_database_code_depnum_ccdc_archive 'CCDC 1957205'
loop_
_audit_author_name
_audit_author_address
'Juan Herrera'
;University of Granada
Spain
;
_audit_update_record             
;
2019-10-02 deposited with the CCDC.	2019-12-02 downloaded from the CCDC.
;
_audit_creation_date             2019-10-02
_audit_creation_method           
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_shelxl_version_number           2013-4
_chemical_name_common            ?
_chemical_name_systematic        
;
 ?
;
_chemical_formula_moiety         
'C36 H75.37 Dy O7 P2, 3(C F3 O3 S), 2(C18 H33 O P)'
_chemical_formula_sum            'C75 H141.37 Dy F9 O18 P4 S3'
_chemical_formula_weight         1884.80
_chemical_absolute_configuration ad
_chemical_melting_point          ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Dy Dy -0.1892 4.4098 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 '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'
S S 0.1246 0.1234 '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           4
_space_group_name_H-M_alt        'P 1 21 1'
_space_group_name_Hall           'P 2yb'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y+1/2, -z'

_cell_length_a                   15.6605(8)
_cell_length_b                   18.6140(8)
_cell_length_c                   15.9083(8)
_cell_angle_alpha                90
_cell_angle_beta                 104.6559(17)
_cell_angle_gamma                90
_cell_volume                     4486.5(4)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    9813
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      24.776
_cell_measurement_theta_min      2.378
_shelx_estimated_absorpt_T_max   0.884
_shelx_estimated_absorpt_T_min   0.858
_exptl_absorpt_coefficient_mu    1.054
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.6535
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
'SADABS-2014/5 (Bruker,2014/5) was used for absorption correction. wR2(int) was 0.1090 before and 0.0531 after correction. The Ratio of minimum to maximum transmission is 0.6535. The λ/2 correction factor is 0.00150.'
_exptl_crystal_colour            'clear whiteish colourless'
_exptl_crystal_colour_lustre     clear
_exptl_crystal_colour_modifier   whiteish
_exptl_crystal_colour_primary    colourless
_exptl_crystal_density_diffrn    1.395
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       block
_exptl_crystal_F_000             1981
_exptl_crystal_size_max          0.15
_exptl_crystal_size_mid          0.13
_exptl_crystal_size_min          0.12
_exptl_special_details           
;
 ?
;
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0355
_diffrn_reflns_av_unetI/netI     0.0227
_diffrn_reflns_Laue_measured_fraction_full 0.949
_diffrn_reflns_Laue_measured_fraction_max 0.996
_diffrn_reflns_limit_h_max       18
_diffrn_reflns_limit_h_min       -18
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_k_min       -21
_diffrn_reflns_limit_l_max       18
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            84733
_diffrn_reflns_point_group_measured_fraction_full 0.946
_diffrn_reflns_point_group_measured_fraction_max 0.994
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         24.810
_diffrn_reflns_theta_min         2.378
_diffrn_ambient_temperature      100.0
_diffrn_detector_area_resol_mean ?
_diffrn_measured_fraction_theta_full 0.949
_diffrn_measured_fraction_theta_max 0.996
_diffrn_measurement_device_type  'Bruker VENTURE'
_diffrn_measurement_method       ?
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   ?
_reflns_Friedel_coverage         0.931
_reflns_Friedel_fraction_full    0.944
_reflns_Friedel_fraction_max     0.992
_reflns_number_gt                15058
_reflns_number_total             15379
_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 v8.37A (Bruker, 2015)'
_computing_data_collection       ?
_computing_data_reduction        'SAINT v8.37A (Bruker, 2015)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2015)'
_computing_structure_solution    'ShelXS (Sheldrick, 2008)'
_refine_diff_density_max         0.386
_refine_diff_density_min         -0.693
_refine_diff_density_rms         0.050
_refine_ls_abs_structure_details 
;
 Flack x determined using 7149 quotients [(I+)-(I-)]/[(I+)+(I-)]
 (Parsons and Flack (2004), Acta Cryst. A60, s61).
;
_refine_ls_abs_structure_Flack   -0.032(3)
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.061
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1098
_refine_ls_number_reflns         15379
_refine_ls_number_restraints     125
_refine_ls_R_factor_all          0.0225
_refine_ls_R_factor_gt           0.0214
_refine_ls_restrained_S_all      1.075
_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)+(0.0294P)²+2.5037P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0525
_refine_ls_wR_factor_ref         0.0534
_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 O(H,H) groups
2. Restrained distances
 S3T-O9TA
 1.45 with sigma of 0.02
 S3T-O8T = S3T-O9T = S3T-O7T = S3T-O8TA
 1.45 with sigma of 0.02
 S3T-O7TA = S3T-O8TA = S3T-O7T = S3T-O8T = S3T-O9T
 1.45 with sigma of 0.02
 C8-C7 = C8A-C7 = C7-C12 = C7-C12A = C9-C8 = C9A-C8A = C10-C9 = C10A-C9A =
