# Electronic Supplementary Material (ESI) for Dalton Transactions.
# 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_dym
_database_code_depnum_ccdc_archive 'CCDC 1046436'
_audit_update_record             
;
2015-01-30 deposited with the CCDC.
2015-03-25 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C56 H72 Cl4 Dy4 N20 O14'
_chemical_formula_weight         2041.14

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'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Dy Dy -0.1892 4.4098 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_symmetry_cell_setting           triclinic
_symmetry_space_group_name_H-M   P-1

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

_cell_length_a                   11.6810(9)
_cell_length_b                   12.2354(9)
_cell_length_c                   14.2356(10)
_cell_angle_alpha                75.848(2)
_cell_angle_beta                 69.993(2)
_cell_angle_gamma                67.549(2)
_cell_volume                     1751.6(2)
_cell_formula_units_Z            1
_cell_measurement_temperature    150(2)
_cell_measurement_reflns_used    14369
_cell_measurement_theta_min      3.070
_cell_measurement_theta_max      27.395

_exptl_crystal_description       polyhedral
_exptl_crystal_colour            colorless
_exptl_crystal_size_max          0.16
_exptl_crystal_size_mid          0.11
_exptl_crystal_size_min          0.09
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.935
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             992
_exptl_absorpt_coefficient_mu    4.444
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.5366
_exptl_absorpt_correction_T_max  0.6905
_exptl_absorpt_process_details   ?

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      150(2)
_diffrn_radiation_wavelength     0.71073
_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            16555
_diffrn_reflns_av_R_equivalents  0.0642
_diffrn_reflns_av_sigmaI/netI    0.0838
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_limit_l_max       18
_diffrn_reflns_theta_min         3.07
_diffrn_reflns_theta_max         27.39
_reflns_number_total             7829
_reflns_number_gt                6270
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_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)+(0.0800P)²+0.0000P] 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         7829
_refine_ls_number_parameters     444
_refine_ls_number_restraints     13
_refine_ls_R_factor_all          0.0693
_refine_ls_R_factor_gt           0.0571
_refine_ls_wR_factor_ref         0.1458
_refine_ls_wR_factor_gt          0.1372
_refine_ls_goodness_of_fit_ref   1.052
_refine_ls_restrained_S_all      1.056
_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
Dy1 Dy 0.28766(3) 0.38241(3) 0.20931(2) 0.03023(11) Uani 1 1 d . . .
Dy2 Dy 0.52682(3) 0.40399(3) -0.09745(2) 0.02958(11) Uani 1 1 d . . .
Cl1 Cl 0.48067(17) 0.21127(15) 0.27921(14) 0.0404(4) Uani 1 1 d . . .
Cl2 Cl 0.11674(18) 0.65639(18) 0.42572(14) 0.0488(4) Uani 1 1 d . . .
O1 O 0.4783(4) 0.4086(4) 0.0804(3) 0.0300(9) Uani 1 1 d . . .
H1O H 0.5428 0.3578 0.0990 0.036 Uiso 1 1 d R . .
O2 O 0.3140(4) 0.5500(4) 0.2238(3) 0.0339(10) Uani 1 1 d . . .
H2O H 0.2686 0.5912 0.2720 0.041 Uiso 1 1 d R . .
O1W O 0.1958(4) 0.3921(4) 0.3877(3) 0.0395(11) Uani 1 1 d . . .
H1WA H 0.2462 0.3403 0.4203 0.047 Uiso 1 1 d R . .
H1WB H 0.1822 0.4608 0.4009 0.047 Uiso 1 1 d R . .
O2W O 0.7141(5) 0.2562(4) -0.0639(4) 0.0425(11) Uani 1 1 d . . .
H2WA H 0.6992 0.1924 -0.0318 0.051 Uiso 1 1 d R . .
H2WB H 0.7744 0.2405 -0.1179 0.051 Uiso 1 1 d R . .
O3W O 0.9440(6) 0.2062(6) -0.2203(5) 0.0678(17) Uani 1 1 d . . .
H3WA H 0.9329 0.2412 -0.2775 0.081 Uiso 1 1 d R . .
H3WB H 0.9937 0.2321 -0.2066 0.081 Uiso 1 1 d R . .
N1 N 0.1743(5) 0.2159(5) 0.2609(4) 0.0316(12) Uani 1 1 d . . .
N2 N 0.3537(5) 0.2429(5) 0.0891(4) 0.0366(13) Uani 1 1 d . . .
N3 N 0.4344(5) 0.2454(5) -0.0050(4) 0.0369(13) Uani 1 1 d . . .
N4 N 0.3363(5) 0.1127(5) 0.0122(4) 0.0330(12) Uani 1 1 d . . .
N5 N 0.5477(5) 0.2408(5) -0.2030(4) 0.0344(12) Uani 1 1 d . . .
N6 N 0.0360(5) 0.5079(5) 0.2339(4) 0.0370(13) Uani 1 1 d . . .
N7 N 0.2218(5) 0.4929(5) 0.0594(4) 0.0372(13) Uani 1 1 d . . .
N8 N 0.2951(5) 0.4984(5) -0.0357(4) 0.0362(13) Uani 1 1 d . . .
N9 N 0.0928(5) 0.6091(5) -0.0391(4) 0.0387(14) Uani 1 1 d . . .
N10 N 0.4015(5) 0.5345(5) -0.2335(4) 0.0360(12) Uani 1 1 d . . .
C1 C 0.0952(6) 0.1981(6) 0.3520(5) 0.0333(14) Uani 1 1 d . . .
H1 H 0.0743 0.2497 0.4000 0.040 Uiso 1 1 calc R . .
C2 C 0.0421(7) 0.1066(6) 0.3793(5) 0.0363(15) Uani 1 1 d . . .
H2 H -0.0134 0.0958 0.4449 0.044 Uiso 1 1 calc R . .
C3 C 0.0713(7) 0.0316(6) 0.3094(6) 0.0431(17) Uani 1 1 d . . .
H3 H 0.0354 -0.0308 0.3264 0.052 Uiso 1 1 calc R . .
C4 C 0.1541(7) 0.0489(6) 0.2138(5) 0.0384(15) Uani 1 1 d . . .
H4 H 0.1763 -0.0012 0.1645 0.046 Uiso 1 1 calc R . .
C5 C 0.2031(6) 0.1421(6) 0.1933(5) 0.0327(14) Uani 1 1 d . . .
C6 C 0.2974(6) 0.1630(5) 0.0973(5) 0.0292(13) Uani 1 1 d . . .
C7 C 0.4222(7) 0.1677(6) -0.0494(5) 0.0380(16) Uani 1 1 d . . .
C8 C 0.4924(6) 0.1561(6) -0.1559(5) 0.0319(14) Uani 1 1 d . . .
C9 C 0.5025(6) 0.0648(6) -0.2044(5) 0.0359(14) Uani 1 1 d . . .
H9 H 0.4639 0.0055 -0.1686 0.043 Uiso 1 1 calc R . .
C10 C 0.5691(7) 0.0626(6) -0.3044(6) 0.0405(16) Uani 1 1 d . . .
H10 H 0.5761 0.0020 -0.3390 0.049 Uiso 1 1 calc R . .
C11 C 0.6261(7) 0.1493(6) -0.3551(5) 0.0398(16) Uani 1 1 d . . .
