# Electronic Supplementary Material (ESI) for RSC Advances.
# This journal is © The Royal Society of Chemistry 2015

####################################################################### 
# 
# 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_dd
_database_code_depnum_ccdc_archive 'CCDC 1037817'
_audit_update_record             
;
2014-12-05 deposited with the CCDC.
2015-10-30 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
;
 ?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C15 H12 Dy F9 O8, C3 H6 O '
_chemical_formula_sum            'C18 H18 Dy F9 O9 '
_chemical_formula_weight         711.82

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'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_H-M   ' P b c n  '
_symmetry_space_group_name_Hall  '  -P 2n 2ab    '

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

_cell_length_a                   11.124(5)
_cell_length_b                   21.760(5)
_cell_length_c                   22.119(5)
_cell_angle_alpha                90.000(5)
_cell_angle_beta                 90.000(5)
_cell_angle_gamma                90.000(5)
_cell_volume                     5354(3)
_cell_formula_units_Z            8
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    ?
_cell_measurement_theta_min      ?
_cell_measurement_theta_max      ?

_exptl_crystal_description       block
_exptl_crystal_colour            colorless
_exptl_crystal_size_max          0.3
_exptl_crystal_size_mid          0.21
_exptl_crystal_size_min          0.13
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.751
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             2760
_exptl_absorpt_coefficient_mu    2.895
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.487
_exptl_absorpt_correction_T_max  0.686
_exptl_absorpt_process_details   sadabs(Sheldrick,1996)

_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      293(2)
_diffrn_radiation_wavelength     0.71069
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  ?
_diffrn_measurement_method       ?
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            14831
_diffrn_reflns_av_R_equivalents  0.0273
_diffrn_reflns_av_sigmaI/netI    0.0283
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_h_max       8
_diffrn_reflns_limit_k_min       -25
_diffrn_reflns_limit_k_max       25
_diffrn_reflns_limit_l_min       -26
_diffrn_reflns_limit_l_max       23
_diffrn_reflns_theta_min         3.20
_diffrn_reflns_theta_max         25.00
_reflns_number_total             4720
_reflns_number_gt                3744
_reflns_threshold_expression     >2sigma(I)

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

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

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0697P)²+44.1645P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         4720
_refine_ls_number_parameters     379
_refine_ls_number_restraints     294
_refine_ls_R_factor_all          0.0674
_refine_ls_R_factor_gt           0.0528
_refine_ls_wR_factor_ref         0.1495
_refine_ls_wR_factor_gt          0.1369
_refine_ls_goodness_of_fit_ref   1.040
_refine_ls_restrained_S_all      1.038
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C 0.3647(11) 0.1496(5) -0.0692(4) 0.074(3) Uani 1 1 d . . .
H1A H 0.3505 0.1104 -0.0878 0.111 Uiso 1 1 calc R . .
H1B H 0.4300 0.1698 -0.0895 0.111 Uiso 1 1 calc R . .
H1C H 0.2936 0.1743 -0.0722 0.111 Uiso 1 1 calc R . .
C2 C 0.3957(10) 0.1406(5) -0.0049(4) 0.066(3) Uani 1 1 d . . .
C3 C 0.4198(10) 0.1964(5) 0.0285(5) 0.067(3) Uani 1 1 d . . .
H3 H 0.4056 0.2343 0.0102 0.081 Uiso 1 1 calc R . .
C4 C 0.4641(9) 0.1946(5) 0.0882(5) 0.066(3) Uani 1 1 d . . .
C5 C 0.5014(12) 0.2556(4) 0.1151(5) 0.067(3) Uani 1 1 d . . .
C7 C 0.0664(13) 0.1679(7) 0.0863(7) 0.094(4) Uani 1 1 d . . .
C8 C 0.1644(10) 0.1396(6) 0.1217(5) 0.074(3) Uani 1 1 d . . .
C9 C 0.1781(12) 0.1658(5) 0.1792(5) 0.082(4) Uani 1 1 d . . .
H9 H 0.1287 0.1984 0.1901 0.098 Uiso 1 1 calc R . .
C10 C 0.2662(12) 0.1438(5) 0.2223(4) 0.075(3) Uani 1 1 d . . .
C11 C 0.2613(13) 0.1706(6) 0.2826(5) 0.102(5) Uani 1 1 d . . .
H11A H 0.3242 0.1534 0.3071 0.153 Uiso 1 1 calc R . .
H11B H 0.1848 0.1617 0.3006 0.153 Uiso 1 1 calc R . .
H11C H 0.2718 0.2143 0.2798 0.153 Uiso 1 1 calc R . .
C12 C 0.3101(14) -0.1199(5) 0.2367(6) 0.088(4) Uani 1 1 d . . .
C13 C 0.3207(9) -0.0835(4) 0.1771(4) 0.057(2) Uani 1 1 d . . .
C14 C 0.3012(10) -0.1138(4) 0.1236(4) 0.060(3) Uani 1 1 d . . .
H14 H 0.2860 -0.1558 0.1248 0.073 Uiso 1 1 calc R . .
C15 C 0.3029(8) -0.0842(4) 0.0670(4) 0.049(2) Uani 1 1 d . . .
C16 C 0.2725(10) -0.1204(5) 0.0112(4) 0.066(3) Uani 1 1 d . . .
H16A H 0.2793 -0.0944 -0.0237 0.100 Uiso 1 1 calc R . .
H16B H 0.1917 -0.1356 0.0142 0.100 Uiso 1 1 calc R . .
H16C H 0.3271 -0.1544 0.0074 0.100 Uiso 1 1 calc R . .
O1 O 0.4069(6) 0.0882(3) 0.0167(2) 0.0510(15) Uani 1 1 d . . .
O2 O 0.4856(6) 0.1486(3) 0.1198(2) 0.0505(15) Uani 1 1 d . . .
O3 O 0.3375(6) 0.0998(3) 0.2113(2) 0.0500(14) Uani 1 1 d . . .
O4 O 0.2188(6) 0.0940(3) 0.1010(3) 0.0568(16) Uani 1 1 d . . .
O5 O 0.3270(6) -0.0284(3) 0.0605(3) 0.0554(16) Uani 1 1 d . . .
O6 O 0.3474(7) -0.0281(3) 0.1850(3) 0.0591(17) Uani 1 1 d . . .
O7 O 0.5745(5) 0.0027(3) 0.0734(3) 0.0586(16) Uani 1 1 d . . .
O8 O 0.5704(6) 0.0401(3) 0.1903(3) 0.0561(16) Uani 1 1 d . . .
Dy1 Dy 0.40505(3) 0.051080(16) 0.119649(15) 0.03601(16) Uani 1 1 d . . .
F1 F 0.6167(8) 0.2622(4) 0.1154(4) 0.122(3) Uani 1 1 d U . .
F2B F 0.4894(15) 0.2560(8) 0.1749(8) 0.095(4) Uani 0.50 1 d PU . .
F3 F 0.4560(8) 0.3035(4) 0.0881(4) 0.123(3) Uani 1 1 d U . .
F4A F -0.0189(9) 0.1315(6) 0.0750(6) 0.181(4) Uani 1 1 d U . .
F5A F 0.1207(19) 0.1948(11) 0.0338(11) 0.136(5) Uani 0.50 1 d PU . .
F5B F 0.086(2) 0.1578(11) 0.0256(11) 0.146(5) Uani 0.50 1 d PU . .
F6A F -0.0040(15) 0.2064(9) 0.1071(8) 0.109(4) Uani 0.50 1 d PU . .
F7A F 0.1927(11) -0.1148(5) 0.2536(5) 0.151(3) Uani 1 1 d U . .
F8B F 0.3329(14) -0.0906(7) 0.2850(6) 0.084(4) Uani 0.50 1 d PU . .
F9B F 0.3584(16) -0.1786(7) 0.2297(7) 0.094(4) Uani 0.50 1 d PU . .
F6B F 0.069(2) 0.2295(12) 0.0858(12) 0.146(6) Uani 0.50 1 d PU . .
F9A F 0.2811(16) -0.1740(8) 0.2342(7) 0.098(4) Uani 0.50 1 d PU . .
F8A F 0.3954(13) -0.1036(6) 0.2765(6) 0.075(3) Uani 0.50 1 d PU . .
F2A F 0.4319(17) 0.2649(9) 0.1677(9) 0.106(5) Uani 0.50 1 d PU . .
O9 O 0.8007(12) 0.0064(8) 0.1212(5) 0.157(5) Uani 1 1 d U . .
C23 C 0.983(2) -0.0076(12) 0.1658(11) 0.184(6) Uani 1 1 d U . .
H23A H 0.9464 0.0100 0.2009 0.276 Uiso 1 1 calc R . .
H23B H 1.0498 0.0175 0.1534 0.276 Uiso 1 1 calc R . .
H23C H 1.0119 -0.0482 0.1753 0.276 Uiso 1 1 calc R . .
C22 C 0.8971(18) -0.0112(11) 0.1178(10) 0.137(6) Uani 1 1 d U . .
C24 C 0.942(2) -0.0394(11) 0.0621(13) 0.197(7) Uani 1 1 d U . .
H24A H 0.8792 -0.0409 0.0326 0.295 Uiso 1 1 calc R . .
H24B H 0.9697 -0.0804 0.0706 0.295 Uiso 1 1 calc R . .
H24C H 1.0081 -0.0155 0.0466 0.295 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
C1 C2 1.476(13) . ?
C2 O1 1.243(11) . ?
C2 C3 1.447(15) . ?
C3 C4 1.410(15) . ?
C4 O2 1.246(12) . ?
C4 C5 1.512(14) . ?
C5 F1 1.290(14) . ?
C5 F3 1.303(12) . ?
C5 F2B 1.330(18) . ?
C5 F2A 1.41(2) . ?
C7 F6A 1.235(19) . ?
C7 F4A 1.262(17) . ?
C7 F6B 1.34(3) . ?
C7 F5B 1.38(3) . ?
C7 F5A 1.43(3) . ?
C7 C8 1.476(17) . ?
C8 O4 1.250(13) . ?
C8 C9 1.401(15) . ?
C9 C10 1.449(15) . ?
C10 O3 1.267(12) . ?
C10 C11 1.456(13) . ?
C12 F9A 1.221(19) . ?
C12 F8B 1.271(17) . ?
C12 F8A 1.342(18) . ?
C12 F7A 1.363(17) . ?
C12 F9B 1.39(2) . ?
C12 C13 1.544(15) . ?
C13 O6 1.253(11) . ?
C13 C14 1.371(12) . ?
C14 C15 1.409(12) . ?
C15 O5 1.252(11) . ?
C15 C16 1.504(11) . ?
O1 Dy1 2.416(5) . ?
O2 Dy1 2.303(6) . ?
O3 Dy1 2.408(6) . ?
O4 Dy1 2.309(6) . ?
O5 Dy1 2.336(6) . ?
O6 Dy1 2.338(6) . ?
O7 Dy1 2.390(6) . ?
O8 Dy1 2.425(6) . ?
F2B F2A 0.69(2) . ?
F4A F5B 1.69(3) . ?
F5A F5B 0.91(3) . ?
F5A F6B 1.49(3) . ?
F6A F6B 1.07(3) . ?
F7A F9A 1.678(19) . ?
F8B F8A 0.773(16) . ?
F9B F9A 0.871(19) . ?
O9 C22 1.14(2) . ?
C23 C22 1.43(3) . ?
C22 C24 1.47(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 C2 C3 123.7(9) . . ?
O1 C2 C1 121.0(10) . . ?
C3 C2 C1 115.1(9) . . ?
C4 C3 C2 121.3(9) . . ?
O2 C4 C3 128.0(10) . . ?
O2 C4 C5 115.5(9) . . ?
C3 C4 C5 116.2(10) . . ?
F1 C5 F3 107.4(10) . . ?
F1 C5 F2B 95.5(12) . . ?
F3 C5 F2B 114.3(12) . . ?
F1 C5 F2A 121.7(13) . . ?
F3 C5 F2A 92.9(12) . . ?
F2B C5 F2A 28.8(10) . . ?
F1 C5 C4 111.8(10) . . ?
F3 C5 C4 114.4(10) . . ?
F2B C5 C4 111.8(11) . . ?
F2A C5 C4 107.5(11) . . ?
F6A C7 F4A 91.2(15) . . ?
F6A C7 F6B 48.8(13) . . ?
F4A C7 F6B 130.2(17) . . ?
F6A C7 F5B 124.7(17) . . ?
F4A C7 F5B 79.8(14) . . ?
F6B C7 F5B 98.6(19) . . ?
F6A C7 F5A 107.0(17) . . ?
F4A C7 F5A 114.4(16) . . ?
F6B C7 F5A 64.8(15) . . ?
F5B C7 F5A 37.9(12) . . ?
F6A C7 C8 123.6(15) . . ?
F4A C7 C8 113.6(14) . . ?
F6B C7 C8 113.7(16) . . ?
F5B C7 C8 109.7(15) . . ?
F5A C7 C8 106.8(14) . . ?
O4 C8 C9 127.0(10) . . ?
O4 C8 C7 119.6(11) . . ?
C9 C8 C7 113.1(11) . . ?
C8 C9 C10 122.5(10) . . ?
O3 C10 C9 123.1(9) . . ?
O3 C10 C11 120.1(10) . . ?
C9 C10 C11 116.4(10) . . ?
F9A C12 F8B 125.1(14) . . ?
F9A C12 F8A 118.1(15) . . ?
F8B C12 F8A 34.3(8) . . ?
F9A C12 F7A 80.8(12) . . ?
F8B C12 F7A 85.4(13) . . ?
F8A C12 F7A 118.4(13) . . ?
F9A C12 F9B 38.2(9) . . ?
F8B C12 F9B 118.4(14) . . ?
F8A C12 F9B 92.4(13) . . ?
F7A C12 F9B 118.4(12) . . ?
F9A C12 C13 118.5(13) . . ?
F8B C12 C13 116.4(11) . . ?
F8A C12 C13 111.7(10) . . ?
F7A C12 C13 105.4(11) . . ?
F9B C12 C13 110.3(12) . . ?
O6 C13 C14 128.4(9) . . ?
O6 C13 C12 113.1(8) . . ?
C14 C13 C12 118.5(8) . . ?
C13 C14 C15 123.0(8) . . ?
O5 C15 C14 123.3(8) . . ?
O5 C15 C16 117.5(8) . . ?
C14 C15 C16 119.2(8) . . ?
C2 O1 Dy1 132.0(6) . . ?
C4 O2 Dy1 131.7(6) . . ?
C10 O3 Dy1 133.6(6) . . ?
C8 O4 Dy1 133.7(7) . . ?
C15 O5 Dy1 137.1(5) . . ?
C13 O6 Dy1 133.4(6) . . ?
O2 Dy1 O4 88.7(2) . . ?
O2 Dy1 O5 145.9(2) . . ?
O4 Dy1 O5 82.3(2) . . ?
O2 Dy1 O6 141.66(19) . . ?
O4 Dy1 O6 99.3(2) . . ?
O5 Dy1 O6 72.5(2) . . ?
O2 Dy1 O7 95.7(2) . . ?
O4 Dy1 O7 144.0(2) . . ?
O5 Dy1 O7 74.2(2) . . ?
O6 Dy1 O7 99.0(2) . . ?
O2 Dy1 O3 73.4(2) . . ?
O4 Dy1 O3 72.1(2) . . ?
O5 Dy1 O3 132.9(2) . . ?
O6 Dy1 O3 73.6(2) . . ?
O7 Dy1 O3 143.2(2) . . ?
O2 Dy1 O1 71.95(19) . . ?
O4 Dy1 O1 72.8(2) . . ?
O5 Dy1 O1 73.9(2) . . ?
O6 Dy1 O1 146.2(2) . . ?
O7 Dy1 O1 74.8(2) . . ?
O3 Dy1 O1 130.5(2) . . ?
O2 Dy1 O8 78.1(2) . . ?
O4 Dy1 O8 146.6(2) . . ?
O5 Dy1 O8 124.8(2) . . ?
O6 Dy1 O8 74.8(2) . . ?
O7 Dy1 O8 68.5(2) . . ?
O3 Dy1 O8 74.8(2) . . ?
O1 Dy1 O8 129.3(2) . . ?
F2A F2B C5 82(3) . . ?
C7 F4A F5B 53.1(11) . . ?
F5B F5A C7 68(2) . . ?
F5B F5A F6B 116(3) . . ?
C7 F5A F6B 54.6(14) . . ?
F5A F5B C7 74(2) . . ?
F5A F5B F4A 118(3) . . ?
C7 F5B F4A 47.2(11) . . ?
F6B F6A C7 70.8(17) . . ?
C12 F7A F9A 45.9(8) . . ?
F8A F8B C12 77.9(18) . . ?
F9A F9B C12 60.1(17) . . ?
F6A F6B C7 60.4(16) . . ?
F6A F6B F5A 113(3) . . ?
C7 F6B F5A 60.6(15) . . ?
F9B F9A C12 82(2) . . ?
F9B F9A F7A 134(2) . . ?
C12 F9A F7A 53.3(10) . . ?
F8B F8A C12 67.8(17) . . ?
F2B F2A C5 69(2) . . ?
O9 C22 C23 124(3) . . ?
O9 C22 C24 121(2) . . ?
C23 C22 C24 114(2) . . ?