 C11A-C10A = C11-C10 = C11A-C12A = C11-C12
 1.54 with sigma of 0.02
 F8TA-C3T = F8T-C3T = F9TA-C3T = F9T-C3T = F7T-C3T = F7TA-C3T
 1.35 with sigma of 0.02
3. Uiso/Uaniso restraints and constraints
Uanis(C8A) \\sim Ueq, Uanis(C8) \\sim Ueq, Uanis(C9A) \\sim Ueq, Uanis(C9)
\\sim Ueq, Uanis(C10) \\sim Ueq, Uanis(C11A) \\sim Ueq, Uanis(C11) \\sim Ueq,
Uanis(C12A) \\sim Ueq, Uanis(C12) \\sim Ueq, Uanis(C10A) \\sim Ueq: with sigma
of 0.005 and sigma for terminal atoms of 1
Uanis(F7TA) \\sim Ueq, Uanis(F7T) \\sim Ueq, Uanis(F8TA) \\sim Ueq, Uanis(F8T)
\\sim Ueq, Uanis(F9TA) \\sim Ueq, Uanis(F9T) \\sim Ueq: with sigma of 0.1 and
sigma for terminal atoms of 0.2
4. Others
 Sof(O7TA)=Sof(O8TA)=Sof(O9TA)=1-FVAR(1)
 Sof(O7T)=Sof(O8T)=Sof(O9T)=FVAR(1)
 Sof(F7TA)=Sof(F8T)=Sof(F9T)=1-FVAR(2)
 Sof(F7T)=Sof(F8TA)=Sof(F9TA)=FVAR(2)
 Sof(H7)=Sof(C8)=Sof(H8A)=Sof(H8B)=Sof(C9A)=Sof(H9AA)=Sof(H9AB)=Sof(C10)=
 Sof(H10A)=Sof(H10B)=Sof(C11A)=Sof(H11C)=Sof(H11D)=Sof(C12A)=Sof(H12C)=
 Sof(H12D)=1-FVAR(3)
 Sof(C8A)=Sof(H8AA)=Sof(H8AB)=Sof(C9)=Sof(H9A)=Sof(H9B)=Sof(C10A)=Sof(H10C)=
 Sof(H10D)=Sof(C11)=Sof(H11A)=Sof(H11B)=Sof(C12)=Sof(H12A)=Sof(H12B)=FVAR(3)
5.a Rotating group:
 O1W(H1WA,H1WB), O2W(H2WA,H2WB), O3W(H3WA,H3WB), O4W(H4WA,H4WB), O5W(H5WA,H5WB)
5.b Ternary CH refined with riding coordinates:
 C1(H1), C7(H7), C13(H13), C19(H19), C25(H25), C31(H31), C37(H37), C43(H43),
 C49(H49), C2BA(H2BA), C4BA(H4BA), C4CA(H4CA)
5.c Secondary CH2 refined with riding coordinates:
 C2(H2A,H2B), C3(H3A,H3B), C4(H4A,H4B), C5(H5A,H5B), C6(H6A,H6B), C8(H8A,H8B),
 C8A(H8AA,H8AB), C9(H9A,H9B), C9A(H9AA,H9AB), C10(H10A,H10B), C10A(H10C,H10D),
 C11(H11A,H11B), C11A(H11C,H11D), C12(H12A,H12B), C12A(H12C,H12D), C14(H14A,
 H14B), C15(H15A,H15B), C16(H16A,H16B), C17(H17A,H17B), C18(H18A,H18B),
 C20(H20A,H20B), C21(H21A,H21B), C22(H22A,H22B), C23(H23A,H23B), C24(H24A,H24B),
  C26(H26A,H26B), C27(H27A,H27B), C28(H28A,H28B), C29(H29A,H29B), C30(H30A,
 H30B), C32(H32A,H32B), C33(H33A,H33B), C34(H34A,H34B), C35(H35A,H35B),
 C36(H36A,H36B), C38(H38A,H38B), C39(H39A,H39B), C40(H40A,H40B), C41(H41A,H41B),
  C42(H42A,H42B), C44(H44A,H44B), C45(H45A,H45B), C46(H46A,H46B), C47(H47A,
 H47B), C48(H48A,H48B), C50(H50A,H50B), C51(H51A,H51B), C52(H52A,H52B),
 C53(H53A,H53B), C54(H54A,H54B), C0CA(H0CA,H0CB), C1AA(H1AA,H1AB), C1CA(H1CA,
 H1CB), C2AA(H2AA,H2AB), C2CA(H2CA,H2CB), C3AA(H3AA,H3AB), C3BA(H3BA,H3BB),
 C3CA(H3CA,H3CB), C4AA(H4AA,H4AB), C7BA(H7BA,H7BB), C8AA(H8AC,H8AD), C8BA(H8BA,
 H8BB), C9AA(H9AC,H9AD), C56(H56A,H56B), C65(H65A,H65B)
;
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     direct
_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 0.21519(2) 0.25892(2) 0.22769(2) 0.00933(5) Uani 1 1 d . . . . .
S3T S 0.48668(8) 0.15960(7) 0.47926(11) 0.0472(4) Uani 1 1 d D . . . .
P1 P 0.15067(6) 0.07076(5) 0.16611(6) 0.01367(19) Uani 1 1 d . . . . .
P2 P 0.27838(6) 0.44731(5) 0.28448(6) 0.01282(19) Uani 1 1 d . . . . .
F7T F 0.6348(14) 0.2129(19) 0.552(2) 0.083(7) Uani 0.42(5) 1 d D U P A 2
F7TA F 0.6255(11) 0.2383(11) 0.5459(15) 0.068(4) Uani 0.58(5) 1 d D U P A 1
F8T F 0.559(2) 0.1609(7) 0.6349(6) 0.067(6) Uani 0.58(5) 1 d D U P A 2
F8TA F 0.608(2) 0.1734(8) 0.6375(8) 0.058(5) Uani 0.42(5) 1 d D U P A 1
F9T F 0.5079(18) 0.2619(12) 0.5836(16) 0.068(5) Uani 0.58(5) 1 d D U P A 2
F9TA F 0.533(2) 0.2686(14) 0.597(2) 0.067(7) Uani 0.42(5) 1 d D U P A 1
O1 O 0.18102(17) 0.14531(13) 0.19939(16) 0.0163(5) Uani 1 1 d . . . . .
O1W O 0.36402(17) 0.22478(14) 0.24979(16) 0.0176(5) Uani 1 1 d . . . . .
H1WA H 0.4078 0.2185 0.2942 0.026 Uiso 1 1 d GR . . . .
H1WB H 0.3827 0.2351 0.2035 0.026 Uiso 1 1 d GR . . . .
O2 O 0.26538(18) 0.36881(13) 0.25898(16) 0.0168(5) Uani 1 1 d . . . . .
O2W O 0.24677(15) 0.26728(16) 0.09009(14) 0.0157(5) Uani 1 1 d . . . . .
H2WA H 0.2103 0.2397 0.0519 0.024 Uiso 1 1 d GR . . . .
H2WB H 0.2995 0.2490 0.0925 0.024 Uiso 1 1 d GR . . . .
O3W O 0.09273(17) 0.31262(15) 0.13123(16) 0.0192(6) Uani 1 1 d . . . . .
H3WA H 0.0544 0.3262 0.1596 0.029 Uiso 1 1 d GR . . . .
H3WB H 0.0807 0.3269 0.0758 0.029 Uiso 1 1 d GR . . . .
O4W O 0.09731(14) 0.26346(19) 0.29606(13) 0.0171(5) Uani 1 1 d . . . . .
H4WA H 0.0382 0.2730 0.2779 0.026 Uiso 1 1 d GR . . . .
H4WB H 0.1161 0.2511 0.3516 0.026 Uiso 1 1 d GR . . . .
O5W O 0.27331(17) 0.23992(13) 0.37824(15) 0.0188(6) Uani 1 1 d . . . . .
H5WA H 0.2990 0.1978 0.3871 0.028 Uiso 1 1 d GR . . . .
H5WB H 0.2301 0.2369 0.4040 0.028 Uiso 1 1 d GR . . . .
O7T O 0.4924(6) 0.2099(3) 0.4008(4) 0.034(2) Uani 0.594(15) 1 d D . P B 1
O7TA O 0.4496(8) 0.2109(5) 0.4244(6) 0.030(3) Uani 0.406(15) 1 d D . P B 2
O8T O 0.530(2) 0.0947(13) 0.465(2) 0.053(8) Uani 0.594(15) 1 d D . P B 1
O8TA O 0.542(3) 0.0998(16) 0.475(3) 0.030(5) Uani 0.406(15) 1 d D . P B 2
O9T O 0.4021(4) 0.1504(4) 0.4817(6) 0.051(3) Uani 0.594(15) 1 d D . P B 1
O9TA O 0.4222(6) 0.1430(5) 0.5456(7) 0.042(3) Uani 0.406(15) 1 d D . P B 2
C1 C 0.0531(2) 0.04565(19) 0.2009(2) 0.0144(7) Uani 1 1 d . . . . .
H1 H 0.0339 -0.0033 0.1777 0.017 Uiso 1 1 calc R . . . .
C2 C -0.0224(3) 0.0989(2) 0.1653(2) 0.0175(8) Uani 1 1 d . . . . .
H2A H -0.0020 0.1482 0.1832 0.021 Uiso 1 1 calc R . . . .