H11 H 0.6718 0.1502 -0.4246 0.048 Uiso 1 1 calc R . .
C12 C 0.6139(7) 0.2352(6) -0.3000(5) 0.0390(16) Uani 1 1 d . . .
H12 H 0.6551 0.2932 -0.3336 0.047 Uiso 1 1 calc R . .
C13 C -0.0569(7) 0.5191(7) 0.3226(5) 0.0386(16) Uani 1 1 d . . .
H13 H -0.0317 0.4764 0.3816 0.046 Uiso 1 1 calc R . .
C14 C -0.1855(7) 0.5873(7) 0.3351(6) 0.0435(17) Uani 1 1 d . . .
H14 H -0.2460 0.5917 0.3998 0.052 Uiso 1 1 calc R . .
C15 C -0.2220(7) 0.6494(7) 0.2479(6) 0.0492(19) Uani 1 1 d . . .
H15 H -0.3092 0.6969 0.2523 0.059 Uiso 1 1 calc R . .
C16 C -0.1295(7) 0.6411(7) 0.1543(6) 0.0438(17) Uani 1 1 d . . .
H16 H -0.1530 0.6826 0.0944 0.053 Uiso 1 1 calc R . .
C17 C -0.0028(6) 0.5714(6) 0.1502(5) 0.0367(15) Uani 1 1 d . . .
C18 C 0.1011(6) 0.5602(6) 0.0553(5) 0.0365(15) Uani 1 1 d . . .
C19 C 0.2175(7) 0.5676(6) -0.0926(5) 0.0357(15) Uani 1 1 d . . .
C20 C 0.2721(7) 0.5904(6) -0.2019(5) 0.0386(16) Uani 1 1 d . . .
C21 C 0.2010(7) 0.6604(7) -0.2685(5) 0.0411(16) Uani 1 1 d . . .
H21 H 0.1110 0.6998 -0.2440 0.049 Uiso 1 1 calc R . .
C22 C 0.2608(7) 0.6724(7) -0.3690(6) 0.0451(17) Uani 1 1 d . . .
H22 H 0.2123 0.7177 -0.4155 0.054 Uiso 1 1 calc R . .
C23 C 0.3928(8) 0.6179(7) -0.4033(6) 0.0442(18) Uani 1 1 d . . .
H23 H 0.4364 0.6266 -0.4731 0.053 Uiso 1 1 calc R . .
C24 C 0.4596(7) 0.5505(6) -0.3334(5) 0.0374(15) Uani 1 1 d . . .
H24 H 0.5503 0.5140 -0.3568 0.045 Uiso 1 1 calc R . .
O3 O 0.7435(6) 0.0455(5) 0.0400(5) 0.0608(16) Uani 1 1 d . . .
H3O H 0.7415 -0.0061 0.0105 0.073 Uiso 1 1 d R . .
C25 C 0.8229(9) -0.0119(8) 0.1063(7) 0.062(2) Uani 1 1 d . . .
H25A H 0.9051 -0.0683 0.0715 0.075 Uiso 1 1 calc R . .
H25B H 0.7788 -0.0572 0.1658 0.075 Uiso 1 1 calc R . .
C26 C 0.8492(10) 0.0831(9) 0.1395(8) 0.075(3) Uani 1 1 d . . .
H26A H 0.8972 0.0459 0.1901 0.112 Uiso 1 1 calc R . .
H26B H 0.7672 0.1424 0.1688 0.112 Uiso 1 1 calc R . .
H26C H 0.9001 0.1224 0.0811 0.112 Uiso 1 1 calc R . .
O4 O 0.3372(8) 0.2197(7) 0.5064(5) 0.094(2) Uani 1 1 d . . .
H4O H 0.4087 0.1866 0.4656 0.113 Uiso 1 1 d R . .
C27 C 0.3178(14) 0.1204(11) 0.5788(10) 0.108(4) Uani 1 1 d DU . .
H27A H 0.2738 0.1496 0.6453 0.129 Uiso 1 1 calc R . .
H27B H 0.4040 0.0637 0.5822 0.129 Uiso 1 1 calc R . .
C28 C 0.2456(13) 0.0525(12) 0.5663(10) 0.114(4) Uani 1 1 d DU . .
H28A H 0.2400 -0.0115 0.6229 0.170 Uiso 1 1 calc R . .
H28B H 0.2898 0.0178 0.5030 0.170 Uiso 1 1 calc R . .
H28C H 0.1585 0.1057 0.5648 0.170 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 O2 2.252(4) . ?
Dy1 O1W 2.408(5) . ?
Dy1 O1 2.427(4) . ?
Dy1 N7 2.428(6) . ?
Dy1 N2 2.440(6) . ?
Dy1 N1 2.666(5) . ?
Dy1 N6 2.690(6) . ?
Dy1 Cl1 2.7144(17) . ?
Dy1 Dy2 3.7405(4) 2_665 ?
Dy1 Dy2 4.3123(5) . ?
Dy2 O2 2.242(4) 2_665 ?
Dy2 O1 2.341(4) 2_665 ?
Dy2 O2W 2.357(5) . ?
Dy2 O1 2.408(4) . ?
Dy2 N8 2.432(6) . ?
Dy2 N3 2.459(6) . ?
Dy2 N10 2.662(6) . ?
Dy2 N5 2.674(6) . ?
Dy2 Dy1 3.7405(4) 2_665 ?
Dy2 Dy2 3.8056(6) 2_665 ?
O1 Dy2 2.341(4) 2_665 ?
O1 H1O 0.8500 . ?
O2 Dy2 2.242(4) 2_665 ?
O2 H2O 0.8500 . ?
O1W H1WA 0.8500 . ?
O1W H1WB 0.8499 . ?
O2W H2WA 0.8501 . ?
O2W H2WB 0.8500 . ?
O3W H3WA 0.8500 . ?
O3W H3WB 0.8501 . ?
N1 C1 1.334(8) . ?
N1 C5 1.351(8) . ?
N2 C6 1.336(8) . ?
N2 N3 1.350(8) . ?
N3 C7 1.335(8) . ?
N4 C6 1.352(8) . ?
N4 C7 1.361(9) . ?
N5 C12 1.335(9) . ?
N5 C8 1.348(8) . ?
N6 C13 1.350(9) . ?
N6 C17 1.369(8) . ?
N7 N8 1.333(8) . ?
N7 C18 1.348(8) . ?
N8 C19 1.333(8) . ?
N9 C18 1.350(8) . ?
N9 C19 1.351(9) . ?
N10 C24 1.352(9) . ?
N10 C20 1.361(9) . ?
C1 C2 1.393(9) . ?
C1 H1 0.9500 . ?
C2 C3 1.386(10) . ?
C2 H2 0.9500 . ?
C3 C4 1.395(10) . ?
C3 H3 0.9500 . ?
C4 C5 1.390(9) . ?
C4 H4 0.9500 . ?
C5 C6 1.469(9) . ?
C7 C8 1.469(10) . ?
C8 C9 1.399(9) . ?
C9 C10 1.370(10) . ?
C9 H9 0.9500 . ?
C10 C11 1.388(10) . ?
C10 H10 0.9500 . ?
C11 C12 1.397(10) . ?
C11 H11 0.9500 . ?
C12 H12 0.9500 . ?
C13 C14 1.385(10) . ?
C13 H13 0.9500 . ?
C14 C15 1.397(10) . ?
C14 H14 0.9500 . ?