_diffrn_measured_fraction_theta_max 0.998
_diffrn_reflns_theta_full        25.00
_diffrn_measured_fraction_theta_full 0.998
_refine_diff_density_max         1.137
_refine_diff_density_min         -1.053
_refine_diff_density_rms         0.139
_exptl_crystal_recrystallization_method 'Re-crystallisation from solvent: '
####################################################################### 
# 
# 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_123
_database_code_depnum_ccdc_archive 'CCDC 1037818'
_audit_update_record             
;
2014-12-05 deposited with the CCDC.
2015-10-30 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
;
 ?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C25 H20 Dy F9 N2 O6 '
_chemical_formula_sum            'C25 H20 Dy F9 N2 O6 '
_chemical_formula_weight         777.93

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

_symmetry_cell_setting           triclinic
_symmetry_space_group_name_H-M   'P -1'
_symmetry_space_group_name_Hall  '-P 1'

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

_cell_length_a                   12.286(5)
_cell_length_b                   15.177(5)
_cell_length_c                   17.897(5)
_cell_angle_alpha                93.487(5)
_cell_angle_beta                 107.140(5)
_cell_angle_gamma                111.979(5)
_cell_volume                     2901.5(17)
_cell_formula_units_Z            4
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    ?
_cell_measurement_theta_min      ?
_cell_measurement_theta_max      ?

_exptl_crystal_description       block
_exptl_crystal_colour            colorless
_exptl_crystal_size_max          0.3
_exptl_crystal_size_mid          0.21
_exptl_crystal_size_min          0.13
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.781
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1516
_exptl_absorpt_coefficient_mu    2.674
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.515
_exptl_absorpt_correction_T_max  0.706
_exptl_absorpt_process_details   sadabs(Sheldrick,1996)

_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      293(2)
_diffrn_radiation_wavelength     0.71069
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  ?
_diffrn_measurement_method       ?
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            21727
_diffrn_reflns_av_R_equivalents  0.0378
_diffrn_reflns_av_sigmaI/netI    0.0506
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_theta_min         3.34
_diffrn_reflns_theta_max         25.00
_reflns_number_total             10216
_reflns_number_gt                7768
_reflns_threshold_expression     >2sigma(I)

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

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

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.1565P)²+14.7801P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         10216
_refine_ls_number_parameters     759
_refine_ls_number_restraints     13
_refine_ls_R_factor_all          0.1035
_refine_ls_R_factor_gt           0.0832
_refine_ls_wR_factor_ref         0.2494
_refine_ls_wR_factor_gt          0.2177
_refine_ls_goodness_of_fit_ref   1.080
_refine_ls_restrained_S_all      1.079
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C -0.6546(14) 0.2700(15) 0.3448(12) 0.104(6) Uani 1 1 d . . .
H1A H -0.6569 0.2344 0.2978 0.156 Uiso 1 1 calc R . .
H1B H -0.6513 0.3325 0.3357 0.156 Uiso 1 1 calc R . .
H1C H -0.7284 0.2353 0.3571 0.156 Uiso 1 1 calc R . .
C2 C -0.5419(12) 0.2822(10) 0.4128(9) 0.066(4) Uani 1 1 d . . .
C3 C -0.5216(14) 0.3321(12) 0.4878(11) 0.081(4) Uani 1 1 d . . .
H3 H -0.5749 0.3608 0.4922 0.097 Uiso 1 1 calc R . .
C4 C -0.4242(13) 0.3402(10) 0.5557(10) 0.068(4) Uani 1 1 d . . .
C5 C -0.4173(18) 0.3904(14) 0.6325(13) 0.089(5) Uani 1 1 d . . .
C6 C -0.2877(17) 0.2050(13) 0.2001(9) 0.091(5) Uani 1 1 d . . .
H6A H -0.3413 0.2386 0.1889 0.136 Uiso 1 1 calc R . .
H6B H -0.3340 0.1386 0.1731 0.136 Uiso 1 1 calc R . .
H6C H -0.2188 0.2350 0.1819 0.136 Uiso 1 1 calc R . .
C7 C -0.2363(12) 0.2095(9) 0.2932(7) 0.057(3) Uani 1 1 d . . .
C8 C -0.1548(17) 0.1642(11) 0.3211(9) 0.078(4) Uani 1 1 d . . .
H8 H -0.1362 0.1312 0.2846 0.094 Uiso 1 1 calc R . .
C9 C -0.1008(13) 0.1680(9) 0.4032(9) 0.063(3) Uani 1 1 d . . .
C10 C -0.019(2) 0.1167(15) 0.4235(11) 0.091(5) Uani 1 1 d . . .
C11 C -0.2068(16) 0.5881(11) 0.4593(11) 0.092(5) Uani 1 1 d . . .
H11A H -0.2706 0.5637 0.4076 0.138 Uiso 1 1 calc R . .
H11B H -0.1318 0.6353 0.4551 0.138 Uiso 1 1 calc R . .
H11C H -0.2345 0.6177 0.4946 0.138 Uiso 1 1 calc R . .
C13 C -0.1802(12) 0.5034(9) 0.4927(9) 0.060(3) Uani 1 1 d . . .
C14 C -0.0909(12) 0.5233(9) 0.5679(8) 0.060(3) Uani 1 1 d . . .
H14 H -0.0545 0.5856 0.5981 0.072 Uiso 1 1 calc R . .
C15 C -0.0541(12) 0.4531(14) 0.5994(7) 0.073(3) Uani 1 1 d U . .
C17 C -0.0132(17) -0.0868(11) 0.8303(9) 0.086(5) Uani 1 1 d . . .
H17A H -0.0509 -0.0619 0.7866 0.128 Uiso 1 1 calc R . .
H17B H -0.0773 -0.1355 0.8436 0.128 Uiso 1 1 calc R . .
H17C H 0.0377 -0.1146 0.8153 0.128 Uiso 1 1 calc R . .
C18 C 0.0679(13) -0.0048(9) 0.9022(8) 0.061(3) Uani 1 1 d . . .
C19 C 0.1308(12) -0.0248(9) 0.9716(8) 0.062(3) Uani 1 1 d . . .
H19 H 0.1289 -0.0866 0.9716 0.074 Uiso 1 1 calc R . .
C20 C 0.1982(11) 0.0448(9) 1.0428(7) 0.051(3) Uani 1 1 d . . .
C31 C -0.1630(19) 0.2955(17) 0.8543(15) 0.134(9) Uani 1 1 d . . .
H31A H -0.1309 0.3272 0.8158 0.201 Uiso 1 1 calc R . .
H31B H -0.2052 0.3290 0.8731 0.201 Uiso 1 1 calc R . .
H31C H -0.2207 0.2298 0.8300 0.201 Uiso 1 1 calc R . .
C32 C -0.0457(13) 0.2961(10) 0.9304(11) 0.075(4) Uani 1 1 d . . .
C33 C -0.0221(17) 0.3386(12) 1.0083(12) 0.089(5) Uani 1 1 d . . .
H33 H -0.0673 0.3725 1.0181 0.106 Uiso 1 1 calc R . .
C34 C 0.0708(13) 0.3295(10) 1.0718(10) 0.067(4) Uani 1 1 d . . .
C36 C 0.200(2) 0.2276(18) 0.7045(10) 0.132(9) Uani 1 1 d . . .
H36A H 0.1480 0.2622 0.6978 0.199 Uiso 1 1 calc R . .
H36B H 0.1548 0.1650 0.6701 0.199 Uiso 1 1 calc R . .
H36C H 0.2728 0.2632 0.6912 0.199 Uiso 1 1 calc R . .
C37 C 0.2421(14) 0.2149(10) 0.7932(8) 0.073(4) Uani 1 1 d . . .
C38 C 0.3197(17) 0.1660(13) 0.8139(9) 0.090(5) Uani 1 1 d . . .
H38 H 0.3372 0.1368 0.7744 0.107 Uiso 1 1 calc R . .
C39 C 0.3702(14) 0.1606(10) 0.8916(12) 0.079(5) Uani 1 1 d . . .
C40 C 0.4576(18) 0.1101(15) 0.9116(19) 0.124(10) Uani 1 1 d . . .
C41 C -0.1720(13) 0.1943(11) 0.6445(7) 0.077(4) Uani 1 1 d . . .
H41 H -0.1434 0.2603 0.6632 0.093 Uiso 1 1 calc R . .
C42 C -0.1390(13) 0.1341(13) 0.6944(8) 0.086(5) Uani 1 1 d . . .
H42 H -0.0892 0.1600 0.7475 0.104 Uiso 1 1 calc R . .
C43 C -0.1785(19) 0.0390(14) 0.6663(10) 0.092(5) Uani 1 1 d . . .
H43 H -0.1521 0.0015 0.7004 0.111 Uiso 1 1 calc R . .
C44 C -0.2539(15) -0.0037(12) 0.5915(9) 0.079(4) Uani 1 1 d . . .
H44 H -0.2816 -0.0697 0.5733 0.094 Uiso 1 1 calc R . .
C45 C -0.2902(11) 0.0578(8) 0.5404(7) 0.048(3) Uani 1 1 d . . .
C46 C -0.3745(10) 0.0190(8) 0.4583(7) 0.047(2) Uani 1 1 d . . .
C47 C -0.4365(15) -0.0798(9) 0.4268(9) 0.075(4) Uani 1 1 d . . .
H47 H -0.4245 -0.1242 0.4584 0.090 Uiso 1 1 calc R . .
C48 C -0.5160(16) -0.1118(10) 0.3484(10) 0.089(5) Uani 1 1 d . . .
H48 H -0.5560 -0.1773 0.3253 0.106 Uiso 1 1 calc R . .
C49 C -0.5336(13) -0.0420(9) 0.3056(8) 0.069(3) Uani 1 1 d . . .
H49 H -0.5862 -0.0605 0.2527 0.082 Uiso 1 1 calc R . .
C50 C -0.4765(11) 0.0494(9) 0.3394(8) 0.062(3) Uani 1 1 d . . .
H50 H -0.4932 0.0936 0.3093 0.074 Uiso 1 1 calc R . .
C51 C 0.4504(11) 0.3077(11) 1.1411(7) 0.072(4) Uani 1 1 d . . .
H51 H 0.4307 0.2417 1.1315 0.087 Uiso 1 1 calc R . .
C52 C 0.5383(14) 0.3685(13) 1.2155(8) 0.084(5) Uani 1 1 d . . .
H52 H 0.5752 0.3421 1.2558 0.101 Uiso 1 1 calc R . .
C53 C 0.5660(15) 0.4603(12) 1.2262(10) 0.083(5) Uani 1 1 d . . .
H53 H 0.6268 0.4989 1.2738 0.100 Uiso 1 1 calc R . .
C55 C 0.5140(11) 0.5027(11) 1.1741(8) 0.069(4) Uani 1 1 d . . .
H55 H 0.5322 0.5683 1.1858 0.083 Uiso 1 1 calc R . .
C56 C 0.4264(9) 0.4427(8) 1.0974(6) 0.044(2) Uani 1 1 d . . .
C57 C 0.3657(10) 0.4814(8) 1.0326(7) 0.046(2) Uani 1 1 d . . .
C58 C 0.4027(14) 0.5804(9) 1.0348(9) 0.076(4) Uani 1 1 d . . .
H58 H 0.4669 0.6248 1.0787 0.091 Uiso 1 1 calc R . .
C59 C 0.3421(15) 0.6120(10) 0.9701(10) 0.081(4) Uani 1 1 d . . .
H59 H 0.3645 0.6777 0.9701 0.097 Uiso 1 1 calc R . .
C60 C 0.2492(13) 0.5438(9) 0.9071(8) 0.066(3) Uani 1 1 d . . .
H60 H 0.2047 0.5628 0.8643 0.079 Uiso 1 1 calc R . .
C61 C 0.2219(12) 0.4496(9) 0.9066(7) 0.062(3) Uani 1 1 d . . .
H61 H 0.1620 0.4052 0.8613 0.074 Uiso 1 1 calc R . .
C64 C 0.0365(14) 0.4856(9) 0.6848(8) 0.068(4) Uani 1 1 d . . .
C66 C 0.2684(13) 0.0128(9) 1.1138(11) 0.080(5) Uani 1 1 d . . .
C70 C 0.096(3) 0.3834(19) 1.1496(15) 0.133(8) Uani 1 1 d DU . .
N1 N 0.3958(8) 0.3498(6) 1.0840(5) 0.047(2) Uani 1 1 d . . .
N2 N 0.2745(8) 0.4163(7) 0.9663(5) 0.048(2) Uani 1 1 d . . .
N3 N -0.3973(8) 0.0838(7) 0.4127(5) 0.047(2) Uani 1 1 d . . .
N4 N -0.2490(9) 0.1521(7) 0.5661(5) 0.049(2) Uani 1 1 d . . .
O1 O -0.2358(7) 0.4225(5) 0.4468(5) 0.056(2) Uani 1 1 d . . .
O2 O -0.0875(7) 0.3679(5) 0.5696(5) 0.055(2) Uani 1 1 d . . .
O3 O -0.1169(7) 0.2098(6) 0.4562(5) 0.0541(19) Uani 1 1 d . . .
O4 O -0.2743(8) 0.2510(6) 0.3346(4) 0.0527(19) Uani 1 1 d . . .
O5 O -0.4724(7) 0.2468(6) 0.3984(5) 0.061(2) Uani 1 1 d . . .
O6 O -0.3433(7) 0.3075(6) 0.5606(5) 0.0545(19) Uani 1 1 d . . .
O7 O 0.0097(7) 0.2514(6) 0.9065(5) 0.058(2) Uani 1 1 d . . .
O8 O 0.1362(8) 0.2872(6) 1.0669(5) 0.058(2) Uani 1 1 d . . .
O9 O 0.2036(8) 0.2507(6) 0.8389(5) 0.064(2) Uani 1 1 d . . .
O10 O 0.3544(8) 0.1943(6) 0.9530(5) 0.059(2) Uani 1 1 d . . .
O11 O 0.0712(8) 0.0787(6) 0.8946(5) 0.056(2) Uani 1 1 d . . .
O12 O 0.2136(8) 0.1313(5) 1.0563(4) 0.0549(19) Uani 1 1 d . . .
F1A F -0.343(3) 0.374(2) 0.6956(17) 0.133(8) Uiso 0.50 1 d P . .
F1B F -0.292(4) 0.457(3) 0.673(3) 0.208(16) Uiso 0.50 1 d P . .
F2A F -0.472(3) 0.449(2) 0.6267(17) 0.134(8) Uiso 0.50 1 d P . .
F2B F -0.524(3) 0.365(2) 0.6442(19) 0.146(9) Uiso 0.50 1 d P . .
F3A F -0.371(3) 0.487(2) 0.6369(17) 0.139(9) Uiso 0.50 1 d P . .
F3B F -0.446(5) 0.340(3) 0.681(3) 0.198(15) Uiso 0.50 1 d P . .
F7A F -0.0246(16) 0.4473(13) 0.7335(10) 0.078(4) Uiso 0.50 1 d P . .
F7B F 0.020(3) 0.419(2) 0.7273(18) 0.141(10) Uiso 0.50 1 d P . .
F8 F 0.0786(15) 0.5756(12) 0.7164(9) 0.162(5) Uiso 1 1 d . . .
F9A F 0.120(2) 0.4433(18) 0.6953(14) 0.108(6) Uiso 0.50 1 d P . .
F9B F 0.151(3) 0.500(2) 0.6848(18) 0.149(10) Uiso 0.50 1 d P . .
F10A F 0.079(3) 0.165(2) 0.4800(19) 0.128(8) Uiso 0.50 1 d P . .
F10B F 0.014(4) 0.116(3) 0.500(2) 0.168(12) Uiso 0.50 1 d P . .
F11A F 0.001(3) 0.074(2) 0.3657(18) 0.133(9) Uiso 0.50 1 d P . .
F11B F -0.064(3) 0.033(3) 0.376(2) 0.150(11) Uiso 0.50 1 d P . .
F12A F -0.072(3) 0.044(2) 0.4562(19) 0.137(9) Uiso 0.50 1 d P . .
F12B F 0.082(4) 0.161(3) 0.404(3) 0.200(15) Uiso 0.50 1 d P . .
F13A F 0.561(4) 0.161(3) 0.951(3) 0.183(14) Uiso 0.50 1 d P . .
F13B F 0.547(4) 0.156(3) 0.879(3) 0.180(13) Uiso 0.50 1 d P . .
F14A F 0.450(2) 0.059(2) 0.8437(15) 0.117(7) Uiso 0.50 1 d P . .
F14B F 0.521(4) 0.130(3) 0.988(2) 0.155(12) Uiso 0.50 1 d P . .
F15A F 0.421(3) 0.042(2) 0.951(2) 0.144(10) Uiso 0.50 1 d P . .
F15B F 0.400(3) 0.019(3) 0.874(2) 0.159(11) Uiso 0.50 1 d P . .
F16A F 0.2629(18) -0.0809(13) 1.0942(11) 0.085(5) Uiso 0.50 1 d P . .
F16B F 0.221(2) -0.0720(18) 1.1225(15) 0.117(7) Uiso 0.50 1 d P . .
F17A F 0.381(3) 0.080(2) 1.1548(19) 0.141(10) Uiso 0.50 1 d P . .
F17B F 0.3924(17) 0.0505(14) 1.1189(11) 0.084(5) Uiso 0.50 1 d P . .
F18A F 0.213(3) 0.005(2) 1.1706(18) 0.138(9) Uiso 0.50 1 d P . .
F18B F 0.276(2) 0.0619(19) 1.1844(15) 0.112(7) Uiso 0.50 1 d P . .
F97 F 0.022(3) 0.427(2) 1.138(2) 0.322(16) Uiso 1 1 d D . .
F98 F 0.072(3) 0.322(2) 1.1936(19) 0.323(16) Uiso 1 1 d D . .
F99 F 0.208(3) 0.444(3) 1.188(3) 0.53(3) Uiso 1 1 d D . .
Dy1A Dy -0.26628(4) 0.26413(3) 0.46669(3) 0.0366(2) Uani 0.90 1 d P . .
Dy1B Dy -0.2080(7) 0.2581(6) 0.5332(3) 0.0675(19) Uani 0.10 1 d PU . .
Dy2A Dy 0.19791(5) 0.23573(3) 0.96821(3) 0.0367(2) Uani 0.90 1 d P . .
Dy2B Dy 0.2694(8) 0.2397(7) 1.0316(3) 0.086(3) Uani 0.10 1 d P . .