H2B H -0.0383 0.0971 0.1010 0.021 Uiso 1 1 calc R . . . .
C3 C -0.1040(3) 0.0820(2) 0.1978(2) 0.0227(8) Uani 1 1 d . . . . .
H3A H -0.1286 0.0350 0.1743 0.027 Uiso 1 1 calc R . . . .
H3B H -0.1496 0.1191 0.1764 0.027 Uiso 1 1 calc R . . . .
C3T C 0.5579(4) 0.2076(3) 0.5670(3) 0.0452(14) Uani 1 1 d D . . . .
C4 C -0.0817(3) 0.0797(2) 0.2972(3) 0.0265(9) Uani 1 1 d . . . . .
H4A H -0.0627 0.1280 0.3210 0.032 Uiso 1 1 calc R . . . .
H4B H -0.1348 0.0659 0.3165 0.032 Uiso 1 1 calc R . . . .
C5 C -0.0085(3) 0.0259(2) 0.3312(2) 0.0252(9) Uani 1 1 d . . . . .
H5A H -0.0295 -0.0227 0.3106 0.030 Uiso 1 1 calc R . . . .
H5B H 0.0061 0.0256 0.3955 0.030 Uiso 1 1 calc R . . . .
C6 C 0.0742(3) 0.0433(2) 0.3015(3) 0.0236(9) Uani 1 1 d . . . . .
H6A H 0.1198 0.0063 0.3237 0.028 Uiso 1 1 calc R . . . .
H6B H 0.0980 0.0903 0.3255 0.028 Uiso 1 1 calc R . . . .
C7 C 0.2382(3) 0.0072(3) 0.2097(4) 0.0376(13) Uani 1 1 d D . . . .
H7 H 0.2388 0.0052 0.2727 0.045 Uiso 0.369(10) 1 calc R . P C 2
C8 C 0.3086(8) 0.0264(7) 0.2781(8) 0.033(3) Uani 0.369(10) 1 d D U P C 1
H8A H 0.2902 0.0234 0.3331 0.040 Uiso 0.369(10) 1 calc R . P C 1
H8B H 0.3252 0.0768 0.2704 0.040 Uiso 0.369(10) 1 calc R . P C 1
C8A C 0.3294(4) 0.0292(3) 0.2119(4) 0.0204(17) Uani 0.631(10) 1 d D U P C 2
H8AA H 0.3399 0.0775 0.2385 0.024 Uiso 0.631(10) 1 calc R . P C 2
H8AB H 0.3347 0.0332 0.1513 0.024 Uiso 0.631(10) 1 calc R . P C 2
C9 C 0.3905(8) -0.0231(7) 0.2844(9) 0.042(4) Uani 0.631(10) 1 d D U P C 1
H9A H 0.4157 -0.0145 0.2341 0.051 Uiso 0.631(10) 1 calc R . P C 1
H9B H 0.4365 -0.0122 0.3382 0.051 Uiso 0.631(10) 1 calc R . P C 1
C9A C 0.4019(11) -0.0214(9) 0.2617(9) 0.012(3) Uani 0.369(10) 1 d D U P C 2
H9AA H 0.4587 -0.0084 0.2491 0.015 Uiso 0.369(10) 1 calc R . P C 2
H9AB H 0.4086 -0.0156 0.3249 0.015 Uiso 0.369(10) 1 calc R . P C 2
C10 C 0.3612(11) -0.1011(7) 0.2851(12) 0.045(4) Uani 0.369(10) 1 d D U P C 1
H10A H 0.4124 -0.1323 0.2851 0.054 Uiso 0.369(10) 1 calc R . P C 1
H10B H 0.3445 -0.1099 0.3402 0.054 Uiso 0.369(10) 1 calc R . P C 1
C10A C 0.3803(5) -0.0996(4) 0.2364(6) 0.033(2) Uani 0.631(10) 1 d D U P C 2
H10C H 0.4266 -0.1314 0.2712 0.040 Uiso 0.631(10) 1 calc R . P C 2
H10D H 0.3781 -0.1067 0.1742 0.040 Uiso 0.631(10) 1 calc R . P C 2
C11 C 0.2892(7) -0.1230(6) 0.2149(9) 0.048(3) Uani 0.631(10) 1 d D U P C 1
H11A H 0.2677 -0.1702 0.2295 0.057 Uiso 0.631(10) 1 calc R . P C 1
H11B H 0.3115 -0.1296 0.1625 0.057 Uiso 0.631(10) 1 calc R . P C 1
C11A C 0.2880(9) -0.1189(8) 0.2535(11) 0.025(3) Uani 0.369(10) 1 d D U P C 2
H11C H 0.2852 -0.1046 0.3126 0.030 Uiso 0.369(10) 1 calc R . P C 2
H11D H 0.2751 -0.1709 0.2453 0.030 Uiso 0.369(10) 1 calc R . P C 2
C12 C 0.2112(10) -0.0710(7) 0.1930(11) 0.026(4) Uani 0.631(10) 1 d D U P C 1
H12A H 0.1800 -0.0768 0.1309 0.031 Uiso 0.631(10) 1 calc R . P C 1
H12B H 0.1694 -0.0837 0.2280 0.031 Uiso 0.631(10) 1 calc R . P C 1
C12A C 0.2226(18) -0.0721(12) 0.1808(17) 0.022(6) Uani 0.369(10) 1 d D U P C 2
H12C H 0.2354 -0.0793 0.1235 0.026 Uiso 0.369(10) 1 calc R . P C 2
H12D H 0.1605 -0.0860 0.1761 0.026 Uiso 0.369(10) 1 calc R . P C 2
C13 C 0.1202(2) 0.0734(2) 0.0479(2) 0.0162(7) Uani 1 1 d . . . . .
H13 H 0.0834 0.1177 0.0319 0.019 Uiso 1 1 calc R . . . .
C14 C 0.0622(3) 0.01118(19) 0.0025(2) 0.0177(8) Uani 1 1 d . . . . .
H14A H 0.0971 -0.0338 0.0100 0.021 Uiso 1 1 calc R . . . .
H14B H 0.0118 0.0043 0.0287 0.021 Uiso 1 1 calc R . . . .
C15 C 0.0282(3) 0.0285(2) -0.0944(2) 0.0214(8) Uani 1 1 d . . . . .
H15A H -0.0079 -0.0121 -0.1242 0.026 Uiso 1 1 calc R . . . .
H15B H -0.0100 0.0716 -0.1015 0.026 Uiso 1 1 calc R . . . .
C16 C 0.1042(3) 0.0421(2) -0.1366(3) 0.0235(9) Uani 1 1 d . . . . .
H16A H 0.0799 0.0574 -0.1975 0.028 Uiso 1 1 calc R . . . .
H16B H 0.1370 -0.0033 -0.1373 0.028 Uiso 1 1 calc R . . . .
C17 C 0.1679(3) 0.0995(2) -0.0886(3) 0.0220(8) Uani 1 1 d . . . . .
H17A H 0.2195 0.1022 -0.1138 0.026 Uiso 1 1 calc R . . . .
H17B H 0.1381 0.1468 -0.0968 0.026 Uiso 1 1 calc R . . . .