C15 C16 1.397(10) . ?
C15 H15 0.9500 . ?
C16 C17 1.386(9) . ?
C16 H16 0.9500 . ?
C17 C18 1.470(10) . ?
C19 C20 1.466(10) . ?
C20 C21 1.386(9) . ?
C21 C22 1.360(10) . ?
C21 H21 0.9500 . ?
C22 C23 1.385(10) . ?
C22 H22 0.9500 . ?
C23 C24 1.385(9) . ?
C23 H23 0.9500 . ?
C24 H24 0.9500 . ?
O3 C25 1.423(9) . ?
O3 H3O 0.8500 . ?
C25 C26 1.519(12) . ?
C25 H25A 0.9900 . ?
C25 H25B 0.9900 . ?
C26 H26A 0.9800 . ?
C26 H26B 0.9800 . ?
C26 H26C 0.9800 . ?
O4 C27 1.424(13) . ?
O4 H4O 0.8499 . ?
C27 C28 1.464(9) . ?
C27 H27A 0.9900 . ?
C27 H27B 0.9900 . ?
C28 H28A 0.9800 . ?
C28 H28B 0.9800 . ?
C28 H28C 0.9800 . ?

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
O2 Dy1 O1W 78.51(16) . . ?
O2 Dy1 O1 70.72(16) . . ?
O1W Dy1 O1 137.18(15) . . ?
O2 Dy1 N7 86.10(18) . . ?
O1W Dy1 N7 134.96(18) . . ?
O1 Dy1 N7 72.46(16) . . ?
O2 Dy1 N2 141.16(18) . . ?
O1W Dy1 N2 139.23(18) . . ?
O1 Dy1 N2 72.34(16) . . ?
N7 Dy1 N2 71.68(19) . . ?
O2 Dy1 N1 155.42(17) . . ?
O1W Dy1 N1 79.64(16) . . ?
O1 Dy1 N1 133.83(16) . . ?
N7 Dy1 N1 101.67(17) . . ?
N2 Dy1 N1 62.75(17) . . ?
O2 Dy1 N6 87.36(16) . . ?
O1W Dy1 N6 74.39(17) . . ?
O1 Dy1 N6 131.20(16) . . ?
N7 Dy1 N6 62.74(18) . . ?
N2 Dy1 N6 108.61(18) . . ?
N1 Dy1 N6 76.00(17) . . ?
O2 Dy1 Cl1 101.50(12) . . ?
O1W Dy1 Cl1 79.93(12) . . ?
O1 Dy1 Cl1 77.91(11) . . ?
N7 Dy1 Cl1 144.98(14) . . ?
N2 Dy1 Cl1 81.95(14) . . ?
N1 Dy1 Cl1 85.56(12) . . ?
N6 Dy1 Cl1 150.58(13) . . ?
O2 Dy1 Dy2 33.57(11) . 2_665 ?
O1W Dy1 Dy2 109.37(11) . 2_665 ?
O1 Dy1 Dy2 37.51(10) . 2_665 ?
N7 Dy1 Dy2 73.61(13) . 2_665 ?
N2 Dy1 Dy2 108.03(13) . 2_665 ?
N1 Dy1 Dy2 170.77(12) . 2_665 ?
N6 Dy1 Dy2 107.89(12) . 2_665 ?
Cl1 Dy1 Dy2 93.92(4) . 2_665 ?
O2 Dy1 Dy2 88.34(11) . . ?
O1W Dy1 Dy2 163.74(11) . . ?
O1 Dy1 Dy2 26.77(10) . . ?
N7 Dy1 Dy2 52.16(13) . . ?
N2 Dy1 Dy2 52.85(13) . . ?
N1 Dy1 Dy2 114.94(11) . . ?
N6 Dy1 Dy2 114.90(12) . . ?
Cl1 Dy1 Dy2 93.54(4) . . ?
Dy2 Dy1 Dy2 55.862(9) 2_665 . ?
O2 Dy2 O1 72.52(16) 2_665 2_665 ?
O2 Dy2 O2W 76.92(17) 2_665 . ?
O1 Dy2 O2W 109.84(16) 2_665 . ?
O2 Dy2 O1 128.69(15) 2_665 . ?
O1 Dy2 O1 73.48(17) 2_665 . ?
O2W Dy2 O1 79.88(16) . . ?
O2 Dy2 N8 135.48(18) 2_665 . ?
O1 Dy2 N8 80.43(17) 2_665 . ?
O2W Dy2 N8 146.77(18) . . ?
O1 Dy2 N8 72.84(16) . . ?
O2 Dy2 N3 145.49(18) 2_665 . ?
O1 Dy2 N3 140.84(17) 2_665 . ?
O2W Dy2 N3 81.05(18) . . ?
O1 Dy2 N3 71.70(16) . . ?
N8 Dy2 N3 72.71(19) . . ?
O2 Dy2 N10 78.61(16) 2_665 . ?
O1 Dy2 N10 81.80(16) 2_665 . ?
O2W Dy2 N10 147.93(18) . . ?
O1 Dy2 N10 132.04(16) . . ?
N8 Dy2 N10 62.81(18) . . ?
N3 Dy2 N10 109.20(17) . . ?
O2 Dy2 N5 87.78(16) 2_665 . ?
O1 Dy2 N5 153.66(16) 2_665 . ?
O2W Dy2 N5 81.47(16) . . ?
O1 Dy2 N5 132.77(15) . . ?
N8 Dy2 N5 103.38(17) . . ?
N3 Dy2 N5 62.73(18) . . ?
N10 Dy2 N5 77.17(16) . . ?
O2 Dy2 Dy1 33.75(11) 2_665 2_665 ?
O1 Dy2 Dy1 39.14(11) 2_665 2_665 ?
O2W Dy2 Dy1 89.27(12) . 2_665 ?
O1 Dy2 Dy1 101.86(10) . 2_665 ?
N8 Dy2 Dy1 114.36(14) . 2_665 ?
N3 Dy2 Dy1 169.13(13) . 2_665 ?
N10 Dy2 Dy1 81.64(12) . 2_665 ?
N5 Dy2 Dy1 120.89(12) . 2_665 ?
O2 Dy2 Dy2 102.17(11) 2_665 2_665 ?
O1 Dy2 Dy2 37.35(11) 2_665 2_665 ?
O2W Dy2 Dy2 95.60(12) . 2_665 ?
O1 Dy2 Dy2 36.13(10) . 2_665 ?
N8 Dy2 Dy2 73.21(13) . 2_665 ?
N3 Dy2 Dy2 106.15(13) . 2_665 ?
N10 Dy2 Dy2 109.64(12) . 2_665 ?
N5 Dy2 Dy2 168.77(12) . 2_665 ?
Dy1 Dy2 Dy2 69.698(10) 2_665 2_665 ?
O2 Dy2 Dy1 155.13(11) 2_665 . ?
O1 Dy2 Dy1 88.35(11) 2_665 . ?
O2W Dy2 Dy1 95.57(12) . . ?
O1 Dy2 Dy1 27.00(9) . . ?
N8 Dy2 Dy1 52.21(13) . . ?
N3 Dy2 Dy1 52.68(13) . . ?
N10 Dy2 Dy1 115.01(12) . . ?
N5 Dy2 Dy1 114.85(12) . . ?
Dy1 Dy2 Dy1 124.138(9) 2_665 . ?