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

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
C1 C2 1.49(2) . ?
C2 O5 1.242(15) . ?
C2 C3 1.40(2) . ?
C3 C4 1.39(2) . ?
C4 O6 1.251(15) . ?
C4 C5 1.49(2) . ?
C5 F3B 1.23(5) . ?
C5 F2A 1.30(3) . ?
C5 F2B 1.30(3) . ?
C5 F1A 1.33(3) . ?
C5 F3A 1.34(3) . ?
C5 F1B 1.42(5) . ?
C6 C7 1.586(19) . ?
C7 O4 1.236(14) . ?
C7 C8 1.41(2) . ?
C8 C9 1.41(2) . ?
C9 O3 1.213(15) . ?
C9 C10 1.46(2) . ?
C10 F10A 1.24(3) . ?
C10 F11B 1.31(4) . ?
C10 F10B 1.31(4) . ?
C10 F11A 1.32(3) . ?
C10 F12B 1.33(4) . ?
C10 F12A 1.33(3) . ?
C11 C13 1.553(18) . ?
C13 O1 1.252(14) . ?
C13 C14 1.393(18) . ?
C14 C15 1.39(2) . ?
C15 O2 1.230(19) . ?
C15 C64 1.521(18) . ?
C15 Dy1B 2.79(2) . ?
C17 C18 1.523(19) . ?
C18 O11 1.268(14) . ?
C18 C19 1.375(19) . ?
C19 C20 1.408(18) . ?
C20 O12 1.252(14) . ?
C20 C66 1.528(18) . ?
C20 Dy2B 2.792(14) . ?
C31 C32 1.66(2) . ?
C32 O7 1.262(17) . ?
C32 C33 1.40(2) . ?
C33 C34 1.41(2) . ?
C34 O8 1.219(15) . ?
C34 C70 1.46(3) . ?
C36 C37 1.57(2) . ?
C37 O9 1.248(16) . ?
C37 C38 1.40(2) . ?
C38 C39 1.37(2) . ?
C39 O10 1.280(17) . ?
C39 C40 1.51(3) . ?
C40 F13A 1.18(5) . ?
C40 F15A 1.30(4) . ?
C40 F14B 1.30(4) . ?
C40 F15B 1.32(4) . ?
C40 F14A 1.36(3) . ?
C40 F13B 1.37(5) . ?
C41 N4 1.388(14) . ?
C41 C42 1.40(2) . ?
C41 Dy1B 2.266(13) . ?
C42 C43 1.35(2) . ?
C43 C44 1.34(2) . ?
C44 C45 1.443(17) . ?
C45 N4 1.325(15) . ?
C45 C46 1.456(16) . ?
C45 Dy1B 2.847(14) . ?
C46 N3 1.371(14) . ?
C46 C47 1.392(17) . ?
C47 C48 1.38(2) . ?
C48 C49 1.39(2) . ?
C49 C50 1.304(18) . ?
C50 N3 1.313(15) . ?
C51 N1 1.377(14) . ?
C51 C52 1.431(19) . ?
C51 Dy2B 2.305(13) . ?
C52 C53 1.29(2) . ?
C53 C55 1.31(2) . ?
C55 C56 1.455(16) . ?
C56 N1 1.303(14) . ?
C56 C57 1.465(16) . ?
C56 Dy2B 2.893(15) . ?
C57 N2 1.372(14) . ?
C57 C58 1.391(16) . ?
C58 C59 1.40(2) . ?
C59 C60 1.365(19) . ?
C60 C61 1.340(17) . ?
C61 N2 1.310(15) . ?
C64 F8 1.288(19) . ?
C64 F7B 1.29(3) . ?
C64 F7A 1.33(2) . ?
C64 F9B 1.34(3) . ?
C64 F9A 1.38(3) . ?
C66 F16B 1.24(3) . ?
C66 F17A 1.32(3) . ?
C66 F18A 1.37(3) . ?
C66 F17B 1.38(2) . ?
C66 F18B 1.39(3) . ?
C66 F16A 1.42(2) . ?
C70 F98 1.260(18) . ?
C70 F99 1.28(2) . ?
C70 F97 1.288(18) . ?
N1 Dy2B 1.758(13) . ?
N1 Dy2A 2.578(8) . ?
N2 Dy2A 2.549(9) . ?
N3 Dy1A 2.546(9) . ?
N4 Dy1B 1.695(11) . ?
N4 Dy1A 2.553(9) . ?
O1 Dy1A 2.357(8) . ?
O2 Dy1B 1.688(11) . ?
O2 Dy1A 2.318(7) . ?
O3 Dy1B 2.258(9) . ?
O3 Dy1A 2.325(8) . ?
O4 Dy1A 2.331(7) . ?
O5 Dy1A 2.369(8) . ?
O6 Dy1B 2.221(9) . ?
O6 Dy1A 2.328(8) . ?
O7 Dy2A 2.358(8) . ?
O8 Dy2B 2.243(9) . ?
O8 Dy2A 2.317(8) . ?
O9 Dy2A 2.357(8) . ?
O10 Dy2B 2.198(9) . ?
O10 Dy2A 2.315(8) . ?
O11 Dy2A 2.339(8) . ?
O12 Dy2B 1.672(11) . ?
O12 Dy2A 2.321(7) . ?
F1A F3B 1.11(5) . ?
F1A F1B 1.32(5) . ?
F1B F3A 1.25(4) . ?
F2A F3A 1.10(3) . ?
F2A F2B 1.30(4) . ?
F2B F3B 1.19(5) . ?
F7A F7B 0.84(3) . ?
F7B F9A 1.44(4) . ?
F9A F9B 0.86(3) . ?
F10A F10B 1.03(4) . ?
F10A F12B 1.36(5) . ?
F10B F12A 1.22(4) . ?
F11A F11B 0.89(4) . ?
F11A F12B 1.30(5) . ?
F11B F12A 1.48(4) . ?
F13A F14B 0.98(5) . ?
F13A F13B 1.24(5) . ?
F13B F14A 1.46(4) . ?
F14A F15B 0.99(4) . ?
F14B F15A 1.38(5) . ?
F15A F15B 1.34(4) . ?
F16A F16B 0.86(3) . ?
F16B F18A 1.46(3) . ?
F17A F17B 0.83(3) . ?
F17A F18B 1.48(4) . ?
F18A F18B 0.88(3) . ?
Dy1A Dy1B 1.224(5) . ?
Dy2A Dy2B 1.194(5) . ?