C18 C 0.1997(3) 0.0835(2) 0.0086(2) 0.0206(8) Uani 1 1 d . . . . .
H18A H 0.2367 0.1237 0.0382 0.025 Uiso 1 1 calc R . . . .
H18B H 0.2361 0.0394 0.0176 0.025 Uiso 1 1 calc R . . . .
C19 C 0.2105(3) 0.4657(2) 0.3594(2) 0.0169(8) Uani 1 1 d . . . . .
H19 H 0.2205 0.4244 0.4010 0.020 Uiso 1 1 calc R . . . .
C20 C 0.2304(3) 0.5337(2) 0.4159(3) 0.0236(9) Uani 1 1 d . . . . .
H20A H 0.2175 0.5770 0.3787 0.028 Uiso 1 1 calc R . . . .
H20B H 0.2935 0.5347 0.4476 0.028 Uiso 1 1 calc R . . . .
C21 C 0.1723(3) 0.5330(3) 0.4807(3) 0.0329(11) Uani 1 1 d . . . . .
H21A H 0.1892 0.4917 0.5207 0.039 Uiso 1 1 calc R . . . .
H21B H 0.1829 0.5775 0.5159 0.039 Uiso 1 1 calc R . . . .
C22 C 0.0743(3) 0.5277(3) 0.4347(3) 0.0327(10) Uani 1 1 d . . . . .
H22A H 0.0395 0.5249 0.4785 0.039 Uiso 1 1 calc R . . . .
H22B H 0.0559 0.5715 0.3994 0.039 Uiso 1 1 calc R . . . .
C23 C 0.0550(3) 0.4617(3) 0.3758(3) 0.0306(10) Uani 1 1 d . . . . .
H23A H 0.0674 0.4175 0.4116 0.037 Uiso 1 1 calc R . . . .
H23B H -0.0081 0.4612 0.3441 0.037 Uiso 1 1 calc R . . . .
C24 C 0.1118(3) 0.4628(2) 0.3113(3) 0.0231(9) Uani 1 1 d . . . . .
H24A H 0.0965 0.5053 0.2730 0.028 Uiso 1 1 calc R . . . .
H24B H 0.1001 0.4193 0.2745 0.028 Uiso 1 1 calc R . . . .
C25 C 0.2407(3) 0.5012(2) 0.1867(3) 0.0182(9) Uani 1 1 d . . . . .
H25 H 0.1749 0.5017 0.1741 0.022 Uiso 1 1 calc R . . . .
C26 C 0.2624(3) 0.4665(2) 0.1072(2) 0.0228(9) Uani 1 1 d . . . . .
H26A H 0.2405 0.4163 0.1011 0.027 Uiso 1 1 calc R . . . .
H26B H 0.3271 0.4653 0.1153 0.027 Uiso 1 1 calc R . . . .
C27 C 0.2194(3) 0.5088(2) 0.0246(3) 0.0256(9) Uani 1 1 d . . . . .
H27A H 0.2364 0.4871 -0.0256 0.031 Uiso 1 1 calc R . . . .
H27B H 0.1544 0.5058 0.0135 0.031 Uiso 1 1 calc R . . . .
C28 C 0.2476(3) 0.5870(2) 0.0331(3) 0.0284(10) Uani 1 1 d . . . . .
H28A H 0.2161 0.6135 -0.0197 0.034 Uiso 1 1 calc R . . . .
H28B H 0.3117 0.5902 0.0375 0.034 Uiso 1 1 calc R . . . .
C29 C 0.2277(3) 0.6221(2) 0.1130(3) 0.0297(10) Uani 1 1 d . . . . .
H29A H 0.1630 0.6244 0.1051 0.036 Uiso 1 1 calc R . . . .
H29B H 0.2507 0.6718 0.1187 0.036 Uiso 1 1 calc R . . . .
C30 C 0.2694(3) 0.5802(2) 0.1963(3) 0.0222(9) Uani 1 1 d . . . . .
H30A H 0.2510 0.6020 0.2458 0.027 Uiso 1 1 calc R . . . .
H30B H 0.3345 0.5833 0.2086 0.027 Uiso 1 1 calc R . . . .
C31 C 0.3933(2) 0.4637(2) 0.3393(2) 0.0161(7) Uani 1 1 d . . . . .
H31 H 0.3999 0.5154 0.3571 0.019 Uiso 1 1 calc R . . . .
C32 C 0.4550(3) 0.4484(2) 0.2799(3) 0.0226(8) Uani 1 1 d . . . . .
H32A H 0.4446 0.3990 0.2567 0.027 Uiso 1 1 calc R . . . .
H32B H 0.4412 0.4821 0.2300 0.027 Uiso 1 1 calc R . . . .
C33 C 0.5521(3) 0.4566(3) 0.3284(3) 0.0288(10) Uani 1 1 d . . . . .
H33A H 0.5897 0.4437 0.2892 0.035 Uiso 1 1 calc R . . . .
H33B H 0.5641 0.5074 0.3459 0.035 Uiso 1 1 calc R . . . .
C34 C 0.5759(3) 0.4092(2) 0.4086(3) 0.0274(9) Uani 1 1 d . . . . .
H34A H 0.6384 0.4174 0.4398 0.033 Uiso 1 1 calc R . . . .
H34B H 0.5691 0.3581 0.3910 0.033 Uiso 1 1 calc R . . . .
C35 C 0.5168(3) 0.4259(3) 0.4686(3) 0.0251(10) Uani 1 1 d . . . . .
H35A H 0.5275 0.4758 0.4901 0.030 Uiso 1 1 calc R . . . .
H35B H 0.5319 0.3933 0.5195 0.030 Uiso 1 1 calc R . . . .
C36 C 0.4191(3) 0.4168(2) 0.4219(3) 0.0206(8) Uani 1 1 d . . . . .
H36A H 0.3825 0.4305 0.4618 0.025 Uiso 1 1 calc R . . . .
H36B H 0.4072 0.3658 0.4059 0.025 Uiso 1 1 calc R . . . .
S1T S -0.11822(6) 0.32565(5) 0.18910(6) 0.01711(19) Uani 1 1 d . . . . .
F1T F -0.19264(18) 0.34260(14) 0.02282(16) 0.0345(6) Uani 1 1 d . . . . .
F2T F -0.09938(14) 0.25530(19) 0.05196(14) 0.0326(5) Uani 1 1 d . . . . .
F3T F -0.22754(15) 0.24406(12) 0.07639(15) 0.0282(6) Uani 1 1 d . . . . .
O1T O -0.08624(16) 0.2620(2) 0.23982(15) 0.0240(5) Uani 1 1 d . . . . .
O2T O -0.19221(18) 0.36106(16) 0.20846(19) 0.0267(6) Uani 1 1 d . . . . .
O3T O -0.04769(18) 0.37216(14) 0.17784(18) 0.0219(6) Uani 1 1 d . . . . .
C1T C -0.1616(3) 0.2902(2) 0.0793(3) 0.0212(8) Uani 1 1 d . . . . .
S2T S 0.07778(7) 0.33510(5) -0.10524(6) 0.0205(2) Uani 1 1 d . . . . .