Dy2 Dy2 Dy1 54.440(9) 2_665 . ?
Dy2 O1 Dy2 106.52(17) 2_665 . ?
Dy2 O1 Dy1 103.35(17) 2_665 . ?
Dy2 O1 Dy1 126.23(16) . . ?
Dy2 O1 H1O 106.4 2_665 . ?
Dy2 O1 H1O 106.5 . . ?
Dy1 O1 H1O 106.5 . . ?
Dy2 O2 Dy1 112.68(19) 2_665 . ?
Dy2 O2 H2O 123.7 2_665 . ?
Dy1 O2 H2O 123.6 . . ?
Dy1 O1W H1WA 110.6 . . ?
Dy1 O1W H1WB 110.5 . . ?
H1WA O1W H1WB 108.8 . . ?
Dy2 O2W H2WA 111.6 . . ?
Dy2 O2W H2WB 111.4 . . ?
H2WA O2W H2WB 109.4 . . ?
H3WA O3W H3WB 108.8 . . ?
C1 N1 C5 118.3(6) . . ?
C1 N1 Dy1 123.1(4) . . ?
C5 N1 Dy1 118.5(4) . . ?
C6 N2 N3 106.3(5) . . ?
C6 N2 Dy1 125.2(4) . . ?
N3 N2 Dy1 127.4(4) . . ?
C7 N3 N2 106.4(6) . . ?
C7 N3 Dy2 123.8(5) . . ?
N2 N3 Dy2 126.8(4) . . ?
C6 N4 C7 101.5(5) . . ?
C12 N5 C8 117.2(6) . . ?
C12 N5 Dy2 123.9(4) . . ?
C8 N5 Dy2 118.9(4) . . ?
C13 N6 C17 115.8(6) . . ?
C13 N6 Dy1 126.0(4) . . ?
C17 N6 Dy1 118.1(4) . . ?
N8 N7 C18 105.4(5) . . ?
N8 N7 Dy1 128.0(4) . . ?
C18 N7 Dy1 126.6(5) . . ?
C19 N8 N7 107.0(5) . . ?
C19 N8 Dy2 125.4(5) . . ?
N7 N8 Dy2 127.6(4) . . ?
C18 N9 C19 100.8(5) . . ?
C24 N10 C20 117.3(6) . . ?
C24 N10 Dy2 123.6(4) . . ?
C20 N10 Dy2 119.0(4) . . ?
N1 C1 C2 122.3(6) . . ?
N1 C1 H1 118.9 . . ?
C2 C1 H1 118.9 . . ?
C3 C2 C1 119.2(6) . . ?
C3 C2 H2 120.4 . . ?
C1 C2 H2 120.4 . . ?
C2 C3 C4 119.2(6) . . ?
C2 C3 H3 120.4 . . ?
C4 C3 H3 120.4 . . ?
C5 C4 C3 117.7(7) . . ?
C5 C4 H4 121.1 . . ?
C3 C4 H4 121.1 . . ?
N1 C5 C4 123.3(6) . . ?
N1 C5 C6 114.7(6) . . ?
C4 C5 C6 121.9(6) . . ?
N2 C6 N4 113.1(6) . . ?
N2 C6 C5 118.1(6) . . ?
N4 C6 C5 128.8(6) . . ?
N3 C7 N4 112.8(6) . . ?
N3 C7 C8 119.2(6) . . ?
N4 C7 C8 127.9(6) . . ?
N5 C8 C9 122.7(6) . . ?
N5 C8 C7 114.0(6) . . ?
C9 C8 C7 123.3(6) . . ?
C10 C9 C8 118.8(6) . . ?
C10 C9 H9 120.6 . . ?
C8 C9 H9 120.6 . . ?
C9 C10 C11 119.7(7) . . ?
C9 C10 H10 120.1 . . ?
C11 C10 H10 120.1 . . ?
C10 C11 C12 117.5(7) . . ?
C10 C11 H11 121.2 . . ?
C12 C11 H11 121.2 . . ?
N5 C12 C11 124.1(6) . . ?
N5 C12 H12 118.0 . . ?
C11 C12 H12 118.0 . . ?
N6 C13 C14 125.8(7) . . ?
N6 C13 H13 117.1 . . ?
C14 C13 H13 117.1 . . ?
C13 C14 C15 116.9(7) . . ?
C13 C14 H14 121.6 . . ?
C15 C14 H14 121.6 . . ?
C14 C15 C16 119.6(7) . . ?
C14 C15 H15 120.2 . . ?
C16 C15 H15 120.2 . . ?
C17 C16 C15 118.9(7) . . ?
C17 C16 H16 120.5 . . ?
C15 C16 H16 120.5 . . ?
N6 C17 C16 123.0(7) . . ?
N6 C17 C18 114.5(6) . . ?
C16 C17 C18 122.5(6) . . ?
N7 C18 N9 113.5(6) . . ?
N7 C18 C17 118.1(6) . . ?
N9 C18 C17 128.4(6) . . ?
N8 C19 N9 113.3(6) . . ?
N8 C19 C20 119.3(6) . . ?
N9 C19 C20 127.5(6) . . ?
N10 C20 C21 122.1(7) . . ?
N10 C20 C19 113.5(6) . . ?
C21 C20 C19 124.4(6) . . ?
C22 C21 C20 119.6(7) . . ?
C22 C21 H21 120.2 . . ?
C20 C21 H21 120.2 . . ?
C21 C22 C23 119.6(7) . . ?
C21 C22 H22 120.2 . . ?
C23 C22 H22 120.2 . . ?
C24 C23 C22 118.5(7) . . ?
C24 C23 H23 120.7 . . ?
C22 C23 H23 120.7 . . ?
N10 C24 C23 122.9(7) . . ?
N10 C24 H24 118.6 . . ?
C23 C24 H24 118.6 . . ?
C25 O3 H3O 109.7 . . ?
O3 C25 C26 108.4(7) . . ?
O3 C25 H25A 110.0 . . ?
C26 C25 H25A 110.0 . . ?
O3 C25 H25B 110.0 . . ?
C26 C25 H25B 110.0 . . ?
H25A C25 H25B 108.4 . . ?
C25 C26 H26A 109.5 . . ?
C25 C26 H26B 109.5 . . ?
H26A C26 H26B 109.5 . . ?
C25 C26 H26C 109.5 . . ?
H26A C26 H26C 109.5 . . ?
H26B C26 H26C 109.5 . . ?
C27 O4 H4O 101.3 . . ?
O4 C27 C28 120.0(11) . . ?
O4 C27 H27A 107.3 . . ?
C28 C27 H27A 107.3 . . ?
O4 C27 H27B 107.3 . . ?
C28 C27 H27B 107.3 . . ?
H27A C27 H27B 106.9 . . ?
C27 C28 H28A 109.5 . . ?
C27 C28 H28B 109.5 . . ?
H28A C28 H28B 109.5 . . ?
C27 C28 H28C 109.5 . . ?
H28A C28 H28C 109.5 . . ?
H28B C28 H28C 109.5 . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
O2 Dy1 Dy2 O2 31.3(4) . . . 2_665 ?
O1W Dy1 Dy2 O2 -4.6(5) . . . 2_665 ?
O1 Dy1 Dy2 O2 -16.2(3) . . . 2_665 ?
N7 Dy1 Dy2 O2 117.6(3) . . . 2_665 ?