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
O5 C2 C3 124.8(13) . . ?
O5 C2 C1 116.6(15) . . ?
C3 C2 C1 118.5(13) . . ?
C4 C3 C2 122.2(13) . . ?
O6 C4 C3 127.5(14) . . ?
O6 C4 C5 115.6(15) . . ?
C3 C4 C5 116.9(14) . . ?
F3B C5 F2A 108(3) . . ?
F3B C5 F2B 56(2) . . ?
F2A C5 F2B 60.1(19) . . ?
F3B C5 F1A 51(2) . . ?
F2A C5 F1A 131(2) . . ?
F2B C5 F1A 105(2) . . ?
F3B C5 F3A 132(3) . . ?
F2A C5 F3A 49.2(17) . . ?
F2B C5 F3A 107(2) . . ?
F1A C5 F3A 107(2) . . ?
F3B C5 F1B 105(3) . . ?
F2A C5 F1B 100(3) . . ?
F2B C5 F1B 137(3) . . ?
F1A C5 F1B 58(2) . . ?
F3A C5 F1B 54(2) . . ?
F3B C5 C4 117(3) . . ?
F2A C5 C4 116(2) . . ?
F2B C5 C4 115(2) . . ?
F1A C5 C4 112.5(17) . . ?
F3A C5 C4 110.5(19) . . ?
F1B C5 C4 109(2) . . ?
O4 C7 C8 126.0(11) . . ?
O4 C7 C6 116.3(12) . . ?
C8 C7 C6 117.6(12) . . ?
C9 C8 C7 121.4(12) . . ?
O3 C9 C8 125.2(13) . . ?
O3 C9 C10 119.3(14) . . ?
C8 C9 C10 115.5(13) . . ?
F10A C10 F11B 135(3) . . ?
F10A C10 F10B 47.7(19) . . ?
F11B C10 F10B 116(3) . . ?
F10A C10 F11A 112(2) . . ?
F11B C10 F11A 39.5(17) . . ?
F10B C10 F11A 131(3) . . ?
F10A C10 F12B 64(2) . . ?
F11B C10 F12B 98(3) . . ?
F10B C10 F12B 110(3) . . ?
F11A C10 F12B 59(2) . . ?
F10A C10 F12A 100(2) . . ?
F11B C10 F12A 68(2) . . ?
F10B C10 F12A 55(2) . . ?
F11A C10 F12A 103(2) . . ?
F12B C10 F12A 142(3) . . ?
F10A C10 C9 112(2) . . ?
F11B C10 C9 113(2) . . ?
F10B C10 C9 109(2) . . ?
F11A C10 C9 119(2) . . ?
F12B C10 C9 110(2) . . ?
F12A C10 C9 108.0(19) . . ?
O1 C13 C14 124.8(12) . . ?
O1 C13 C11 116.4(13) . . ?
C14 C13 C11 118.6(12) . . ?
C13 C14 C15 122.2(12) . . ?
O2 C15 C14 129.8(12) . . ?
O2 C15 C64 115.2(13) . . ?
C14 C15 C64 114.9(15) . . ?
O2 C15 Dy1B 19.8(6) . . ?
C14 C15 Dy1B 118.8(9) . . ?
C64 C15 Dy1B 121.9(10) . . ?
O11 C18 C19 123.6(12) . . ?
O11 C18 C17 117.4(13) . . ?
C19 C18 C17 119.0(12) . . ?
C18 C19 C20 122.5(11) . . ?
O12 C20 C19 129.6(11) . . ?
O12 C20 C66 114.1(11) . . ?
C19 C20 C66 116.3(11) . . ?
O12 C20 Dy2B 20.0(5) . . ?
C19 C20 Dy2B 117.8(8) . . ?
C66 C20 Dy2B 121.7(8) . . ?
O7 C32 C33 128.5(14) . . ?
O7 C32 C31 110.1(16) . . ?
C33 C32 C31 121.4(14) . . ?
C32 C33 C34 119.3(13) . . ?
O8 C34 C33 126.7(14) . . ?
O8 C34 C70 118.0(17) . . ?
C33 C34 C70 115.1(15) . . ?
O9 C37 C38 126.2(14) . . ?
O9 C37 C36 116.4(17) . . ?
C38 C37 C36 117.4(15) . . ?
C39 C38 C37 120.8(14) . . ?
O10 C39 C38 128.1(15) . . ?
O10 C39 C40 113.0(19) . . ?
C38 C39 C40 118.9(18) . . ?
F13A C40 F15A 106(4) . . ?
F13A C40 F14B 46(3) . . ?
F15A C40 F14B 64(3) . . ?
F13A C40 F15B 134(3) . . ?
F15A C40 F15B 61(2) . . ?
F14B C40 F15B 119(4) . . ?
F13A C40 F14A 112(3) . . ?
F15A C40 F14A 102(2) . . ?
F14B C40 F14A 138(3) . . ?
F15B C40 F14A 43.4(17) . . ?
F13A C40 F13B 58(3) . . ?
F15A C40 F13B 145(3) . . ?
F14B C40 F13B 103(3) . . ?
F15B C40 F13B 106(3) . . ?
F14A C40 F13B 64(2) . . ?
F13A C40 C39 115(3) . . ?
F15A C40 C39 111(2) . . ?
F14B C40 C39 112(2) . . ?
F15B C40 C39 111(2) . . ?
F14A C40 C39 110(2) . . ?
F13B C40 C39 104(3) . . ?
N4 C41 C42 117.7(13) . . ?
N4 C41 Dy1B 48.3(6) . . ?
C42 C41 Dy1B 158.4(13) . . ?
C43 C42 C41 120.8(14) . . ?
C44 C43 C42 122.8(15) . . ?
C43 C44 C45 116.6(16) . . ?
N4 C45 C44 121.6(12) . . ?
N4 C45 C46 116.9(10) . . ?
C44 C45 C46 121.5(12) . . ?
N4 C45 Dy1B 22.1(5) . . ?
C44 C45 Dy1B 138.8(10) . . ?
C46 C45 Dy1B 98.0(7) . . ?
N3 C46 C47 119.8(11) . . ?
N3 C46 C45 117.4(10) . . ?
C47 C46 C45 122.7(11) . . ?
C48 C47 C46 119.7(13) . . ?
C47 C48 C49 117.2(13) . . ?
C50 C49 C48 120.3(14) . . ?
C49 C50 N3 125.0(13) . . ?
N1 C51 C52 118.1(13) . . ?
N1 C51 Dy2B 49.5(5) . . ?
C52 C51 Dy2B 159.4(12) . . ?
C53 C52 C51 119.5(14) . . ?
C52 C53 C55 124.2(14) . . ?
C53 C55 C56 117.2(14) . . ?
N1 C56 C55 120.5(11) . . ?
N1 C56 C57 116.6(9) . . ?
C55 C56 C57 122.9(11) . . ?
N1 C56 Dy2B 22.2(5) . . ?
C55 C56 Dy2B 137.9(9) . . ?
C57 C56 Dy2B 97.2(7) . . ?
N2 C57 C58 120.2(11) . . ?
N2 C57 C56 117.6(10) . . ?
C58 C57 C56 122.1(11) . . ?
C57 C58 C59 119.0(13) . . ?
C60 C59 C58 118.1(12) . . ?
C61 C60 C59 120.1(13) . . ?
N2 C61 C60 123.9(12) . . ?
F8 C64 F7B 121.4(19) . . ?
F8 C64 F7A 98.4(14) . . ?
F7B C64 F7A 37.1(14) . . ?
F8 C64 F9B 89.1(17) . . ?
F7B C64 F9B 100(2) . . ?
F7A C64 F9B 132(2) . . ?
F8 C64 F9A 118.1(17) . . ?
F7B C64 F9A 65.3(18) . . ?
F7A C64 F9A 101.7(16) . . ?
F9B C64 F9A 37.1(15) . . ?
F8 C64 C15 116.9(15) . . ?
F7B C64 C15 114.2(18) . . ?
F7A C64 C15 109.3(13) . . ?
F9B C64 C15 109.2(17) . . ?
F9A C64 C15 110.1(14) . . ?
F16B C66 F17A 128(2) . . ?
F16B C66 F18A 67.9(17) . . ?
F17A C66 F18A 100(2) . . ?
F16B C66 F17B 117.7(17) . . ?
F17A C66 F17B 35.8(13) . . ?
F18A C66 F17B 132(2) . . ?
F16B C66 F18B 100(2) . . ?
F17A C66 F18B 66.1(18) . . ?
F18A C66 F18B 37.1(15) . . ?
F17B C66 F18B 101.4(17) . . ?
F16B C66 F16A 36.9(12) . . ?
F17A C66 F16A 115.0(19) . . ?
F18A C66 F16A 104.0(17) . . ?
F17B C66 F16A 88.3(14) . . ?
F18B C66 F16A 130.7(18) . . ?
F16B C66 C20 118.9(17) . . ?
F17A C66 C20 113.2(16) . . ?
F18A C66 C20 109.9(16) . . ?
F17B C66 C20 106.8(14) . . ?
F18B C66 C20 110.0(14) . . ?
F16A C66 C20 113.0(15) . . ?
F98 C70 F99 105(3) . . ?
F98 C70 F97 112(3) . . ?
F99 C70 F97 110(3) . . ?
F98 C70 C34 107(2) . . ?
F99 C70 C34 118(3) . . ?
F97 C70 C34 106(2) . . ?
C56 N1 C51 120.4(9) . . ?
C56 N1 Dy2B 141.5(8) . . ?
C51 N1 Dy2B 93.9(8) . . ?
C56 N1 Dy2A 120.8(7) . . ?
C51 N1 Dy2A 117.1(7) . . ?
Dy2B N1 Dy2A 23.5(2) . . ?
C61 N2 C57 118.5(10) . . ?
C61 N2 Dy2A 121.9(8) . . ?
C57 N2 Dy2A 119.3(7) . . ?
C50 N3 C46 118.0(10) . . ?
C50 N3 Dy1A 122.6(8) . . ?
C46 N3 Dy1A 119.0(7) . . ?
C45 N4 C41 120.6(10) . . ?
C45 N4 Dy1B 140.7(8) . . ?
C41 N4 Dy1B 94.1(8) . . ?
C45 N4 Dy1A 120.2(7) . . ?
C41 N4 Dy1A 117.7(8) . . ?
Dy1B N4 Dy1A 24.2(3) . . ?
C13 O1 Dy1A 133.1(8) . . ?
C15 O2 Dy1B 145.9(9) . . ?
C15 O2 Dy1A 130.4(8) . . ?
Dy1B O2 Dy1A 30.8(2) . . ?
C9 O3 Dy1B 162.5(9) . . ?
C9 O3 Dy1A 136.0(9) . . ?
Dy1B O3 Dy1A 30.94(16) . . ?
C7 O4 Dy1A 135.2(8) . . ?
C2 O5 Dy1A 134.4(9) . . ?
C4 O6 Dy1B 163.1(9) . . ?
C4 O6 Dy1A 132.3(9) . . ?
Dy1B O6 Dy1A 31.10(16) . . ?
C32 O7 Dy2A 132.8(10) . . ?
C34 O8 Dy2B 162.4(10) . . ?
C34 O8 Dy2A 136.5(10) . . ?
Dy2B O8 Dy2A 30.31(17) . . ?
C37 O9 Dy2A 134.2(10) . . ?
C39 O10 Dy2B 162.3(10) . . ?
C39 O10 Dy2A 132.4(10) . . ?
Dy2B O10 Dy2A 30.55(17) . . ?
C18 O11 Dy2A 134.9(9) . . ?
C20 O12 Dy2B 145.1(8) . . ?
C20 O12 Dy2A 129.5(7) . . ?
Dy2B O12 Dy2A 29.5(3) . . ?
F3B F1A F1B 119(4) . . ?
F3B F1A C5 60(3) . . ?
F1B F1A C5 65(3) . . ?
F3A F1B F1A 113(4) . . ?
F3A F1B C5 60(3) . . ?
F1A F1B C5 58(2) . . ?
F3A F2A C5 68(2) . . ?
F3A F2A F2B 124(3) . . ?
C5 F2A F2B 60(2) . . ?
F3B F2B C5 59(3) . . ?
F3B F2B F2A 111(4) . . ?
C5 F2B F2A 60(2) . . ?
F2A F3A F1B 124(4) . . ?
F2A F3A C5 63(2) . . ?
F1B F3A C5 66(3) . . ?
F1A F3B F2B 129(5) . . ?
F1A F3B C5 69(3) . . ?
F2B F3B C5 65(3) . . ?
F7B F7A C64 69(3) . . ?
F7A F7B C64 74(3) . . ?
F7A F7B F9A 133(4) . . ?
C64 F7B F9A 60.1(18) . . ?
F9B F9A C64 69(3) . . ?
F9B F9A F7B 119(4) . . ?
C64 F9A F7B 54.6(16) . . ?
F9A F9B C64 74(3) . . ?
F10B F10A C10 70(3) . . ?
F10B F10A F12B 128(4) . . ?
C10 F10A F12B 61(2) . . ?
F10A F10B F12A 122(4) . . ?
F10A F10B C10 63(3) . . ?
F12A F10B C10 63(3) . . ?
F11B F11A F12B 130(5) . . ?
F11B F11A C10 69(3) . . ?
F12B F11A C10 61(2) . . ?
F11A F11B C10 71(3) . . ?
F11A F11B F12A 120(4) . . ?
C10 F11B F12A 57(2) . . ?
F10B F12A C10 62(2) . . ?
F10B F12A F11B 111(3) . . ?
C10 F12A F11B 55.3(19) . . ?
F11A F12B C10 60(2) . . ?
F11A F12B F10A 106(4) . . ?
C10 F12B F10A 55(2) . . ?
F14B F13A C40 74(4) . . ?
F14B F13A F13B 142(6) . . ?
C40 F13A F13B 69(4) . . ?
F13A F13B C40 53(3) . . ?
F13A F13B F14A 103(4) . . ?
C40 F13B F14A 57(2) . . ?
F15B F14A C40 66(3) . . ?
F15B F14A F13B 123(4) . . ?
C40 F14A F13B 58(2) . . ?
F13A F14B C40 60(4) . . ?
F13A F14B F15A 113(5) . . ?
C40 F14B F15A 58(3) . . ?
C40 F15A F15B 60(2) . . ?
C40 F15A F14B 58(2) . . ?
F15B F15A F14B 113(3) . . ?
F14A F15B C40 70(3) . . ?
F14A F15B F15A 125(4) . . ?
C40 F15B F15A 59(2) . . ?
F16B F16A C66 60(2) . . ?
F16A F16B C66 83(3) . . ?
F16A F16B F18A 142(3) . . ?
C66 F16B F18A 60.4(18) . . ?
F17B F17A C66 76(3) . . ?
F17B F17A F18B 134(4) . . ?
C66 F17A F18B 59.0(18) . . ?
F17A F17B C66 68(3) . . ?
F18B F18A C66 72(3) . . ?
F18B F18A F16B 117(4) . . ?
C66 F18A F16B 51.8(15) . . ?
F18A F18B C66 70(3) . . ?
F18A F18B F17A 121(4) . . ?
C66 F18B F17A 54.9(16) . . ?
Dy1B Dy1A O2 44.8(4) . . ?
Dy1B Dy1A O3 71.5(3) . . ?
O2 Dy1A O3 76.9(3) . . ?
Dy1B Dy1A O6 69.6(3) . . ?
O2 Dy1A O6 76.5(3) . . ?
O3 Dy1A O6 141.1(3) . . ?
Dy1B Dy1A O4 143.2(3) . . ?
O2 Dy1A O4 121.6(3) . . ?
O3 Dy1A O4 71.9(3) . . ?
O6 Dy1A O4 147.0(3) . . ?
Dy1B Dy1A O1 115.4(4) . . ?
O2 Dy1A O1 73.5(3) . . ?
O3 Dy1A O1 117.6(3) . . ?
O6 Dy1A O1 80.9(3) . . ?
O4 Dy1A O1 79.1(3) . . ?
Dy1B Dy1A O5 136.4(4) . . ?
O2 Dy1A O5 140.0(3) . . ?
O3 Dy1A O5 142.1(3) . . ?
O6 Dy1A O5 72.2(3) . . ?
O4 Dy1A O5 78.0(3) . . ?
O1 Dy1A O5 77.5(3) . . ?
Dy1B Dy1A N3 97.6(4) . . ?
O2 Dy1A N3 140.1(3) . . ?
O3 Dy1A N3 78.1(3) . . ?
O6 Dy1A N3 106.0(3) . . ?
O4 Dy1A N3 78.2(3) . . ?
O1 Dy1A N3 146.2(3) . . ?
O5 Dy1A N3 73.6(3) . . ?
Dy1B Dy1A N4 34.6(4) . . ?
O2 Dy1A N4 79.4(3) . . ?
O3 Dy1A N4 72.2(3) . . ?
O6 Dy1A N4 75.3(3) . . ?
O4 Dy1A N4 131.7(3) . . ?
O1 Dy1A N4 147.3(3) . . ?
O5 Dy1A N4 114.9(3) . . ?
N3 Dy1A N4 63.6(3) . . ?
Dy1A Dy1B O2 104.4(5) . . ?
Dy1A Dy1B N4 121.2(6) . . ?
O2 Dy1B N4 134.2(5) . . ?
Dy1A Dy1B O6 79.3(3) . . ?
O2 Dy1B O6 93.8(4) . . ?
N4 Dy1B O6 98.5(5) . . ?
Dy1A Dy1B O3 77.6(3) . . ?
O2 Dy1B O3 93.0(5) . . ?
N4 Dy1B O3 92.5(5) . . ?
O6 Dy1B O3 156.8(4) . . ?
Dy1A Dy1B C41 157.2(7) . . ?
O2 Dy1B C41 97.8(5) . . ?
N4 Dy1B C41 37.7(5) . . ?
O6 Dy1B C41 94.1(5) . . ?
O3 Dy1B C41 106.8(5) . . ?
Dy1A Dy1B C15 100.9(5) . . ?
O2 Dy1B C15 14.3(4) . . ?
N4 Dy1B C15 137.0(5) . . ?
O6 Dy1B C15 79.5(4) . . ?
O3 Dy1B C15 105.9(4) . . ?
C41 Dy1B C15 99.4(5) . . ?
Dy1A Dy1B C45 107.3(5) . . ?
O2 Dy1B C45 144.6(4) . . ?
N4 Dy1B C45 17.1(4) . . ?
O6 Dy1B C45 107.0(4) . . ?
O3 Dy1B C45 79.1(4) . . ?
C41 Dy1B C45 53.4(4) . . ?
C15 Dy1B C45 151.8(4) . . ?
Dy2B Dy2A O10 69.3(3) . . ?
Dy2B Dy2A O8 71.5(3) . . ?
O10 Dy2A O8 140.7(3) . . ?
Dy2B Dy2A O12 43.6(5) . . ?
O10 Dy2A O12 76.2(3) . . ?
O8 Dy2A O12 76.6(3) . . ?
Dy2B Dy2A O11 114.4(5) . . ?
O10 Dy2A O11 82.1(3) . . ?
O8 Dy2A O11 116.2(3) . . ?
O12 Dy2A O11 73.4(3) . . ?
Dy2B Dy2A O9 136.9(4) . . ?
O10 Dy2A O9 71.8(3) . . ?
O8 Dy2A O9 143.4(3) . . ?
O12 Dy2A O9 138.8(3) . . ?
O11 Dy2A O9 77.0(3) . . ?
Dy2B Dy2A O7 143.0(3) . . ?
O10 Dy2A O7 147.5(3) . . ?
O8 Dy2A O7 71.7(3) . . ?
O12 Dy2A O7 122.6(3) . . ?
O11 Dy2A O7 79.4(3) . . ?
O9 Dy2A O7 78.2(3) . . ?
Dy2B Dy2A N2 98.7(5) . . ?
O10 Dy2A N2 104.9(3) . . ?
O8 Dy2A N2 79.5(3) . . ?
O12 Dy2A N2 140.4(3) . . ?
O11 Dy2A N2 146.1(3) . . ?
O9 Dy2A N2 74.1(3) . . ?
O7 Dy2A N2 77.8(3) . . ?
Dy2B Dy2A N1 36.0(5) . . ?
O10 Dy2A N1 75.7(3) . . ?
O8 Dy2A N1 71.8(3) . . ?
O12 Dy2A N1 79.4(3) . . ?
O11 Dy2A N1 148.3(3) . . ?
O9 Dy2A N1 115.9(3) . . ?
O7 Dy2A N1 130.3(3) . . ?
N2 Dy2A N1 63.2(3) . . ?
Dy2A Dy2B O12 107.0(7) . . ?
Dy2A Dy2B N1 120.5(6) . . ?
O12 Dy2B N1 132.2(5) . . ?
Dy2A Dy2B O10 80.2(3) . . ?
O12 Dy2B O10 94.4(5) . . ?
N1 Dy2B O10 98.4(5) . . ?
Dy2A Dy2B O8 78.2(3) . . ?
O12 Dy2B O8 93.4(5) . . ?
N1 Dy2B O8 91.2(5) . . ?
O10 Dy2B O8 158.3(4) . . ?
Dy2A Dy2B C51 156.2(8) . . ?
O12 Dy2B C51 96.6(5) . . ?
N1 Dy2B C51 36.6(5) . . ?
O10 Dy2B C51 95.5(5) . . ?
O8 Dy2B C51 103.6(5) . . ?
Dy2A Dy2B C20 102.4(6) . . ?
O12 Dy2B C20 14.9(4) . . ?
N1 Dy2B C20 136.3(4) . . ?
O10 Dy2B C20 79.6(4) . . ?
O8 Dy2B C20 106.5(5) . . ?
C51 Dy2B C20 99.8(5) . . ?
Dy2A Dy2B C56 106.7(5) . . ?
O12 Dy2B C56 143.1(4) . . ?
N1 Dy2B C56 16.3(4) . . ?
O10 Dy2B C56 105.7(5) . . ?
O8 Dy2B C56 79.2(4) . . ?
C51 Dy2B C56 51.7(5) . . ?
C20 Dy2B C56 150.9(4) . . ?