F4T F -0.00587(19) 0.21874(14) -0.07800(19) 0.0394(6) Uani 1 1 d . . . . .
F5T F -0.0857(2) 0.29278(18) -0.1683(2) 0.0558(9) Uani 1 1 d . . . . .
F6T F 0.0108(2) 0.22795(16) -0.20835(18) 0.0458(7) Uani 1 1 d . . . . .
O4T O 0.0518(2) 0.36713(16) -0.03271(18) 0.0290(7) Uani 1 1 d . . . . .
O5T O 0.0675(2) 0.38053(17) -0.18032(19) 0.0337(8) Uani 1 1 d . . . . .
O6T O 0.15936(19) 0.29454(16) -0.08087(17) 0.0251(6) Uani 1 1 d . . . . .
C2T C -0.0056(3) 0.2660(3) -0.1420(3) 0.0298(9) Uani 1 1 d . . . . .
P3 P 0.49882(5) 0.26048(7) 0.07762(5) 0.01464(16) Uani 1 1 d . . . . .
O3 O 0.41620(16) 0.2504(2) 0.10864(15) 0.0227(6) Uani 1 1 d . . . . .
C37 C 0.5929(2) 0.2217(2) 0.1552(2) 0.0175(8) Uani 1 1 d . . . . .
H37 H 0.6458 0.2257 0.1311 0.021 Uiso 1 1 calc R . . . .
C38 C 0.6118(2) 0.2626(3) 0.2424(2) 0.0221(7) Uani 1 1 d . . . . .
H38A H 0.6261 0.3133 0.2329 0.027 Uiso 1 1 calc R . . . .
H38B H 0.5583 0.2621 0.2648 0.027 Uiso 1 1 calc R . . . .
C39 C 0.6887(3) 0.2286(2) 0.3096(3) 0.0318(10) Uani 1 1 d . . . . .
H39A H 0.7435 0.2341 0.2901 0.038 Uiso 1 1 calc R . . . .
H39B H 0.6968 0.2542 0.3657 0.038 Uiso 1 1 calc R . . . .
C40 C 0.6728(3) 0.1496(3) 0.3228(3) 0.0374(11) Uani 1 1 d . . . . .
H40A H 0.7253 0.1288 0.3639 0.045 Uiso 1 1 calc R . . . .
H40B H 0.6218 0.1442 0.3486 0.045 Uiso 1 1 calc R . . . .
C41 C 0.6548(3) 0.1094(3) 0.2379(3) 0.0400(12) Uani 1 1 d . . . . .
H41A H 0.6420 0.0585 0.2479 0.048 Uiso 1 1 calc R . . . .
H41B H 0.7081 0.1108 0.2151 0.048 Uiso 1 1 calc R . . . .
C42 C 0.5765(3) 0.1419(2) 0.1704(3) 0.0296(10) Uani 1 1 d . . . . .
H42A H 0.5222 0.1370 0.1910 0.036 Uiso 1 1 calc R . . . .
H42B H 0.5677 0.1153 0.1150 0.036 Uiso 1 1 calc R . . . .
C43 C 0.4868(3) 0.2122(2) -0.0249(2) 0.0239(9) Uani 1 1 d . . . . .
H43 H 0.4998 0.1609 -0.0073 0.029 Uiso 1 1 calc R . . . .
C44 C 0.3919(3) 0.2115(3) -0.0799(3) 0.0290(10) Uani 1 1 d . . . . .
H44A H 0.3743 0.2607 -0.1009 0.035 Uiso 1 1 calc R . . . .
H44B H 0.3523 0.1955 -0.0440 0.035 Uiso 1 1 calc R . . . .
C45 C 0.3825(3) 0.1609(2) -0.1575(3) 0.0297(10) Uani 1 1 d . . . . .
H45A H 0.3936 0.1109 -0.1362 0.036 Uiso 1 1 calc R . . . .
H45B H 0.3213 0.1634 -0.1943 0.036 Uiso 1 1 calc R . . . .
C46 C 0.4460(3) 0.1796(3) -0.2122(3) 0.0335(10) Uani 1 1 d . . . . .
H46A H 0.4298 0.2268 -0.2403 0.040 Uiso 1 1 calc R . . . .
H46B H 0.4411 0.1432 -0.2586 0.040 Uiso 1 1 calc R . . . .
C47 C 0.5410(3) 0.1823(3) -0.1572(3) 0.0319(10) Uani 1 1 d . . . . .
H47A H 0.5602 0.1330 -0.1377 0.038 Uiso 1 1 calc R . . . .
H47B H 0.5794 0.1998 -0.1936 0.038 Uiso 1 1 calc R . . . .
C48 C 0.5527(3) 0.2307(2) -0.0780(2) 0.0221(8) Uani 1 1 d . . . . .
H48A H 0.5444 0.2814 -0.0971 0.026 Uiso 1 1 calc R . . . .
H48B H 0.6135 0.2255 -0.0410 0.026 Uiso 1 1 calc R . . . .
C49 C 0.5198(3) 0.3562(2) 0.0690(2) 0.0183(8) Uani 1 1 d . . . . .
H49 H 0.5156 0.3777 0.1254 0.022 Uiso 1 1 calc R . . . .
C50 C 0.6122(3) 0.3755(2) 0.0599(3) 0.0217(8) Uani 1 1 d . . . . .
H50A H 0.6572 0.3534 0.1082 0.026 Uiso 1 1 calc R . . . .
H50B H 0.6203 0.3559 0.0046 0.026 Uiso 1 1 calc R . . . .
C51 C 0.6253(3) 0.4571(2) 0.0616(3) 0.0302(10) Uani 1 1 d . . . . .
H51A H 0.6223 0.4763 0.1188 0.036 Uiso 1 1 calc R . . . .
H51B H 0.6843 0.4685 0.0531 0.036 Uiso 1 1 calc R . . . .
C52 C 0.5542(3) 0.4922(3) -0.0102(3) 0.0330(10) Uani 1 1 d . . . . .
H52A H 0.5602 0.4756 -0.0675 0.040 Uiso 1 1 calc R . . . .
H52B H 0.5622 0.5450 -0.0075 0.040 Uiso 1 1 calc R . . . .
C53 C 0.4620(3) 0.4737(2) -0.0007(3) 0.0321(10) Uani 1 1 d . . . . .
H53A H 0.4544 0.4941 0.0544 0.038 Uiso 1 1 calc R . . . .
H53B H 0.4173 0.4959 -0.0490 0.038 Uiso 1 1 calc R . . . .
C54 C 0.4471(3) 0.3930(2) -0.0013(3) 0.0235(9) Uani 1 1 d . . . . .
H54A H 0.4473 0.3733 -0.0591 0.028 Uiso 1 1 calc R . . . .
H54B H 0.3888 0.3828 0.0096 0.028 Uiso 1 1 calc R . . . .
P4 P 0.15301(5) 0.25844(7) 0.55766(5) 0.01352(15) Uani 1 1 d . . . . .
O4 O 0.15407(17) 0.27524(13) 0.46515(15) 0.0180(6) Uani 1 1 d . . . . .
C0CA C 0.1681(3) 0.1309(2) 0.6615(2) 0.0182(8) Uani 1 1 d . . . . .