N2 Dy1 Dy2 O2 -147.3(3) . . . 2_665 ?
N1 Dy1 Dy2 O2 -156.9(3) . . . 2_665 ?
N6 Dy1 Dy2 O2 117.6(3) . . . 2_665 ?
Cl1 Dy1 Dy2 O2 -70.2(3) . . . 2_665 ?
Dy2 Dy1 Dy2 O2 22.2(3) 2_665 . . 2_665 ?
O2 Dy1 Dy2 O1 -7.77(14) . . . 2_665 ?
O1W Dy1 Dy2 O1 -43.6(4) . . . 2_665 ?
O1 Dy1 Dy2 O1 -55.2(3) . . . 2_665 ?
N7 Dy1 Dy2 O1 78.6(2) . . . 2_665 ?
N2 Dy1 Dy2 O1 173.69(19) . . . 2_665 ?
N1 Dy1 Dy2 O1 164.06(16) . . . 2_665 ?
N6 Dy1 Dy2 O1 78.55(16) . . . 2_665 ?
Cl1 Dy1 Dy2 O1 -109.20(11) . . . 2_665 ?
Dy2 Dy1 Dy2 O1 -16.87(10) 2_665 . . 2_665 ?
O2 Dy1 Dy2 O2W 102.00(16) . . . . ?
O1W Dy1 Dy2 O2W 66.2(4) . . . . ?
O1 Dy1 Dy2 O2W 54.5(3) . . . . ?
N7 Dy1 Dy2 O2W -171.6(2) . . . . ?
N2 Dy1 Dy2 O2W -76.5(2) . . . . ?
N1 Dy1 Dy2 O2W -86.17(17) . . . . ?
N6 Dy1 Dy2 O2W -171.68(18) . . . . ?
Cl1 Dy1 Dy2 O2W 0.58(12) . . . . ?
Dy2 Dy1 Dy2 O2W 92.91(12) 2_665 . . . ?
O2 Dy1 Dy2 O1 47.5(3) . . . . ?
O1W Dy1 Dy2 O1 11.7(5) . . . . ?
N7 Dy1 Dy2 O1 133.8(3) . . . . ?
N2 Dy1 Dy2 O1 -131.1(3) . . . . ?
N1 Dy1 Dy2 O1 -140.7(3) . . . . ?
N6 Dy1 Dy2 O1 133.8(3) . . . . ?
Cl1 Dy1 Dy2 O1 -53.9(2) . . . . ?
Dy2 Dy1 Dy2 O1 38.4(2) 2_665 . . . ?
O2 Dy1 Dy2 N8 -86.9(2) . . . . ?
O1W Dy1 Dy2 N8 -122.8(5) . . . . ?
O1 Dy1 Dy2 N8 -134.4(3) . . . . ?
N7 Dy1 Dy2 N8 -0.6(2) . . . . ?
N2 Dy1 Dy2 N8 94.5(2) . . . . ?
N1 Dy1 Dy2 N8 84.9(2) . . . . ?
N6 Dy1 Dy2 N8 -0.6(2) . . . . ?
Cl1 Dy1 Dy2 N8 171.64(18) . . . . ?
Dy2 Dy1 Dy2 N8 -96.02(17) 2_665 . . . ?
O2 Dy1 Dy2 N3 176.3(2) . . . . ?
O1W Dy1 Dy2 N3 140.5(5) . . . . ?
O1 Dy1 Dy2 N3 128.8(3) . . . . ?
N7 Dy1 Dy2 N3 -97.4(2) . . . . ?
N2 Dy1 Dy2 N3 -2.3(2) . . . . ?
N1 Dy1 Dy2 N3 -11.9(2) . . . . ?
N6 Dy1 Dy2 N3 -97.4(2) . . . . ?
Cl1 Dy1 Dy2 N3 74.86(17) . . . . ?
Dy2 Dy1 Dy2 N3 167.19(17) 2_665 . . . ?
O2 Dy1 Dy2 N10 -87.94(17) . . . . ?
O1W Dy1 Dy2 N10 -123.8(4) . . . . ?
O1 Dy1 Dy2 N10 -135.4(3) . . . . ?
N7 Dy1 Dy2 N10 -1.6(2) . . . . ?
N2 Dy1 Dy2 N10 93.5(2) . . . . ?
N1 Dy1 Dy2 N10 83.90(18) . . . . ?
N6 Dy1 Dy2 N10 -1.62(19) . . . . ?
Cl1 Dy1 Dy2 N10 170.64(14) . . . . ?
Dy2 Dy1 Dy2 N10 -97.03(13) 2_665 . . . ?
O2 Dy1 Dy2 N5 -174.84(16) . . . . ?
O1W Dy1 Dy2 N5 149.3(4) . . . . ?
O1 Dy1 Dy2 N5 137.7(3) . . . . ?
N7 Dy1 Dy2 N5 -88.5(2) . . . . ?
N2 Dy1 Dy2 N5 6.6(2) . . . . ?
N1 Dy1 Dy2 N5 -3.01(17) . . . . ?
N6 Dy1 Dy2 N5 -88.52(18) . . . . ?
Cl1 Dy1 Dy2 N5 83.73(13) . . . . ?
Dy2 Dy1 Dy2 N5 176.07(12) 2_665 . . . ?
O2 Dy1 Dy2 Dy1 9.09(11) . . . 2_665 ?
O1W Dy1 Dy2 Dy1 -26.7(4) . . . 2_665 ?
O1 Dy1 Dy2 Dy1 -38.4(2) . . . 2_665 ?
N7 Dy1 Dy2 Dy1 95.44(17) . . . 2_665 ?
N2 Dy1 Dy2 Dy1 -169.44(17) . . . 2_665 ?
N1 Dy1 Dy2 Dy1 -179.07(12) . . . 2_665 ?
N6 Dy1 Dy2 Dy1 95.41(13) . . . 2_665 ?
Cl1 Dy1 Dy2 Dy1 -92.33(4) . . . 2_665 ?
Dy2 Dy1 Dy2 Dy1 0.0 2_665 . . 2_665 ?
O2 Dy1 Dy2 Dy2 9.09(11) . . . 2_665 ?
O1W Dy1 Dy2 Dy2 -26.7(4) . . . 2_665 ?
O1 Dy1 Dy2 Dy2 -38.4(2) . . . 2_665 ?
N7 Dy1 Dy2 Dy2 95.44(17) . . . 2_665 ?
N2 Dy1 Dy2 Dy2 -169.44(17) . . . 2_665 ?
N1 Dy1 Dy2 Dy2 -179.07(12) . . . 2_665 ?
N6 Dy1 Dy2 Dy2 95.41(13) . . . 2_665 ?
Cl1 Dy1 Dy2 Dy2 -92.33(4) . . . 2_665 ?
O2 Dy2 O1 Dy2 50.3(3) 2_665 . . 2_665 ?
O1 Dy2 O1 Dy2 0.0 2_665 . . 2_665 ?
O2W Dy2 O1 Dy2 114.36(19) . . . 2_665 ?
N8 Dy2 O1 Dy2 -84.8(2) . . . 2_665 ?
N3 Dy2 O1 Dy2 -161.8(2) . . . 2_665 ?
N10 Dy2 O1 Dy2 -62.1(2) . . . 2_665 ?
N5 Dy2 O1 Dy2 -177.38(16) . . . 2_665 ?
Dy1 Dy2 O1 Dy2 27.27(15) 2_665 . . 2_665 ?