_diffrn_measured_fraction_theta_max 0.997
_diffrn_reflns_theta_full        25.00
_diffrn_measured_fraction_theta_full 0.997
_refine_diff_density_max         6.167
_refine_diff_density_min         -1.575
_refine_diff_density_rms         0.251
####################################################################### 
# 
# 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_dd
_database_code_depnum_ccdc_archive 'CCDC 1037819'
_audit_update_record             
;
2014-12-05 deposited with the CCDC.
2015-10-30 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
;
 ?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C27 H20 Dy F9 N2 O6 '
_chemical_formula_sum            ' C27 H20 Dy F9 N2 O6  '
_chemical_formula_weight         801.95

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'
Dy Dy -0.1892 4.4098 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_H-M   ' P 21/c   '
_symmetry_space_group_name_Hall  ' -P 2ybc  '

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

_cell_length_a                   16.001(5)
_cell_length_b                   18.400(5)
_cell_length_c                   22.106(4)
_cell_angle_alpha                90.00
_cell_angle_beta                 114.699(15)
_cell_angle_gamma                90.00
_cell_volume                     5913(3)
_cell_formula_units_Z            8
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    ?
_cell_measurement_theta_min      ?
_cell_measurement_theta_max      ?

_exptl_crystal_description       block
_exptl_crystal_colour            colorless
_exptl_crystal_size_max          0.3
_exptl_crystal_size_mid          0.21
_exptl_crystal_size_min          0.13
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.802
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             3128
_exptl_absorpt_coefficient_mu    2.628
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.521
_exptl_absorpt_correction_T_max  0.711
_exptl_absorpt_process_details   sadabs(Sheldrick,1996)

_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      293(2)
_diffrn_radiation_wavelength     0.71069
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  ?
_diffrn_measurement_method       ?
_diffrn_detector_area_resol_mean ?
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            30086
_diffrn_reflns_av_R_equivalents  0.0337
_diffrn_reflns_av_sigmaI/netI    0.0375
_diffrn_reflns_limit_h_min       -19
_diffrn_reflns_limit_h_max       18
_diffrn_reflns_limit_k_min       -21
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_limit_l_max       26
_diffrn_reflns_theta_min         3.24
_diffrn_reflns_theta_max         25.00
_reflns_number_total             10403
_reflns_number_gt                6530
_reflns_threshold_expression     >2sigma(I)