H0CA H 0.1811 0.1620 0.7136 0.022 Uiso 1 1 calc R . . . .
H0CB H 0.1035 0.1230 0.6432 0.022 Uiso 1 1 calc R . . . .
C1AA C 0.0114(3) 0.3430(2) 0.5750(3) 0.0242(9) Uani 1 1 d . . . . .
H1AA H 0.0512 0.3679 0.6247 0.029 Uiso 1 1 calc R . . . .
H1AB H 0.0159 0.3675 0.5211 0.029 Uiso 1 1 calc R . . . .
C1CA C 0.3611(3) 0.3981(2) 0.6553(3) 0.0252(9) Uani 1 1 d . . . . .
H1CA H 0.4208 0.4001 0.6451 0.030 Uiso 1 1 calc R . . . .
H1CB H 0.3297 0.4429 0.6323 0.030 Uiso 1 1 calc R . . . .
C2AA C 0.2298(3) 0.3186(2) 0.7246(2) 0.0190(8) Uani 1 1 d . . . . .
H2AA H 0.1705 0.3156 0.7357 0.023 Uiso 1 1 calc R . . . .
H2AB H 0.2623 0.2740 0.7465 0.023 Uiso 1 1 calc R . . . .
C2BA C 0.0415(2) 0.2643(3) 0.5728(2) 0.0175(7) Uani 1 1 d . . . . .
H2BA H 0.0417 0.2416 0.6297 0.021 Uiso 1 1 calc R . . . .
C2CA C 0.2156(3) 0.0583(2) 0.6839(2) 0.0220(8) Uani 1 1 d . . . . .
H2CA H 0.2797 0.0667 0.7063 0.026 Uiso 1 1 calc R . . . .
H2CB H 0.1941 0.0344 0.7302 0.026 Uiso 1 1 calc R . . . .
C3AA C -0.0235(3) 0.2227(2) 0.5007(3) 0.0258(9) Uani 1 1 d . . . . .
H3AA H -0.0208 0.2417 0.4434 0.031 Uiso 1 1 calc R . . . .
H3AB H -0.0063 0.1714 0.5034 0.031 Uiso 1 1 calc R . . . .
C3BA C 0.3690(3) 0.3932(2) 0.7530(3) 0.0250(9) Uani 1 1 d . . . . .
H3BA H 0.4072 0.3519 0.7773 0.030 Uiso 1 1 calc R . . . .
H3BB H 0.3975 0.4374 0.7816 0.030 Uiso 1 1 calc R . . . .
C3CA C 0.3110(3) 0.3334(2) 0.6070(2) 0.0204(8) Uani 1 1 d . . . . .
H3CA H 0.3032 0.3397 0.5437 0.024 Uiso 1 1 calc R . . . .
H3CB H 0.3457 0.2891 0.6251 0.024 Uiso 1 1 calc R . . . .
C4AA C -0.1181(3) 0.2292(3) 0.5102(4) 0.0356(12) Uani 1 1 d . . . . .
H4AA H -0.1586 0.2037 0.4614 0.043 Uiso 1 1 calc R . . . .
H4AB H -0.1221 0.2058 0.5650 0.043 Uiso 1 1 calc R . . . .
C4BA C 0.2209(3) 0.3259(2) 0.6264(2) 0.0167(8) Uani 1 1 d . . . . .
H4BA H 0.1902 0.3728 0.6091 0.020 Uiso 1 1 calc R . . . .
C4CA C 0.1989(3) 0.1683(2) 0.5878(2) 0.0156(8) Uani 1 1 d . . . . .
H4CA H 0.2643 0.1741 0.6086 0.019 Uiso 1 1 calc R . . . .
C7BA C 0.2796(3) 0.3840(2) 0.7725(2) 0.0246(9) Uani 1 1 d . . . . .
H7BA H 0.2439 0.4279 0.7545 0.030 Uiso 1 1 calc R . . . .
H7BB H 0.2879 0.3778 0.8358 0.030 Uiso 1 1 calc R . . . .
C8AA C 0.1819(3) 0.1183(2) 0.5076(2) 0.0198(8) Uani 1 1 d . . . . .
H8AC H 0.1176 0.1103 0.4853 0.024 Uiso 1 1 calc R . . . .
H8AD H 0.2037 0.1416 0.4611 0.024 Uiso 1 1 calc R . . . .
C8BA C 0.1996(3) 0.0093(2) 0.6048(2) 0.0213(8) Uani 1 1 d . . . . .
H8BA H 0.1360 -0.0027 0.5856 0.026 Uiso 1 1 calc R . . . .
H8BB H 0.2330 -0.0359 0.6206 0.026 Uiso 1 1 calc R . . . .
C9AA C -0.1469(3) 0.3070(3) 0.5108(4) 0.0367(12) Uani 1 1 d . . . . .
H9AC H -0.2073 0.3091 0.5195 0.044 Uiso 1 1 calc R . . . .
H9AD H -0.1481 0.3295 0.4542 0.044 Uiso 1 1 calc R . . . .
C56 C 0.2284(3) 0.0457(2) 0.5307(3) 0.0220(8) Uani 1 1 d . . . . .
H56A H 0.2144 0.0140 0.4790 0.026 Uiso 1 1 calc R . . . .
H56B H 0.2931 0.0532 0.5479 0.026 Uiso 1 1 calc R . . . .
C65 C -0.0837(3) 0.3482(2) 0.5834(3) 0.0313(10) Uani 1 1 d . . . . .
H65A H -0.0869 0.3285 0.6403 0.038 Uiso 1 1 calc R . . . .
H65B H -0.1016 0.3993 0.5812 0.038 Uiso 1 1 calc R . . . .


_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 2.200(2) . ?
Dy1 O1W 2.355(3) . ?
Dy1 O2 2.203(2) . ?
Dy1 O2W 2.368(2) . ?
Dy1 O3W 2.354(3) . ?
Dy1 O4W 2.369(2) . ?
Dy1 O5W 2.363(2) . ?
S3T O7T 1.581(6) . ?
S3T O7TA 1.324(8) . ?
S3T O8T 1.430(14) . ?
S3T O8TA 1.427(14) . ?
S3T O9T 1.346(6) . ?
S3T O9TA 1.663(8) . ?
S3T C3T 1.789(6) . ?
P1 O1 1.518(3) . ?
P1 C1 1.813(4) . ?
P1 C7 1.810(5) . ?
P1 C13 1.820(4) . ?
P2 O2 1.516(3) . ?
P2 C19 1.818(4) . ?
P2 C25 1.819(4) . ?
P2 C31 1.817(4) . ?
F7T C3T 1.29(2) . ?
F7TA C3T 1.320(14) . ?
F8T C3T 1.382(11) . ?
F8TA C3T 1.356(11) . ?
F9T C3T 1.345(16) . ?
F9TA C3T 1.33(2) . ?
C1 C2 1.536(5) . ?
C1 C6 1.550(5) . ?
C2 C3 1.529(5) . ?
C3 C4 1.531(5) . ?
C4 C5 1.516(6) . ?
C5 C6 1.523(6) . ?
C7 C8 1.386(12) . ?
C7 C8A 1.478(8) . ?