Dy1 Dy2 O1 Dy2 -121.1(3) . . . 2_665 ?
O2 Dy2 O1 Dy1 171.35(18) 2_665 . . . ?
O1 Dy2 O1 Dy1 121.1(3) 2_665 . . . ?
O2W Dy2 O1 Dy1 -124.6(2) . . . . ?
N8 Dy2 O1 Dy1 36.2(2) . . . . ?
N3 Dy2 O1 Dy1 -40.7(2) . . . . ?
N10 Dy2 O1 Dy1 58.9(3) . . . . ?
N5 Dy2 O1 Dy1 -56.3(3) . . . . ?
Dy1 Dy2 O1 Dy1 148.32(18) 2_665 . . . ?
Dy2 Dy2 O1 Dy1 121.1(3) 2_665 . . . ?
O2 Dy1 O1 Dy2 -6.27(14) . . . 2_665 ?
O1W Dy1 O1 Dy2 -52.8(3) . . . 2_665 ?
N7 Dy1 O1 Dy2 85.73(19) . . . 2_665 ?
N2 Dy1 O1 Dy2 161.5(2) . . . 2_665 ?
N1 Dy1 O1 Dy2 175.20(15) . . . 2_665 ?
N6 Dy1 O1 Dy2 61.9(2) . . . 2_665 ?
Cl1 Dy1 O1 Dy2 -113.19(14) . . . 2_665 ?
Dy2 Dy1 O1 Dy2 122.4(3) . . . 2_665 ?
O2 Dy1 O1 Dy2 -128.7(3) . . . . ?
O1W Dy1 O1 Dy2 -175.23(19) . . . . ?
N7 Dy1 O1 Dy2 -36.7(2) . . . . ?
N2 Dy1 O1 Dy2 39.1(2) . . . . ?
N1 Dy1 O1 Dy2 52.8(3) . . . . ?
N6 Dy1 O1 Dy2 -60.5(3) . . . . ?
Cl1 Dy1 O1 Dy2 124.4(2) . . . . ?
Dy2 Dy1 O1 Dy2 -122.4(3) 2_665 . . . ?
O1W Dy1 O2 Dy2 156.7(2) . . . 2_665 ?
O1 Dy1 O2 Dy2 6.91(15) . . . 2_665 ?
N7 Dy1 O2 Dy2 -65.9(2) . . . 2_665 ?
N2 Dy1 O2 Dy2 -11.8(4) . . . 2_665 ?
N1 Dy1 O2 Dy2 -175.6(3) . . . 2_665 ?
N6 Dy1 O2 Dy2 -128.7(2) . . . 2_665 ?
Cl1 Dy1 O2 Dy2 79.59(18) . . . 2_665 ?
Dy2 Dy1 O2 Dy2 -13.69(17) . . . 2_665 ?
O2 Dy1 N1 C1 -18.7(7) . . . . ?
O1W Dy1 N1 C1 8.9(5) . . . . ?
O1 Dy1 N1 C1 158.0(4) . . . . ?
N7 Dy1 N1 C1 -125.2(5) . . . . ?
N2 Dy1 N1 C1 172.7(5) . . . . ?
N6 Dy1 N1 C1 -67.4(5) . . . . ?
Cl1 Dy1 N1 C1 89.5(5) . . . . ?
Dy2 Dy1 N1 C1 176.5(5) 2_665 . . . ?
Dy2 Dy1 N1 C1 -178.7(4) . . . . ?
O2 Dy1 N1 C5 164.6(4) . . . . ?
O1W Dy1 N1 C5 -167.8(5) . . . . ?
O1 Dy1 N1 C5 -18.7(5) . . . . ?
N7 Dy1 N1 C5 58.1(5) . . . . ?
N2 Dy1 N1 C5 -4.0(4) . . . . ?
N6 Dy1 N1 C5 115.8(5) . . . . ?
Cl1 Dy1 N1 C5 -87.3(4) . . . . ?
Dy2 Dy1 N1 C5 -0.2(10) 2_665 . . . ?
Dy2 Dy1 N1 C5 4.6(5) . . . . ?
O2 Dy1 N2 C6 -164.6(4) . . . . ?
O1W Dy1 N2 C6 32.8(6) . . . . ?
O1 Dy1 N2 C6 176.8(6) . . . . ?
N7 Dy1 N2 C6 -106.3(5) . . . . ?
N1 Dy1 N2 C6 7.9(5) . . . . ?
N6 Dy1 N2 C6 -54.7(5) . . . . ?
Cl1 Dy1 N2 C6 97.0(5) . . . . ?
Dy2 Dy1 N2 C6 -171.4(5) 2_665 . . . ?
Dy2 Dy1 N2 C6 -162.3(6) . . . . ?
O2 Dy1 N2 N3 1.8(7) . . . . ?
O1W Dy1 N2 N3 -160.8(4) . . . . ?
O1 Dy1 N2 N3 -16.8(5) . . . . ?
N7 Dy1 N2 N3 60.1(5) . . . . ?
N1 Dy1 N2 N3 174.3(6) . . . . ?
N6 Dy1 N2 N3 111.7(5) . . . . ?
Cl1 Dy1 N2 N3 -96.6(5) . . . . ?
Dy2 Dy1 N2 N3 -5.1(6) 2_665 . . . ?
Dy2 Dy1 N2 N3 4.1(4) . . . . ?
C6 N2 N3 C7 0.6(7) . . . . ?
Dy1 N2 N3 C7 -167.9(4) . . . . ?
C6 N2 N3 Dy2 161.2(4) . . . . ?
Dy1 N2 N3 Dy2 -7.2(8) . . . . ?
O2 Dy2 N3 C7 -43.6(7) 2_665 . . . ?
O1 Dy2 N3 C7 155.2(5) 2_665 . . . ?
O2W Dy2 N3 C7 -94.3(5) . . . . ?
O1 Dy2 N3 C7 -176.5(6) . . . . ?
N8 Dy2 N3 C7 106.3(5) . . . . ?
N10 Dy2 N3 C7 54.3(6) . . . . ?
N5 Dy2 N3 C7 -9.3(5) . . . . ?
Dy1 Dy2 N3 C7 -121.6(7) 2_665 . . . ?
Dy2 Dy2 N3 C7 172.4(5) 2_665 . . . ?
Dy1 Dy2 N3 C7 161.6(6) . . . . ?
O2 Dy2 N3 N2 158.9(4) 2_665 . . . ?
O1 Dy2 N3 N2 -2.4(7) 2_665 . . . ?
O2W Dy2 N3 N2 108.2(5) . . . . ?
O1 Dy2 N3 N2 25.9(5) . . . . ?
N8 Dy2 N3 N2 -51.2(5) . . . . ?
N10 Dy2 N3 N2 -103.2(5) . . . . ?
N5 Dy2 N3 N2 -166.9(6) . . . . ?
Dy1 Dy2 N3 N2 80.9(9) 2_665 . . . ?
Dy2 Dy2 N3 N2 14.9(5) 2_665 . . . ?
Dy1 Dy2 N3 N2 4.1(4) . . . . ?
O2 Dy2 N5 C12 -12.9(5) 2_665 . . . ?
O1 Dy2 N5 C12 28.0(7) 2_665 . . . ?
O2W Dy2 N5 C12 -90.0(5) . . . . ?