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

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

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0790P)²+24.5264P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         10403
_refine_ls_number_parameters     847
_refine_ls_number_restraints     138
_refine_ls_R_factor_all          0.0785
_refine_ls_R_factor_gt           0.0498
_refine_ls_wR_factor_ref         0.1609
_refine_ls_wR_factor_gt          0.1333
_refine_ls_goodness_of_fit_ref   1.038
_refine_ls_restrained_S_all      1.038
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C 1.0475(7) 0.5141(5) 0.2409(5) 0.061(3) Uani 1 1 d . . .
H1 H 0.9851 0.5204 0.2143 0.073 Uiso 1 1 calc R . .
C2 C 1.1038(9) 0.5742(5) 0.2607(6) 0.070(3) Uani 1 1 d . . .
H2 H 1.0793 0.6200 0.2461 0.084 Uiso 1 1 calc R . .
C3 C 1.1946(8) 0.5673(6) 0.3015(6) 0.063(3) Uani 1 1 d . . .
H3 H 1.2322 0.6080 0.3163 0.076 Uiso 1 1 calc R . .
C4 C 1.2293(7) 0.4991(6) 0.3200(5) 0.048(2) Uani 1 1 d . . .
C5 C 1.3247(7) 0.4874(6) 0.3615(5) 0.068(3) Uani 1 1 d . . .
H5 H 1.3642 0.5269 0.3772 0.082 Uiso 1 1 calc R . .
C6 C 1.3585(7) 0.4175(6) 0.3783(6) 0.069(3) Uani 1 1 d . . .
H6 H 1.4205 0.4109 0.4056 0.083 Uiso 1 1 calc R . .
C7 C 1.3328(7) 0.2846(6) 0.3695(5) 0.055(3) Uani 1 1 d . . .
H7 H 1.3948 0.2756 0.3954 0.066 Uiso 1 1 calc R . .
C8 C 1.2724(7) 0.2292(6) 0.3453(5) 0.058(3) Uani 1 1 d . . .
H8 H 1.2928 0.1813 0.3538 0.070 Uiso 1 1 calc R . .
C9 C 1.3003(6) 0.3554(6) 0.3547(4) 0.050(2) Uani 1 1 d . . .
C10 C 1.1714(6) 0.4380(5) 0.2983(4) 0.0353(19) Uani 1 1 d . . .
C11 C 1.2066(6) 0.3659(5) 0.3163(4) 0.042(2) Uani 1 1 d . . .
C12 C 1.1804(6) 0.2440(5) 0.3080(5) 0.049(2) Uani 1 1 d . . .
H12 H 1.1398 0.2052 0.2921 0.059 Uiso 1 1 calc R . .
C13 C 1.1155(14) 0.4085(9) 0.4657(7) 0.095(4) Uani 1 1 d U . .
C14 C 1.0687(8) 0.3537(6) 0.4108(5) 0.059(3) Uani 1 1 d . . .
C15 C 1.0333(7) 0.2288(6) 0.3812(5) 0.058(3) Uani 1 1 d . . .
C16 C 1.0380(10) 0.1493(6) 0.4063(6) 0.094(5) Uani 1 1 d . . .
H16A H 1.0061 0.1178 0.3691 0.141 Uiso 1 1 calc R . .
H16B H 1.0098 0.1466 0.4369 0.141 Uiso 1 1 calc R . .
H16C H 1.1012 0.1344 0.4283 0.141 Uiso 1 1 calc R . .
C18 C 0.9042(6) 0.3466(7) 0.0861(5) 0.054(3) Uani 1 1 d . . .
C19 C 0.9042(7) 0.2746(7) 0.0731(5) 0.062(3) Uani 1 1 d . . .
H19 H 0.8739 0.2587 0.0293 0.074 Uiso 1 1 calc R . .
C20 C 0.9481(7) 0.2233(6) 0.1231(6) 0.059(3) Uani 1 1 d . . .
C21 C 0.9537(10) 0.1452(7) 0.1026(7) 0.097(5) Uani 1 1 d . . .
H21A H 0.9856 0.1162 0.1415 0.145 Uiso 1 1 calc R . .
H21B H 0.9864 0.1438 0.0747 0.145 Uiso 1 1 calc R . .
H21C H 0.8927 0.1264 0.0784 0.145 Uiso 1 1 calc R . .
C22 C 0.7692(8) 0.5201(7) 0.1791(7) 0.068(3) Uani 1 1 d . . .
C23 C 0.7950(7) 0.4432(6) 0.1924(5) 0.051(2) Uani 1 1 d . . .
C24 C 0.7295(7) 0.3917(6) 0.1569(5) 0.060(3) Uani 1 1 d . . .
H24 H 0.6714 0.4076 0.1276 0.072 Uiso 1 1 calc R . .
C25 C 0.7466(6) 0.3177(6) 0.1630(4) 0.050(2) Uani 1 1 d . . .
C26 C 0.3209(6) 0.5030(6) 0.1920(4) 0.052(2) Uani 1 1 d . . .
H26 H 0.3611 0.5420 0.2080 0.063 Uiso 1 1 calc R . .
C27 C 0.2271(7) 0.5188(6) 0.1529(5) 0.061(3) Uani 1 1 d . . .
H27 H 0.2070 0.5666 0.1435 0.073 Uiso 1 1 calc R . .
C28 C 0.1681(7) 0.4638(7) 0.1300(5) 0.061(3) Uani 1 1 d . . .
H28 H 0.1060 0.4727 0.1044 0.074 Uiso 1 1 calc R . .
C29 C 0.2010(6) 0.3904(6) 0.1450(4) 0.051(2) Uani 1 1 d . . .
C30 C 0.2955(6) 0.3823(5) 0.1851(4) 0.0415(19) Uani 1 1 d . . .
C31 C 0.3321(6) 0.3110(5) 0.2043(4) 0.041(2) Uani 1 1 d . . .
C32 C 0.1439(7) 0.3285(6) 0.1231(6) 0.070(3) Uani 1 1 d . . .
H32 H 0.0816 0.3348 0.0964 0.084 Uiso 1 1 calc R . .
C33 C 0.1782(7) 0.2580(7) 0.1404(5) 0.070(3) Uani 1 1 d . . .
H33 H 0.1397 0.2178 0.1253 0.084 Uiso 1 1 calc R . .
C34 C 0.2723(7) 0.2497(6) 0.1812(5) 0.050(3) Uani 1 1 d . . .
C35 C 0.3107(8) 0.1812(5) 0.2030(6) 0.065(3) Uani 1 1 d . . .
H35 H 0.2745 0.1396 0.1893 0.078 Uiso 1 1 calc R . .
C36 C 0.4002(9) 0.1758(5) 0.2439(6) 0.068(3) Uani 1 1 d . . .
H36 H 0.4257 0.1303 0.2591 0.081 Uiso 1 1 calc R . .
C37 C 0.4554(7) 0.2374(5) 0.2638(5) 0.060(3) Uani 1 1 d . . .
H37 H 0.5175 0.2319 0.2917 0.072 Uiso 1 1 calc R . .
C38 C 0.5430(9) 0.6094(7) 0.3907(7) 0.093(5) Uani 1 1 d . . .
H38A H 0.5091 0.6370 0.3511 0.140 Uiso 1 1 calc R . .
H38B H 0.6037 0.6294 0.4132 0.140 Uiso 1 1 calc R . .
H38C H 0.5121 0.6114 0.4197 0.140 Uiso 1 1 calc R . .
C39 C 0.5498(7) 0.5319(6) 0.3723(5) 0.054(3) Uani 1 1 d . . .
C40 C 0.5974(7) 0.4831(6) 0.4242(5) 0.064(3) Uani 1 1 d . . .
H40 H 0.6284 0.5011 0.4671 0.077 Uiso 1 1 calc R . .
C41 C 0.5999(7) 0.4106(7) 0.4140(5) 0.059(3) Uani 1 1 d . . .
C42 C 0.6393(10) 0.3583(9) 0.4735(5) 0.081(4) Uani 1 1 d . . .
C43 C 0.4604(10) 0.5954(6) 0.0886(6) 0.089(4) Uani 1 1 d . . .
H43A H 0.4932 0.6272 0.1254 0.133 Uiso 1 1 calc R . .
H43B H 0.3973 0.6104 0.0671 0.133 Uiso 1 1 calc R . .
H43C H 0.4877 0.5974 0.0574 0.133 Uiso 1 1 calc R . .
C44 C 0.4654(7) 0.5161(6) 0.1147(5) 0.055(3) Uani 1 1 d . . .
C45 C 0.4225(8) 0.4602(7) 0.0698(5) 0.073(3) Uani 1 1 d . . .
H45 H 0.3868 0.4722 0.0256 0.087 Uiso 1 1 calc R . .
C46 C 0.4304(8) 0.3894(6) 0.0878(5) 0.060(3) Uani 1 1 d . . .
C47 C 0.3799(10) 0.3362(7) 0.0341(6) 0.065(3) Uani 1 1 d . . .
C48 C 0.8315(7) 0.4824(7) 0.3702(6) 0.077(4) Uani 1 1 d . . .
H48A H 0.8100 0.5316 0.3609 0.115 Uiso 1 1 calc R . .
H48B H 0.8798 0.4749 0.3558 0.115 Uiso 1 1 calc R . .
H48C H 0.8547 0.4735 0.4171 0.115 Uiso 1 1 calc R . .
C49 C 0.7537(7) 0.4313(7) 0.3336(5) 0.061(3) Uani 1 1 d . . .
C50 C 0.7719(7) 0.3572(6) 0.3395(5) 0.063(3) Uani 1 1 d . . .
H50 H 0.8307 0.3416 0.3675 0.075 Uiso 1 1 calc R . .
C51 C 0.7063(7) 0.3060(6) 0.3055(5) 0.054(3) Uani 1 1 d . . .
C52 C 0.7333(8) 0.2292(8) 0.3199(7) 0.076(4) Uani 1 1 d . . .
C69 C 0.8593(10) 0.3982(11) 0.0277(8) 0.103(3) Uani 1 1 d U . .
C70 C 0.6702(7) 0.2673(7) 0.1259(6) 0.079(4) Uani 1 1 d . . .
H70A H 0.6918 0.2181 0.1348 0.118 Uiso 1 1 calc R . .
H70B H 0.6478 0.2768 0.0790 0.118 Uiso 1 1 calc R . .
H70C H 0.6213 0.2744 0.1398 0.118 Uiso 1 1 calc R . .
C71 C 1.0754(8) 0.2827(6) 0.4278(5) 0.066(3) Uani 1 1 d . . .
H71 H 1.1091 0.2697 0.4721 0.079 Uiso 1 1 calc R . .
Dy1A Dy 0.97380(4) 0.33701(3) 0.24763(4) 0.03120(18) Uani 0.90 1 d P . .
Dy2A Dy 0.52683(4) 0.41286(3) 0.25190(4) 0.03118(18) Uani 0.90 1 d P . .
F1A F 0.7901(13) 0.4226(13) 0.0249(11) 0.126(4) Uani 0.50 1 d PU . .
F1B F 0.832(2) 0.4605(15) 0.0418(13) 0.161(5) Uani 0.50 1 d PU . .
F2 F 0.9200(7) 0.4352(7) 0.0192(6) 0.157(3) Uani 1 1 d U . .
F3A F 0.7916(12) 0.3726(13) -0.0235(9) 0.129(4) Uani 0.50 1 d PU . .
F3B F 0.8546(19) 0.3689(15) -0.0296(13) 0.156(5) Uani 0.50 1 d PU . .
F4 F 0.8098(7) 0.5534(5) 0.1459(6) 0.152(4) Uani 1 1 d . . .
F5 F 0.7947(11) 0.5614(5) 0.2304(6) 0.181(6) Uani 1 1 d . . .
F6 F 0.6818(6) 0.5345(6) 0.1440(8) 0.200(6) Uani 1 1 d . . .
F7 F 0.5773(8) 0.3297(10) 0.4864(7) 0.253(10) Uani 1 1 d . . .
F8 F 0.6902(10) 0.3910(8) 0.5272(5) 0.209(7) Uani 1 1 d . . .
F10 F 0.6891(6) 0.1956(5) 0.3507(5) 0.139(4) Uani 1 1 d . . .
F11 F 0.7035(10) 0.1878(5) 0.2648(6) 0.164(5) Uani 1 1 d . . .
F12 F 0.8192(6) 0.2155(5) 0.3529(6) 0.168(5) Uani 1 1 d . . .
F13 F 0.3296(13) 0.2970(10) 0.0485(7) 0.251(9) Uani 1 1 d . . .
F14 F 0.3261(12) 0.3614(7) -0.0212(5) 0.223(8) Uani 1 1 d . . .
F15 F 0.4355(9) 0.2929(9) 0.0261(7) 0.209(7) Uani 1 1 d . . .
F23 F 0.6898(11) 0.3147(8) 0.4676(5) 0.206(7) Uani 1 1 d . . .
F24 F 1.1788(13) 0.4402(11) 0.4569(8) 0.251(10) Uani 1 1 d U . .
F25 F 1.0675(10) 0.4495(10) 0.4741(7) 0.249(10) Uani 1 1 d . . .
F26 F 1.1676(11) 0.3806(7) 0.5239(6) 0.200(6) Uani 1 1 d . . .
N1 N 1.1481(5) 0.3088(4) 0.2941(3) 0.0390(17) Uani 1 1 d . . .
N2 N 1.0812(5) 0.4457(4) 0.2592(4) 0.0439(18) Uani 1 1 d . . .
N3 N 0.3542(5) 0.4402(4) 0.2066(4) 0.0411(17) Uani 1 1 d . . .
N4 N 0.4225(5) 0.3044(4) 0.2443(4) 0.0461(18) Uani 1 1 d . . .
O1 O 1.0278(5) 0.3834(3) 0.3547(3) 0.0518(17) Uani 1 1 d . . .
O2 O 0.9911(4) 0.2394(3) 0.3197(3) 0.0476(16) Uani 1 1 d . . .
O3 O 0.8771(5) 0.4348(3) 0.2341(3) 0.0508(16) Uani 1 1 d . . .
O4 O 0.8251(4) 0.2909(4) 0.1997(3) 0.0504(17) Uani 1 1 d . . .
O5 O 0.9382(4) 0.3791(4) 0.1408(3) 0.0513(17) Uani 1 1 d . . .
O6 O 0.9857(4) 0.2376(3) 0.1844(3) 0.0516(17) Uani 1 1 d . . .
O7 O 0.5655(5) 0.3755(4) 0.3603(3) 0.0568(18) Uani 1 1 d . . .
O8 O 0.5138(4) 0.5155(3) 0.3120(3) 0.0495(16) Uani 1 1 d . . .
O9 O 0.6232(5) 0.3154(3) 0.2648(3) 0.0506(16) Uani 1 1 d . . .
O10 O 0.6753(4) 0.4600(4) 0.2979(3) 0.0510(17) Uani 1 1 d . . .
O11 O 0.4721(4) 0.3631(3) 0.1450(3) 0.0506(16) Uani 1 1 d . . .
O12 O 0.5080(4) 0.5083(3) 0.1767(3) 0.0495(16) Uani 1 1 d . . .
Dy1B Dy 1.0234(7) 0.3398(3) 0.2500(4) 0.059(2) Uani 0.10 1 d P . .
Dy2B Dy 0.4798(6) 0.4153(3) 0.2462(4) 0.0499(17) Uani 0.10 1 d P . .