C7 C12 1.520(14) . ?
C7 C12A 1.55(2) . ?
C8 C9 1.562(16) . ?
C8A C9A 1.533(16) . ?
C9 C10 1.525(17) . ?
C9A C10A 1.525(17) . ?
C10 C11 1.431(15) . ?
C10A C11A 1.577(15) . ?
C11 C12 1.528(15) . ?
C11A C12A 1.60(2) . ?
C13 C14 1.535(5) . ?
C13 C18 1.540(5) . ?
C14 C15 1.533(5) . ?
C15 C16 1.528(6) . ?
C16 C17 1.529(6) . ?
C17 C18 1.529(6) . ?
C19 C20 1.537(5) . ?
C19 C24 1.542(6) . ?
C20 C21 1.538(6) . ?
C21 C22 1.528(7) . ?
C22 C23 1.528(6) . ?
C23 C24 1.519(6) . ?
C25 C26 1.533(6) . ?
C25 C30 1.535(6) . ?
C26 C27 1.534(5) . ?
C27 C28 1.518(6) . ?
C28 C29 1.529(6) . ?
C29 C30 1.533(6) . ?
C31 C32 1.540(5) . ?
C31 C36 1.544(5) . ?
C32 C33 1.529(6) . ?
C33 C34 1.517(6) . ?
C34 C35 1.521(7) . ?
C35 C36 1.531(6) . ?
S1T O1T 1.450(3) . ?
S1T O2T 1.433(3) . ?
S1T O3T 1.450(3) . ?
S1T C1T 1.829(4) . ?
F1T C1T 1.333(5) . ?
F2T C1T 1.332(5) . ?
F3T C1T 1.335(5) . ?
S2T O4T 1.445(3) . ?
S2T O5T 1.439(3) . ?
S2T O6T 1.450(3) . ?
S2T C2T 1.820(5) . ?
F4T C2T 1.347(5) . ?
F5T C2T 1.317(5) . ?
F6T C2T 1.348(5) . ?
P3 O3 1.509(2) . ?
P3 C37 1.815(4) . ?
P3 C43 1.829(4) . ?
P3 C49 1.823(4) . ?
C37 C38 1.544(5) . ?
C37 C42 1.537(6) . ?
C38 C39 1.531(6) . ?
C39 C40 1.515(7) . ?
C40 C41 1.507(7) . ?
C41 C42 1.535(6) . ?
C43 C44 1.522(6) . ?
C43 C48 1.529(6) . ?
C44 C45 1.530(6) . ?
C45 C46 1.519(7) . ?
C46 C47 1.523(7) . ?
C47 C48 1.523(6) . ?
C49 C50 1.532(5) . ?
C49 C54 1.539(5) . ?
C50 C51 1.532(6) . ?
C51 C52 1.526(6) . ?
C52 C53 1.527(7) . ?
C53 C54 1.521(6) . ?
P4 O4 1.509(2) . ?
P4 C2BA 1.824(3) . ?
P4 C4BA 1.821(4) . ?
P4 C4CA 1.841(4) . ?
C0CA C2CA 1.540(5) . ?
C0CA C4CA 1.542(5) . ?
C1AA C2BA 1.542(6) . ?
C1AA C65 1.532(6) . ?
C1CA C3BA 1.529(6) . ?
C1CA C3CA 1.533(6) . ?
C2AA C4BA 1.540(5) . ?
C2AA C7BA 1.539(5) . ?
C2BA C3AA 1.536(5) . ?
C2CA C8BA 1.522(5) . ?
C3AA C4AA 1.531(7) . ?
C3BA C7BA 1.519(6) . ?
C3CA C4BA 1.524(5) . ?
C4AA C9AA 1.518(7) . ?
C4CA C8AA 1.547(5) . ?
C8AA C56 1.535(5) . ?
C8BA C56 1.523(5) . ?
C9AA C65 1.525(7) . ?

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 O1W 87.22(10) . . ?
O1 Dy1 O2 173.42(10) . . ?
O1 Dy1 O2W 88.33(10) . . ?
O1 Dy1 O3W 99.14(10) . . ?
O1 Dy1 O4W 87.18(11) . . ?
O1 Dy1 O5W 94.30(9) . . ?
O1W Dy1 O2W 74.06(8) . . ?
O1W Dy1 O4W 142.92(8) . . ?
O1W Dy1 O5W 72.27(9) . . ?
O2 Dy1 O1W 86.20(10) . . ?
O2 Dy1 O2W 90.10(10) . . ?
O2 Dy1 O3W 86.46(10) . . ?
O2 Dy1 O4W 97.94(11) . . ?
O2 Dy1 O5W 83.46(9) . . ?
O2W Dy1 O4W 142.29(8) . . ?
O3W Dy1 O1W 145.50(9) . . ?
O3W Dy1 O2W 72.29(9) . . ?
O3W Dy1 O4W 71.54(9) . . ?
O3W Dy1 O5W 139.94(9) . . ?
O5W Dy1 O2W 146.05(8) . . ?
O5W Dy1 O4W 71.65(8) . . ?
O7T S3T C3T 99.9(3) . . ?
O7TA S3T O8TA 134.3(17) . . ?
O7TA S3T O9TA 108.5(6) . . ?
O7TA S3T C3T 103.7(4) . . ?
O8T S3T O7T 104.6(14) . . ?
O8T S3T C3T 108.5(14) . . ?
O8TA S3T O9TA 111.4(17) . . ?
O8TA S3T C3T 99.3(19) . . ?
O9T S3T O7T 110.5(4) . . ?
O9T S3T O8T 114.0(15) . . ?
O9T S3T C3T 117.7(5) . . ?
O9TA S3T C3T 87.5(4) . . ?
O1 P1 C1 110.05(16) . . ?
O1 P1 C7 108.89(19) . . ?
O1 P1 C13 108.23(16) . . ?
C1 P1 C13 107.53(17) . . ?
C7 P1 C1 109.2(2) . . ?
C7 P1 C13 112.9(2) . . ?
O2 P2 C19 107.19(16) . . ?
O2 P2 C25 108.05(17) . . ?
O2 P2 C31 109.87(17) . . ?
C19 P2 C25 109.87(19) . . ?
C31 P2 C19 109.05(17) . . ?
C31 P2 C25 112.66(19) . . ?
P1 O1 Dy1 171.34(17) . . ?
P2 O2 Dy1 166.26(17) . . ?
C2 C1 P1 110.5(2) . . ?
C2 C1 C6 110.1(3) . . ?
C6 C1 P1 110.2(3) . . ?
C3 C2 C1 112.0(3) . . ?
C2 C3 C4 111.3(3) . . ?
F7T C3T S3T 108.5(14) . . ?
F7T C3T F8T 111(3) . . ?
F7T C3T F9T 126.6(16) . . ?
F7TA C3T S3T 113.5(10) . . ?
F7TA C3T F8TA 94(2) . . ?
F7TA C3T F9TA 92.6(17) . . ?
F8T C3T S3T 100.3(12) . . ?
F8TA C3T S3T 121.9(9) . . ?
F9T C3T S3T 104.5(13) . . ?
F9T C3T F8T 102.3(13) . . ?