O1 Dy2 N5 C12 -157.6(4) . . . . ?
N8 Dy2 N5 C12 123.5(5) . . . . ?
N3 Dy2 N5 C12 -174.3(6) . . . . ?
N10 Dy2 N5 C12 65.9(5) . . . . ?
Dy1 Dy2 N5 C12 -6.0(5) 2_665 . . . ?
Dy2 Dy2 N5 C12 -165.6(4) 2_665 . . . ?
Dy1 Dy2 N5 C12 177.8(5) . . . . ?
O2 Dy2 N5 C8 164.7(5) 2_665 . . . ?
O1 Dy2 N5 C8 -154.3(4) 2_665 . . . ?
O2W Dy2 N5 C8 87.6(5) . . . . ?
O1 Dy2 N5 C8 20.0(5) . . . . ?
N8 Dy2 N5 C8 -58.9(5) . . . . ?
N3 Dy2 N5 C8 3.3(4) . . . . ?
N10 Dy2 N5 C8 -116.4(5) . . . . ?
Dy1 Dy2 N5 C8 171.6(4) 2_665 . . . ?
Dy2 Dy2 N5 C8 12.1(9) 2_665 . . . ?
Dy1 Dy2 N5 C8 -4.6(5) . . . . ?
O2 Dy1 N6 C13 -90.3(5) . . . . ?
O1W Dy1 N6 C13 -11.5(5) . . . . ?
O1 Dy1 N6 C13 -151.6(5) . . . . ?
N7 Dy1 N6 C13 -177.3(6) . . . . ?
N2 Dy1 N6 C13 125.9(5) . . . . ?
N1 Dy1 N6 C13 71.4(5) . . . . ?
Cl1 Dy1 N6 C13 18.6(7) . . . . ?
Dy2 Dy1 N6 C13 -117.3(5) 2_665 . . . ?
Dy2 Dy1 N6 C13 -177.3(5) . . . . ?
O2 Dy1 N6 C17 86.6(5) . . . . ?
O1W Dy1 N6 C17 165.4(5) . . . . ?
O1 Dy1 N6 C17 25.2(6) . . . . ?
N7 Dy1 N6 C17 -0.4(5) . . . . ?
N2 Dy1 N6 C17 -57.3(5) . . . . ?
N1 Dy1 N6 C17 -111.7(5) . . . . ?
Cl1 Dy1 N6 C17 -164.5(4) . . . . ?
Dy2 Dy1 N6 C17 59.6(5) 2_665 . . . ?
Dy2 Dy1 N6 C17 -0.4(5) . . . . ?
O2 Dy1 N7 N8 92.0(5) . . . . ?
O1W Dy1 N7 N8 161.5(5) . . . . ?
O1 Dy1 N7 N8 21.0(5) . . . . ?
N2 Dy1 N7 N8 -55.7(5) . . . . ?
N1 Dy1 N7 N8 -111.6(5) . . . . ?
N6 Dy1 N7 N8 -179.0(6) . . . . ?
Cl1 Dy1 N7 N8 -12.6(7) . . . . ?
Dy2 Dy1 N7 N8 60.2(5) 2_665 . . . ?
Dy2 Dy1 N7 N8 1.1(4) . . . . ?
O2 Dy1 N7 C18 -89.5(6) . . . . ?
O1W Dy1 N7 C18 -20.0(7) . . . . ?
O1 Dy1 N7 C18 -160.5(6) . . . . ?
N2 Dy1 N7 C18 122.8(6) . . . . ?
N1 Dy1 N7 C18 66.9(6) . . . . ?
N6 Dy1 N7 C18 -0.5(5) . . . . ?
Cl1 Dy1 N7 C18 165.9(4) . . . . ?
Dy2 Dy1 N7 C18 -121.3(6) 2_665 . . . ?
Dy2 Dy1 N7 C18 179.5(6) . . . . ?
C18 N7 N8 C19 0.1(7) . . . . ?
Dy1 N7 N8 C19 178.8(4) . . . . ?
C18 N7 N8 Dy2 179.4(5) . . . . ?
Dy1 N7 N8 Dy2 -1.9(8) . . . . ?
O2 Dy2 N8 C19 32.2(7) 2_665 . . . ?
O1 Dy2 N8 C19 84.9(6) 2_665 . . . ?
O2W Dy2 N8 C19 -163.4(5) . . . . ?
O1 Dy2 N8 C19 160.4(6) . . . . ?
N3 Dy2 N8 C19 -124.0(6) . . . . ?
N10 Dy2 N8 C19 -0.8(5) . . . . ?
N5 Dy2 N8 C19 -68.5(6) . . . . ?
Dy1 Dy2 N8 C19 64.9(6) 2_665 . . . ?
Dy2 Dy2 N8 C19 122.6(6) 2_665 . . . ?
Dy1 Dy2 N8 C19 -179.7(6) . . . . ?
O2 Dy2 N8 N7 -147.0(5) 2_665 . . . ?
O1 Dy2 N8 N7 -94.3(5) 2_665 . . . ?
O2W Dy2 N8 N7 17.4(7) . . . . ?
O1 Dy2 N8 N7 -18.8(5) . . . . ?
N3 Dy2 N8 N7 56.8(5) . . . . ?
N10 Dy2 N8 N7 -180.0(6) . . . . ?
N5 Dy2 N8 N7 112.3(5) . . . . ?
Dy1 Dy2 N8 N7 -114.3(5) 2_665 . . . ?
Dy2 Dy2 N8 N7 -56.6(5) 2_665 . . . ?
Dy1 Dy2 N8 N7 1.1(4) . . . . ?
O2 Dy2 N10 C24 22.8(5) 2_665 . . . ?
O1 Dy2 N10 C24 96.5(5) 2_665 . . . ?
O2W Dy2 N10 C24 -18.1(7) . . . . ?
O1 Dy2 N10 C24 155.4(5) . . . . ?
N8 Dy2 N10 C24 179.9(6) . . . . ?
N3 Dy2 N10 C24 -122.3(5) . . . . ?
N5 Dy2 N10 C24 -67.5(5) . . . . ?
Dy1 Dy2 N10 C24 56.9(5) 2_665 . . . ?
Dy2 Dy2 N10 C24 121.8(5) 2_665 . . . ?
Dy1 Dy2 N10 C24 -179.2(5) . . . . ?
O2 Dy2 N10 C20 -156.1(5) 2_665 . . . ?
O1 Dy2 N10 C20 -82.3(5) 2_665 . . . ?
O2W Dy2 N10 C20 163.1(4) . . . . ?
O1 Dy2 N10 C20 -23.5(6) . . . . ?
N8 Dy2 N10 C20 1.1(5) . . . . ?
N3 Dy2 N10 C20 58.9(5) . . . . ?
N5 Dy2 N10 C20 113.6(5) . . . . ?
Dy1 Dy2 N10 C20 -121.9(5) 2_665 . . . ?
Dy2 Dy2 N10 C20 -57.1(5) 2_665 . . . ?
Dy1 Dy2 N10 C20 2.0(5) . . . . ?
C5 N1 C1 C2 0.1(9) . . . . ?
Dy1 N1 C1 C2 -176.6(5) . . . . ?
N1 C1 C2 C3 -0.5(10) . . . . ?
C1 C2 C3 C4 0.6(10) . . . . ?
C2 C3 C4 C5 -0.3(10) . . . . ?