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

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
C1 N2 1.362(11) . ?
C1 C2 1.376(14) . ?
C1 H1 0.9300 . ?
C2 C3 1.359(15) . ?
C2 H2 0.9300 . ?
C3 C4 1.363(14) . ?
C3 H3 0.9300 . ?
C4 C10 1.408(12) . ?
C4 C5 1.430(13) . ?
C5 C6 1.383(15) . ?
C5 H5 0.9300 . ?
C6 C9 1.429(14) . ?
C6 H6 0.9300 . ?
C7 C8 1.351(14) . ?
C7 C9 1.389(14) . ?
C7 H7 0.9300 . ?
C8 C12 1.382(12) . ?
C8 H8 0.9300 . ?
C9 C11 1.393(12) . ?
C10 N2 1.344(11) . ?
C10 C11 1.432(12) . ?
C10 Dy1B 2.811(12) . ?
C11 N1 1.356(11) . ?
C11 Dy1B 2.717(13) . ?
C12 N1 1.284(10) . ?
C12 Dy1B 2.893(12) . ?
C12 H12 0.9300 . ?
C13 F25 1.15(2) . ?
C13 F24 1.25(2) . ?
C13 F26 1.309(17) . ?
C13 C14 1.514(16) . ?
C14 O1 1.258(11) . ?
C14 C71 1.352(14) . ?
C15 O2 1.255(11) . ?
C15 C71 1.384(14) . ?
C15 C16 1.555(14) . ?
C16 H16A 0.9600 . ?
C16 H16B 0.9600 . ?
C16 H16C 0.9600 . ?
C18 O5 1.253(11) . ?
C18 C19 1.355(15) . ?
C18 C69 1.519(17) . ?
C19 C20 1.399(15) . ?
C19 H19 0.9300 . ?
C20 O6 1.259(11) . ?
C20 C21 1.521(15) . ?
C21 H21A 0.9600 . ?
C21 H21B 0.9600 . ?
C21 H21C 0.9600 . ?
C22 F5 1.281(16) . ?
C22 F6 1.313(14) . ?
C22 F4 1.316(13) . ?
C22 C23 1.470(15) . ?
C23 O3 1.260(11) . ?
C23 C24 1.387(14) . ?
C24 C25 1.385(13) . ?
C24 H24 0.9300 . ?
C25 O4 1.276(10) . ?
C25 C70 1.479(13) . ?
C26 N3 1.257(11) . ?
C26 C27 1.415(13) . ?
C26 Dy2B 2.821(12) . ?
C26 H26 0.9300 . ?
C27 C28 1.332(14) . ?
C27 H27 0.9300 . ?
C28 C29 1.436(15) . ?
C28 H28 0.9300 . ?
C29 C30 1.405(12) . ?
C29 C32 1.414(14) . ?
C30 N3 1.367(11) . ?
C30 C31 1.426(12) . ?
C30 Dy2B 2.749(12) . ?
C31 N4 1.349(11) . ?
C31 C34 1.428(13) . ?
C31 Dy2B 2.881(12) . ?
C32 C33 1.398(15) . ?
C32 H32 0.9300 . ?
C33 C34 1.404(13) . ?
C33 H33 0.9300 . ?
C34 C35 1.398(14) . ?
C35 C36 1.339(15) . ?
C35 H35 0.9300 . ?
C36 C37 1.391(14) . ?
C36 H36 0.9300 . ?
C37 N4 1.338(11) . ?
C37 H37 0.9300 . ?
C38 C39 1.497(14) . ?
C38 H38A 0.9600 . ?
C38 H38B 0.9600 . ?
C38 H38C 0.9600 . ?
C39 O8 1.249(11) . ?
C39 C40 1.405(15) . ?
C40 C41 1.355(15) . ?
C40 H40 0.9300 . ?
C41 O7 1.258(11) . ?
C41 C42 1.537(15) . ?
C42 F23 1.183(14) . ?
C42 F7 1.257(17) . ?
C42 F8 1.276(16) . ?
C43 C44 1.558(14) . ?
C43 H43A 0.9600 . ?
C43 H43B 0.9600 . ?
C43 H43C 0.9600 . ?
C44 O12 1.259(11) . ?
C44 C45 1.393(14) . ?
C45 C46 1.353(15) . ?
C45 H45 0.9300 . ?
C46 O11 1.254(11) . ?
C46 C47 1.490(15) . ?
C47 F13 1.217(16) . ?
C47 F14 1.254(15) . ?
C47 F15 1.261(16) . ?
C48 C49 1.500(14) . ?
C48 H48A 0.9600 . ?
C48 H48B 0.9600 . ?
C48 H48C 0.9600 . ?
C49 O10 1.283(11) . ?
C49 C50 1.388(15) . ?
C50 C51 1.377(15) . ?
C50 H50 0.9300 . ?
C51 O9 1.267(11) . ?
C51 C52 1.474(15) . ?
C52 F12 1.283(13) . ?
C52 F10 1.323(14) . ?
C52 F11 1.343(16) . ?
C69 F1A 1.17(2) . ?
C69 F2 1.262(17) . ?
C69 F3A 1.28(2) . ?
C69 F1B 1.31(3) . ?
C69 F3B 1.35(3) . ?
C70 H70A 0.9600 . ?
C70 H70B 0.9600 . ?
C70 H70C 0.9600 . ?
C71 H71 0.9300 . ?
Dy1A Dy1B 0.775(10) . ?
Dy1A O3 2.310(6) . ?
Dy1A O1 2.317(6) . ?
Dy1A O5 2.318(6) . ?
Dy1A O4 2.323(6) . ?
Dy1A O2 2.340(6) . ?
Dy1A O6 2.358(6) . ?
Dy1A N2 2.580(7) . ?
Dy1A N1 2.590(7) . ?
Dy2A Dy2B 0.710(9) . ?
Dy2A O9 2.304(6) . ?
Dy2A O7 2.316(6) . ?
Dy2A O10 2.326(6) . ?
Dy2A O11 2.337(6) . ?
Dy2A O12 2.349(6) . ?
Dy2A O8 2.368(6) . ?
Dy2A N4 2.562(7) . ?
Dy2A N3 2.564(7) . ?
F1A F1B 0.93(3) . ?
F1A F3A 1.42(3) . ?
F1B F2 1.74(3) . ?
F2 F3B 1.67(3) . ?
F3A F3B 1.07(3) . ?
N1 Dy1B 1.906(12) . ?
N2 Dy1B 2.130(10) . ?
N3 Dy2B 1.883(11) . ?
N4 Dy2B 2.231(10) . ?
O1 Dy1B 2.423(9) . ?
O2 Dy1B 2.593(9) . ?
O3 Dy1B 2.824(11) . ?
O5 Dy1B 2.335(10) . ?
O6 Dy1B 2.297(9) . ?
O7 Dy2B 2.428(10) . ?
O8 Dy2B 2.270(9) . ?
O9 Dy2B 2.833(10) . ?
O11 Dy2B 2.390(10) . ?
O12 Dy2B 2.464(9) . ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
N2 C1 C2 121.5(9) . . ?
N2 C1 H1 119.3 . . ?
C2 C1 H1 119.3 . . ?
C3 C2 C1 120.8(10) . . ?
C3 C2 H2 119.6 . . ?
C1 C2 H2 119.6 . . ?
C2 C3 C4 118.3(10) . . ?
C2 C3 H3 120.9 . . ?
C4 C3 H3 120.9 . . ?
C3 C4 C10 120.3(9) . . ?
C3 C4 C5 121.6(10) . . ?
C10 C4 C5 118.1(10) . . ?
C6 C5 C4 120.4(9) . . ?
C6 C5 H5 119.8 . . ?
C4 C5 H5 119.8 . . ?
C5 C6 C9 121.6(9) . . ?
C5 C6 H6 119.2 . . ?
C9 C6 H6 119.2 . . ?
C8 C7 C9 118.6(9) . . ?
C8 C7 H7 120.7 . . ?
C9 C7 H7 120.7 . . ?
C7 C8 C12 119.6(9) . . ?
C7 C8 H8 120.2 . . ?
C12 C8 H8 120.2 . . ?
C7 C9 C11 118.4(10) . . ?
C7 C9 C6 122.8(9) . . ?
C11 C9 C6 118.8(10) . . ?
N2 C10 C4 120.8(8) . . ?
N2 C10 C11 117.9(8) . . ?
C4 C10 C11 121.3(8) . . ?
N2 C10 Dy1B 46.8(4) . . ?
C4 C10 Dy1B 166.7(7) . . ?
C11 C10 Dy1B 71.4(5) . . ?
N1 C11 C9 121.1(9) . . ?
N1 C11 C10 119.1(8) . . ?
C9 C11 C10 119.8(9) . . ?
N1 C11 Dy1B 40.7(4) . . ?
C9 C11 Dy1B 161.4(7) . . ?
C10 C11 Dy1B 78.6(5) . . ?
N1 C12 C8 123.2(9) . . ?
N1 C12 Dy1B 30.7(4) . . ?
C8 C12 Dy1B 153.7(8) . . ?
N1 C12 H12 118.4 . . ?
C8 C12 H12 118.4 . . ?
Dy1B C12 H12 87.8 . . ?
F25 C13 F24 110.9(19) . . ?
F25 C13 F26 107.1(17) . . ?
F24 C13 F26 96.4(17) . . ?
F25 C13 C14 115.4(16) . . ?
F24 C13 C14 110.3(16) . . ?
F26 C13 C14 115.2(13) . . ?
O1 C14 C71 129.9(10) . . ?
O1 C14 C13 112.4(11) . . ?
C71 C14 C13 117.7(10) . . ?
O2 C15 C71 124.7(10) . . ?
O2 C15 C16 117.1(10) . . ?
C71 C15 C16 118.2(10) . . ?
C15 C16 H16A 109.5 . . ?
C15 C16 H16B 109.5 . . ?
H16A C16 H16B 109.5 . . ?
C15 C16 H16C 109.5 . . ?
H16A C16 H16C 109.5 . . ?
H16B C16 H16C 109.5 . . ?
O5 C18 C19 129.2(10) . . ?
O5 C18 C69 112.5(12) . . ?
C19 C18 C69 118.2(12) . . ?
C18 C19 C20 122.5(10) . . ?
C18 C19 H19 118.8 . . ?
C20 C19 H19 118.8 . . ?
O6 C20 C19 124.5(10) . . ?
O6 C20 C21 117.2(11) . . ?
C19 C20 C21 118.3(11) . . ?
C20 C21 H21A 109.5 . . ?
C20 C21 H21B 109.5 . . ?
H21A C21 H21B 109.5 . . ?
C20 C21 H21C 109.5 . . ?
H21A C21 H21C 109.5 . . ?
H21B C21 H21C 109.5 . . ?
F5 C22 F6 105.6(13) . . ?
F5 C22 F4 99.7(13) . . ?
F6 C22 F4 103.2(11) . . ?
F5 C22 C23 115.9(11) . . ?
F6 C22 C23 116.9(12) . . ?
F4 C22 C23 113.4(10) . . ?
O3 C23 C24 129.9(10) . . ?
O3 C23 C22 112.5(10) . . ?
C24 C23 C22 117.6(10) . . ?
C25 C24 C23 123.0(9) . . ?
C25 C24 H24 118.5 . . ?
C23 C24 H24 118.5 . . ?
O4 C25 C24 123.0(9) . . ?
O4 C25 C70 118.5(10) . . ?
C24 C25 C70 118.5(9) . . ?
N3 C26 C27 125.0(10) . . ?
N3 C26 Dy2B 32.3(4) . . ?
C27 C26 Dy2B 156.3(8) . . ?
N3 C26 H26 117.5 . . ?
C27 C26 H26 117.5 . . ?
Dy2B C26 H26 85.6 . . ?
C28 C27 C26 118.6(10) . . ?
C28 C27 H27 120.7 . . ?
C26 C27 H27 120.7 . . ?
C27 C28 C29 119.5(9) . . ?
C27 C28 H28 120.2 . . ?
C29 C28 H28 120.2 . . ?
C30 C29 C32 120.1(10) . . ?
C30 C29 C28 116.2(9) . . ?
C32 C29 C28 123.8(9) . . ?
N3 C30 C29 122.5(9) . . ?
N3 C30 C31 118.4(8) . . ?
C29 C30 C31 119.0(9) . . ?
N3 C30 Dy2B 38.5(4) . . ?
C29 C30 Dy2B 159.5(7) . . ?
C31 C30 Dy2B 80.5(5) . . ?
N4 C31 C30 118.2(8) . . ?
N4 C31 C34 122.5(9) . . ?
C30 C31 C34 119.3(8) . . ?
N4 C31 Dy2B 48.6(5) . . ?
C30 C31 Dy2B 70.3(5) . . ?
C34 C31 Dy2B 167.9(7) . . ?
C33 C32 C29 122.1(9) . . ?
C33 C32 H32 119.0 . . ?
C29 C32 H32 119.0 . . ?
C32 C33 C34 118.0(10) . . ?
C32 C33 H33 121.0 . . ?
C34 C33 H33 121.0 . . ?
C35 C34 C33 121.2(10) . . ?
C35 C34 C31 117.2(9) . . ?
C33 C34 C31 121.5(10) . . ?
C36 C35 C34 119.4(9) . . ?
C36 C35 H35 120.3 . . ?
C34 C35 H35 120.3 . . ?
C35 C36 C37 120.8(9) . . ?
C35 C36 H36 119.6 . . ?
C37 C36 H36 119.6 . . ?
N4 C37 C36 122.4(9) . . ?
N4 C37 H37 118.8 . . ?
C36 C37 H37 118.8 . . ?
C39 C38 H38A 109.5 . . ?
C39 C38 H38B 109.5 . . ?
H38A C38 H38B 109.5 . . ?
C39 C38 H38C 109.5 . . ?
H38A C38 H38C 109.5 . . ?
H38B C38 H38C 109.5 . . ?
O8 C39 C40 124.6(10) . . ?
O8 C39 C38 117.8(11) . . ?
C40 C39 C38 117.6(10) . . ?
C41 C40 C39 122.5(10) . . ?
C41 C40 H40 118.7 . . ?
C39 C40 H40 118.7 . . ?
O7 C41 C40 129.1(10) . . ?
O7 C41 C42 110.2(11) . . ?
C40 C41 C42 120.3(10) . . ?
F23 C42 F7 112.4(19) . . ?
F23 C42 F8 102.9(14) . . ?
F7 C42 F8 104.0(13) . . ?
F23 C42 C41 112.7(10) . . ?
F7 C42 C41 112.1(11) . . ?
F8 C42 C41 112.0(14) . . ?
C44 C43 H43A 109.5 . . ?
C44 C43 H43B 109.5 . . ?
H43A C43 H43B 109.5 . . ?
C44 C43 H43C 109.5 . . ?
H43A C43 H43C 109.5 . . ?
H43B C43 H43C 109.5 . . ?
O12 C44 C45 125.0(9) . . ?
O12 C44 C43 115.4(9) . . ?
C45 C44 C43 119.6(10) . . ?
C46 C45 C44 122.9(10) . . ?
C46 C45 H45 118.5 . . ?
C44 C45 H45 118.5 . . ?
O11 C46 C45 127.8(10) . . ?
O11 C46 C47 115.6(10) . . ?
C45 C46 C47 116.5(10) . . ?
F13 C47 F14 102.4(15) . . ?
F13 C47 F15 104.2(15) . . ?