F9TA C3T S3T 121.9(14) . . ?
F9TA C3T F8TA 105.3(15) . . ?
C5 C4 C3 109.9(3) . . ?
C4 C5 C6 112.0(3) . . ?
C5 C6 C1 110.5(3) . . ?
C8 C7 P1 120.5(6) . . ?
C8 C7 C12 120.9(8) . . ?
C8A C7 P1 117.5(4) . . ?
C8A C7 C12A 110.5(12) . . ?
C12 C7 P1 114.1(6) . . ?
C12A C7 P1 117.5(9) . . ?
C7 C8 C9 112.1(10) . . ?
C7 C8A C9A 115.3(8) . . ?
C10 C9 C8 108.5(11) . . ?
C10A C9A C8A 111.3(11) . . ?
C11 C10 C9 116.4(12) . . ?
C9A C10A C11A 108.9(10) . . ?
C10 C11 C12 115.1(11) . . ?
C10A C11A C12A 101.5(14) . . ?
C7 C12 C11 113.4(11) . . ?
C7 C12A C11A 106.4(15) . . ?
C14 C13 P1 115.8(3) . . ?
C14 C13 C18 110.1(3) . . ?
C18 C13 P1 113.3(3) . . ?
C15 C14 C13 109.2(3) . . ?
C16 C15 C14 111.4(3) . . ?
C15 C16 C17 112.3(3) . . ?
C18 C17 C16 111.9(3) . . ?
C17 C18 C13 110.2(3) . . ?
C20 C19 P2 118.2(3) . . ?
C20 C19 C24 110.3(3) . . ?
C24 C19 P2 110.3(3) . . ?
C19 C20 C21 108.6(3) . . ?
C22 C21 C20 111.8(3) . . ?
C23 C22 C21 111.4(4) . . ?
C24 C23 C22 110.1(4) . . ?
C23 C24 C19 110.5(3) . . ?
C26 C25 P2 112.4(3) . . ?
C26 C25 C30 111.5(3) . . ?
C30 C25 P2 114.9(3) . . ?
C25 C26 C27 110.5(4) . . ?
C28 C27 C26 111.2(3) . . ?
C27 C28 C29 111.6(3) . . ?
C28 C29 C30 111.7(4) . . ?
C29 C30 C25 110.6(3) . . ?
C32 C31 P2 112.0(3) . . ?
C32 C31 C36 110.4(3) . . ?
C36 C31 P2 109.1(3) . . ?
C33 C32 C31 111.7(3) . . ?
C34 C33 C32 111.6(3) . . ?
C33 C34 C35 110.5(4) . . ?
C34 C35 C36 111.4(4) . . ?
C35 C36 C31 111.4(3) . . ?
O1T S1T C1T 103.23(18) . . ?
O2T S1T O1T 116.15(17) . . ?
O2T S1T O3T 115.76(17) . . ?
O2T S1T C1T 104.25(18) . . ?
O3T S1T O1T 112.97(16) . . ?
O3T S1T C1T 102.02(17) . . ?
F1T C1T S1T 111.3(3) . . ?
F1T C1T F3T 107.5(3) . . ?
F2T C1T S1T 111.2(3) . . ?
F2T C1T F1T 108.0(3) . . ?
F2T C1T F3T 107.4(3) . . ?
F3T C1T S1T 111.3(3) . . ?
O4T S2T O6T 114.07(17) . . ?
O4T S2T C2T 103.0(2) . . ?
O5T S2T O4T 115.16(18) . . ?
O5T S2T O6T 115.73(18) . . ?
O5T S2T C2T 103.1(2) . . ?
O6T S2T C2T 103.28(19) . . ?
F4T C2T S2T 111.0(3) . . ?
F4T C2T F6T 106.6(4) . . ?
F5T C2T S2T 112.5(4) . . ?
F5T C2T F4T 107.5(4) . . ?
F5T C2T F6T 107.8(3) . . ?
F6T C2T S2T 111.1(3) . . ?
O3 P3 C37 110.11(17) . . ?
O3 P3 C43 109.08(18) . . ?
O3 P3 C49 109.4(2) . . ?
C37 P3 C43 107.04(19) . . ?
C37 P3 C49 107.99(18) . . ?
C49 P3 C43 113.13(19) . . ?
C38 C37 P3 110.6(3) . . ?
C42 C37 P3 110.6(3) . . ?
C42 C37 C38 109.7(3) . . ?
C39 C38 C37 111.2(4) . . ?
C40 C39 C38 111.8(4) . . ?
C41 C40 C39 111.0(4) . . ?
C40 C41 C42 111.5(4) . . ?
C41 C42 C37 110.8(4) . . ?
C44 C43 P3 112.4(3) . . ?
C44 C43 C48 112.4(3) . . ?
C48 C43 P3 116.8(3) . . ?
C43 C44 C45 110.5(4) . . ?
C46 C45 C44 112.2(4) . . ?
C45 C46 C47 111.4(4) . . ?
C48 C47 C46 113.0(4) . . ?
C47 C48 C43 111.6(4) . . ?
C50 C49 P3 115.4(3) . . ?
C50 C49 C54 111.7(3) . . ?
C54 C49 P3 112.0(3) . . ?
C51 C50 C49 110.9(3) . . ?
C52 C51 C50 110.1(4) . . ?
C51 C52 C53 111.0(4) . . ?
C54 C53 C52 111.7(4) . . ?
C53 C54 C49 110.6(3) . . ?
O4 P4 C2BA 111.28(15) . . ?
O4 P4 C4BA 107.07(17) . . ?
O4 P4 C4CA 110.05(16) . . ?
C2BA P4 C4CA 110.1(2) . . ?
C4BA P4 C2BA 108.21(19) . . ?
C4BA P4 C4CA 110.06(19) . . ?
C2CA C0CA C4CA 110.3(3) . . ?
C65 C1AA C2BA 111.9(3) . . ?
C3BA C1CA C3CA 111.3(3) . . ?
C7BA C2AA C4BA 109.7(3) . . ?
C1AA C2BA P4 111.6(3) . . ?
C3AA C2BA P4 110.4(3) . . ?
C3AA C2BA C1AA 110.3(3) . . ?
C8BA C2CA C0CA 111.4(3) . . ?
C4AA C3AA C2BA 111.3(4) . . ?
C7BA C3BA C1CA 111.8(3) . . ?
C4BA C3CA C1CA 110.6(3) . . ?
C9AA C4AA C3AA 111.9(4) . . ?
C2AA C4BA P4 115.9(3) . . ?
C3CA C4BA P4 111.8(3) . . ?
C3CA C4BA C2AA 111.3(3) . . ?
C0CA C4CA P4 115.7(3) . . ?
C0CA C4CA C8AA 109.5(3) . . ?
C8AA C4CA P4 111.1(3) . . ?
C3BA C7BA C2AA 111.5(3) . . ?
C56 C8AA C4CA 111.1(3) . . ?
C2CA C8BA C56 110.8(3) . . ?
C4AA C9AA C65 110.4(4) . . ?
C8BA C56 C8AA 111.1(3) . . ?
C9AA C65 C1AA 111.2(4) . . ?

_olex2_submission_special_instructions 'No special instructions were received'