F14 C47 F15 109.5(14) . . ?
F13 C47 C46 112.3(11) . . ?
F14 C47 C46 117.1(12) . . ?
F15 C47 C46 110.4(12) . . ?
C49 C48 H48A 109.5 . . ?
C49 C48 H48B 109.5 . . ?
H48A C48 H48B 109.5 . . ?
C49 C48 H48C 109.5 . . ?
H48A C48 H48C 109.5 . . ?
H48B C48 H48C 109.5 . . ?
O10 C49 C50 125.1(10) . . ?
O10 C49 C48 116.8(10) . . ?
C50 C49 C48 118.1(10) . . ?
C51 C50 C49 122.5(10) . . ?
C51 C50 H50 118.7 . . ?
C49 C50 H50 118.7 . . ?
O9 C51 C50 129.0(10) . . ?
O9 C51 C52 114.2(11) . . ?
C50 C51 C52 116.7(10) . . ?
F12 C52 F10 106.9(11) . . ?
F12 C52 F11 107.2(13) . . ?
F10 C52 F11 97.9(12) . . ?
F12 C52 C51 117.4(12) . . ?
F10 C52 C51 112.8(11) . . ?
F11 C52 C51 112.8(11) . . ?
F1A C69 F2 124(2) . . ?
F1A C69 F3A 70.4(16) . . ?
F2 C69 F3A 118.9(17) . . ?
F1A C69 F1B 43.8(16) . . ?
F2 C69 F1B 85(2) . . ?
F3A C69 F1B 106.9(19) . . ?
F1A C69 F3B 115(2) . . ?
F2 C69 F3B 79.6(16) . . ?
F3A C69 F3B 48.0(14) . . ?
F1B C69 F3B 133(2) . . ?
F1A C69 C18 112.6(16) . . ?
F2 C69 C18 110.1(11) . . ?
F3A C69 C18 116.4(17) . . ?
F1B C69 C18 115.5(19) . . ?
F3B C69 C18 111.7(19) . . ?
C25 C70 H70A 109.5 . . ?
C25 C70 H70B 109.5 . . ?
H70A C70 H70B 109.5 . . ?
C25 C70 H70C 109.5 . . ?
H70A C70 H70C 109.5 . . ?
H70B C70 H70C 109.5 . . ?
C14 C71 C15 121.9(10) . . ?
C14 C71 H71 119.1 . . ?
C15 C71 H71 119.1 . . ?
Dy1B Dy1A O3 124.6(5) . . ?
Dy1B Dy1A O1 88.4(6) . . ?
O3 Dy1A O1 77.8(2) . . ?
Dy1B Dy1A O5 81.7(6) . . ?
O3 Dy1A O5 75.0(2) . . ?
O1 Dy1A O5 138.2(3) . . ?
Dy1B Dy1A O4 151.6(6) . . ?
O3 Dy1A O4 73.9(2) . . ?
O1 Dy1A O4 118.3(2) . . ?
O5 Dy1A O4 83.6(2) . . ?
Dy1B Dy1A O2 100.3(5) . . ?
O3 Dy1A O2 124.7(2) . . ?
O1 Dy1A O2 72.5(2) . . ?
O5 Dy1A O2 149.2(2) . . ?
O4 Dy1A O2 80.6(2) . . ?
Dy1B Dy1A O6 76.0(5) . . ?
O3 Dy1A O6 138.0(2) . . ?
O1 Dy1A O6 143.5(2) . . ?
O5 Dy1A O6 72.7(2) . . ?
O4 Dy1A O6 76.5(2) . . ?
O2 Dy1A O6 78.0(3) . . ?
Dy1B Dy1A N2 47.2(5) . . ?
O3 Dy1A N2 78.0(2) . . ?
O1 Dy1A N2 70.4(2) . . ?
O5 Dy1A N2 73.3(2) . . ?
O4 Dy1A N2 147.3(2) . . ?
O2 Dy1A N2 130.0(2) . . ?
O6 Dy1A N2 116.4(2) . . ?
Dy1B Dy1A N1 23.7(6) . . ?
O3 Dy1A N1 139.4(2) . . ?
O1 Dy1A N1 77.8(2) . . ?
O5 Dy1A N1 103.7(2) . . ?
O4 Dy1A N1 146.7(2) . . ?
O2 Dy1A N1 77.0(2) . . ?
O6 Dy1A N1 74.9(2) . . ?
N2 Dy1A N1 63.5(2) . . ?
Dy2B Dy2A O9 132.5(5) . . ?
Dy2B Dy2A O7 90.5(7) . . ?
O9 Dy2A O7 76.4(2) . . ?
Dy2B Dy2A O10 150.1(6) . . ?
O9 Dy2A O10 74.2(2) . . ?
O7 Dy2A O10 82.8(2) . . ?
Dy2B Dy2A O11 85.6(7) . . ?
O9 Dy2A O11 76.6(2) . . ?
O7 Dy2A O11 139.1(2) . . ?
O10 Dy2A O11 118.1(2) . . ?
Dy2B Dy2A O12 90.8(6) . . ?
O9 Dy2A O12 123.4(2) . . ?
O7 Dy2A O12 148.7(2) . . ?
O10 Dy2A O12 80.6(2) . . ?
O11 Dy2A O12 72.2(2) . . ?
Dy2B Dy2A O8 73.4(6) . . ?
O9 Dy2A O8 139.7(2) . . ?
O7 Dy2A O8 72.8(2) . . ?
O10 Dy2A O8 76.7(2) . . ?
O11 Dy2A O8 142.8(2) . . ?
O12 Dy2A O8 77.6(2) . . ?
Dy2B Dy2A N4 54.9(5) . . ?
O9 Dy2A N4 77.6(2) . . ?
O7 Dy2A N4 73.8(2) . . ?
O10 Dy2A N4 146.9(2) . . ?
O11 Dy2A N4 70.7(2) . . ?
O12 Dy2A N4 130.5(2) . . ?
O8 Dy2A N4 116.8(2) . . ?
Dy2B Dy2A N3 14.0(7) . . ?
O9 Dy2A N3 139.2(2) . . ?
O7 Dy2A N3 103.9(2) . . ?
O10 Dy2A N3 146.6(2) . . ?
O11 Dy2A N3 78.2(2) . . ?
O12 Dy2A N3 77.2(2) . . ?
O8 Dy2A N3 74.3(2) . . ?
N4 Dy2A N3 64.0(2) . . ?
F1B F1A C69 76(2) . . ?
F1B F1A F3A 123(3) . . ?
C69 F1A F3A 58.5(16) . . ?
F1A F1B C69 60(2) . . ?
F1A F1B F2 103(3) . . ?
C69 F1B F2 46.4(13) . . ?
C69 F2 F3B 52.4(12) . . ?
C69 F2 F1B 48.5(13) . . ?
F3B F2 F1B 91.0(13) . . ?
F3B F3A C69 69.1(17) . . ?
F3B F3A F1A 117(2) . . ?
C69 F3A F1A 51.1(13) . . ?
F3A F3B C69 62.9(18) . . ?
F3A F3B F2 104(3) . . ?
C69 F3B F2 47.9(12) . . ?
C12 N1 C11 119.0(8) . . ?
C12 N1 Dy1B 129.1(7) . . ?
C11 N1 Dy1B 111.7(6) . . ?
C12 N1 Dy1A 122.6(6) . . ?
C11 N1 Dy1A 117.0(5) . . ?
Dy1B N1 Dy1A 9.4(2) . . ?
C10 N2 C1 118.3(8) . . ?
C10 N2 Dy1B 105.8(6) . . ?
C1 N2 Dy1B 135.6(7) . . ?
C10 N2 Dy1A 118.3(5) . . ?
C1 N2 Dy1A 121.5(6) . . ?
Dy1B N2 Dy1A 15.5(3) . . ?
C26 N3 C30 118.1(8) . . ?
C26 N3 Dy2B 126.7(7) . . ?
C30 N3 Dy2B 114.6(6) . . ?
C26 N3 Dy2A 123.5(6) . . ?
C30 N3 Dy2A 117.0(5) . . ?
Dy2B N3 Dy2A 5.2(3) . . ?
C37 N4 C31 117.7(8) . . ?
C37 N4 Dy2B 137.1(7) . . ?
C31 N4 Dy2B 104.4(6) . . ?
C37 N4 Dy2A 122.6(6) . . ?
C31 N4 Dy2A 117.6(6) . . ?
Dy2B N4 Dy2A 15.1(2) . . ?
C14 O1 Dy1A 131.6(7) . . ?
C14 O1 Dy1B 126.3(7) . . ?
Dy1A O1 Dy1B 18.6(2) . . ?
C15 O2 Dy1A 135.5(6) . . ?
C15 O2 Dy1B 127.1(6) . . ?
Dy1A O2 Dy1B 17.1(2) . . ?
C23 O3 Dy1A 128.8(7) . . ?
C23 O3 Dy1B 136.3(7) . . ?
Dy1A O3 Dy1B 13.06(16) . . ?
C25 O4 Dy1A 134.2(6) . . ?
C18 O5 Dy1A 130.4(7) . . ?
C18 O5 Dy1B 133.0(7) . . ?
Dy1A O5 Dy1B 19.2(2) . . ?
C20 O6 Dy1B 137.0(7) . . ?
C20 O6 Dy1A 132.8(7) . . ?
Dy1B O6 Dy1A 19.1(2) . . ?
C41 O7 Dy2A 130.2(7) . . ?
C41 O7 Dy2B 131.2(7) . . ?
Dy2A O7 Dy2B 17.0(2) . . ?
C39 O8 Dy2B 139.5(7) . . ?
C39 O8 Dy2A 133.0(7) . . ?
Dy2B O8 Dy2A 17.4(2) . . ?
C51 O9 Dy2A 130.0(7) . . ?
C51 O9 Dy2B 137.5(7) . . ?
Dy2A O9 Dy2B 10.65(15) . . ?
C49 O10 Dy2A 132.3(7) . . ?
C46 O11 Dy2A 133.2(7) . . ?
C46 O11 Dy2B 125.8(7) . . ?
Dy2A O11 Dy2B 17.2(2) . . ?
C44 O12 Dy2A 134.9(6) . . ?
C44 O12 Dy2B 126.9(6) . . ?
Dy2A O12 Dy2B 16.8(2) . . ?
Dy1A Dy1B N1 146.9(8) . . ?
Dy1A Dy1B N2 117.4(6) . . ?
N1 Dy1B N2 84.5(5) . . ?
Dy1A Dy1B O6 84.9(6) . . ?
N1 Dy1B O6 91.2(4) . . ?
N2 Dy1B O6 143.0(5) . . ?
Dy1A Dy1B O5 79.2(6) . . ?
N1 Dy1B O5 131.0(5) . . ?
N2 Dy1B O5 81.9(3) . . ?
O6 Dy1B O5 73.5(3) . . ?
Dy1A Dy1B O1 72.9(6) . . ?
N1 Dy1B O1 90.2(4) . . ?
N2 Dy1B O1 76.6(3) . . ?
O6 Dy1B O1 140.3(4) . . ?
O5 Dy1B O1 131.0(4) . . ?
Dy1A Dy1B O2 62.6(5) . . ?
N1 Dy1B O2 84.7(4) . . ?
N2 Dy1B O2 141.4(4) . . ?
O6 Dy1B O2 74.1(3) . . ?
O5 Dy1B O2 131.2(4) . . ?
O1 Dy1B O2 66.5(3) . . ?
Dy1A Dy1B C11 153.1(7) . . ?
N1 Dy1B C11 27.6(3) . . ?
N2 Dy1B C11 57.3(3) . . ?
O6 Dy1B C11 115.1(4) . . ?
O5 Dy1B C11 122.4(4) . . ?
O1 Dy1B C11 80.3(3) . . ?
O2 Dy1B C11 104.1(3) . . ?
Dy1A Dy1B C10 138.2(6) . . ?
N1 Dy1B C10 57.5(4) . . ?
N2 Dy1B C10 27.4(3) . . ?
O6 Dy1B C10 136.4(5) . . ?
O5 Dy1B C10 103.3(3) . . ?
O1 Dy1B C10 75.0(3) . . ?
O2 Dy1B C10 125.3(4) . . ?
C11 Dy1B C10 30.0(3) . . ?
Dy1A Dy1B O3 42.3(4) . . ?
N1 Dy1B O3 152.3(4) . . ?
N2 Dy1B O3 75.5(3) . . ?
O6 Dy1B O3 116.3(4) . . ?
O5 Dy1B O3 65.4(3) . . ?
O1 Dy1B O3 66.8(3) . . ?
O2 Dy1B O3 98.9(4) . . ?
C11 Dy1B O3 127.6(3) . . ?
C10 Dy1B O3 99.9(3) . . ?
Dy1A Dy1B C12 131.6(6) . . ?
N1 Dy1B C12 20.2(3) . . ?
N2 Dy1B C12 104.7(4) . . ?
O6 Dy1B C12 74.4(3) . . ?
O5 Dy1B C12 132.1(4) . . ?
O1 Dy1B C12 96.0(4) . . ?
O2 Dy1B C12 69.7(3) . . ?
C11 Dy1B C12 47.7(3) . . ?
C10 Dy1B C12 77.6(4) . . ?
O3 Dy1B C12 162.5(4) . . ?
Dy2A Dy2B N3 160.7(9) . . ?
Dy2A Dy2B N4 110.0(6) . . ?
N3 Dy2B N4 82.1(4) . . ?
Dy2A Dy2B O8 89.1(6) . . ?
N3 Dy2B O8 91.3(4) . . ?
N4 Dy2B O8 137.9(5) . . ?
Dy2A Dy2B O11 77.2(7) . . ?
N3 Dy2B O11 92.0(4) . . ?
N4 Dy2B O11 75.8(3) . . ?
O8 Dy2B O11 146.3(4) . . ?
Dy2A Dy2B O7 72.5(7) . . ?
N3 Dy2B O7 125.8(5) . . ?
N4 Dy2B O7 78.0(3) . . ?
O8 Dy2B O7 72.5(3) . . ?
O11 Dy2B O7 129.6(4) . . ?
Dy2A Dy2B O12 72.5(6) . . ?
N3 Dy2B O12 88.9(4) . . ?
N4 Dy2B O12 143.6(4) . . ?
O8 Dy2B O12 77.1(3) . . ?
O11 Dy2B O12 69.4(3) . . ?
O7 Dy2B O12 133.3(4) . . ?
Dy2A Dy2B C30 155.9(8) . . ?
N3 Dy2B C30 26.9(3) . . ?
N4 Dy2B C30 56.0(3) . . ?
O8 Dy2B C30 114.5(4) . . ?
O11 Dy2B C30 80.0(3) . . ?
O7 Dy2B C30 117.9(4) . . ?
O12 Dy2B C30 106.6(3) . . ?
Dy2A Dy2B C26 144.2(7) . . ?
N3 Dy2B C26 20.9(3) . . ?
N4 Dy2B C26 103.0(4) . . ?
O8 Dy2B C26 74.9(3) . . ?
O11 Dy2B C26 98.5(3) . . ?
O7 Dy2B C26 129.2(4) . . ?
O12 Dy2B C26 72.9(3) . . ?
C30 Dy2B C26 47.7(3) . . ?
Dy2A Dy2B O9 36.8(4) . . ?
N3 Dy2B O9 150.2(4) . . ?
N4 Dy2B O9 73.2(3) . . ?
O8 Dy2B O9 118.1(4) . . ?
O11 Dy2B O9 66.2(3) . . ?
O7 Dy2B O9 65.3(3) . . ?
O12 Dy2B O9 101.1(4) . . ?
C30 Dy2B O9 124.4(3) . . ?
C26 Dy2B O9 164.7(4) . . ?
Dy2A Dy2B C31 132.9(6) . . ?
N3 Dy2B C31 55.9(3) . . ?
N4 Dy2B C31 27.0(3) . . ?
O8 Dy2B C31 133.8(5) . . ?
O11 Dy2B C31 73.6(3) . . ?
O7 Dy2B C31 99.4(3) . . ?
O12 Dy2B C31 127.0(4) . . ?
C30 Dy2B C31 29.2(3) . . ?
C26 Dy2B C31 76.8(4) . . ?
O9 Dy2B C31 96.9(3) . . ?

_diffrn_measured_fraction_theta_max 0.997
_diffrn_reflns_theta_full        25.00
_diffrn_measured_fraction_theta_full 0.997
_refine_diff_density_max         1.563
_refine_diff_density_min         -1.639
_refine_diff_density_rms         0.138