C1 N1 C5 C4 0.2(9) . . . . ?
Dy1 N1 C5 C4 177.0(5) . . . . ?
C1 N1 C5 C6 -176.2(5) . . . . ?
Dy1 N1 C5 C6 0.7(7) . . . . ?
C3 C4 C5 N1 -0.1(10) . . . . ?
C3 C4 C5 C6 176.0(6) . . . . ?
N3 N2 C6 N4 -0.5(7) . . . . ?
Dy1 N2 C6 N4 168.2(4) . . . . ?
N3 N2 C6 C5 -179.8(5) . . . . ?
Dy1 N2 C6 C5 -11.0(8) . . . . ?
C7 N4 C6 N2 0.3(7) . . . . ?
C7 N4 C6 C5 179.4(6) . . . . ?
N1 C5 C6 N2 6.0(8) . . . . ?
C4 C5 C6 N2 -170.4(6) . . . . ?
N1 C5 C6 N4 -173.1(6) . . . . ?
C4 C5 C6 N4 10.5(10) . . . . ?
N2 N3 C7 N4 -0.4(8) . . . . ?
Dy2 N3 C7 N4 -161.8(4) . . . . ?
N2 N3 C7 C8 176.0(6) . . . . ?
Dy2 N3 C7 C8 14.6(9) . . . . ?
C6 N4 C7 N3 0.1(7) . . . . ?
C6 N4 C7 C8 -176.0(6) . . . . ?
C12 N5 C8 C9 0.2(9) . . . . ?
Dy2 N5 C8 C9 -177.7(5) . . . . ?
C12 N5 C8 C7 179.6(6) . . . . ?
Dy2 N5 C8 C7 1.8(7) . . . . ?
N3 C7 C8 N5 -10.1(9) . . . . ?
N4 C7 C8 N5 165.7(6) . . . . ?
N3 C7 C8 C9 169.4(6) . . . . ?
N4 C7 C8 C9 -14.8(11) . . . . ?
N5 C8 C9 C10 -1.3(10) . . . . ?
C7 C8 C9 C10 179.3(6) . . . . ?
C8 C9 C10 C11 0.8(10) . . . . ?
C9 C10 C11 C12 0.8(10) . . . . ?
C8 N5 C12 C11 1.6(10) . . . . ?
Dy2 N5 C12 C11 179.3(5) . . . . ?
C10 C11 C12 N5 -2.1(11) . . . . ?
C17 N6 C13 C14 0.6(10) . . . . ?
Dy1 N6 C13 C14 177.6(5) . . . . ?
N6 C13 C14 C15 0.3(11) . . . . ?
C13 C14 C15 C16 -0.5(11) . . . . ?
C14 C15 C16 C17 -0.3(11) . . . . ?
C13 N6 C17 C16 -1.5(10) . . . . ?
Dy1 N6 C17 C16 -178.6(5) . . . . ?
C13 N6 C17 C18 178.3(6) . . . . ?
Dy1 N6 C17 C18 1.1(8) . . . . ?
C15 C16 C17 N6 1.3(11) . . . . ?
C15 C16 C17 C18 -178.5(7) . . . . ?
N8 N7 C18 N9 0.3(8) . . . . ?
Dy1 N7 C18 N9 -178.5(4) . . . . ?
N8 N7 C18 C17 -179.9(6) . . . . ?
Dy1 N7 C18 C17 1.3(9) . . . . ?
C19 N9 C18 N7 -0.5(8) . . . . ?
C19 N9 C18 C17 179.7(7) . . . . ?
N6 C17 C18 N7 -1.6(9) . . . . ?
C16 C17 C18 N7 178.2(7) . . . . ?
N6 C17 C18 N9 178.2(7) . . . . ?
C16 C17 C18 N9 -2.0(12) . . . . ?
N7 N8 C19 N9 -0.4(8) . . . . ?
Dy2 N8 C19 N9 -179.7(4) . . . . ?
N7 N8 C19 C20 179.8(6) . . . . ?
Dy2 N8 C19 C20 0.5(9) . . . . ?
C18 N9 C19 N8 0.5(8) . . . . ?
C18 N9 C19 C20 -179.7(7) . . . . ?
C24 N10 C20 C21 0.6(10) . . . . ?
Dy2 N10 C20 C21 179.5(5) . . . . ?
C24 N10 C20 C19 179.8(6) . . . . ?
Dy2 N10 C20 C19 -1.2(8) . . . . ?
N8 C19 C20 N10 0.6(10) . . . . ?
N9 C19 C20 N10 -179.2(6) . . . . ?
N8 C19 C20 C21 179.8(7) . . . . ?
N9 C19 C20 C21 0.0(12) . . . . ?
N10 C20 C21 C22 1.4(11) . . . . ?
C19 C20 C21 C22 -177.7(7) . . . . ?
C20 C21 C22 C23 -2.3(12) . . . . ?
C21 C22 C23 C24 1.3(11) . . . . ?
C20 N10 C24 C23 -1.7(10) . . . . ?
Dy2 N10 C24 C23 179.4(5) . . . . ?
C22 C23 C24 N10 0.8(11) . . . . ?

loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_site_symmetry_A
O1 H1O Cl1 0.85 2.79 3.240(5) 114.7 .
O2 H2O Cl2 0.85 2.39 3.205(5) 162.3 .
O1W H1WA O4 0.85 1.90 2.745(8) 171.7 .
O1W H1WB Cl2 0.85 2.29 3.136(5) 170.4 .
O2W H2WA O3 0.85 1.82 2.599(7) 152.5 .
O2W H2WB O3W 0.85 1.98 2.805(8) 163.7 .
O3W H3WA Cl2 0.85 2.31 3.160(7) 174.9 2_665

_diffrn_measured_fraction_theta_max 0.984
_diffrn_reflns_theta_full        27.39
_diffrn_measured_fraction_theta_full 0.984
_refine_diff_density_max         4.293
_refine_diff_density_min         -2.417
_refine_diff_density_rms         0.222
####################################################################### 
# 
# 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_dym
_database_code_depnum_ccdc_archive 'CCDC 1046437'
_audit_update_record             
;
2015-01-30 deposited with the CCDC.
2015-03-25 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C56 H72 Br4 Dy4 N20 O14'
_chemical_formula_weight         2218.98

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'
Br Br -0.2901 2.4595 '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

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

_cell_length_a                   11.6203(9)
_cell_length_b                   12.2946(8)
_cell_length_c                   14.2923(10)
_cell_angle_alpha                75.951(2)
_cell_angle_beta                 70.984(2)
_cell_angle_gamma                68.022(2)
_cell_volume                     1773.1(2)
_cell_formula_units_Z            1
_cell_measurement_temperature    150(2)
_cell_measurement_reflns_used    12513
_cell_measurement_theta_min      3.045
_cell_measurement_theta_max      27.420

_exptl_crystal_description       polyhedral
_exptl_crystal_colour            colorless
_exptl_crystal_size_max          0.19
_exptl_crystal_size_mid          0.14
_exptl_crystal_size_min          0.10
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    2.078
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1064
_exptl_absorpt_coefficient_mu    6.493
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.3717
_exptl_absorpt_correction_T_max  0.5629
_exptl_absorpt_process_details   ?

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      150(2)
_diffrn_radiation_wavelength     0.71073
_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            16460
_diffrn_reflns_av_R_equivalents  0.0921
_diffrn_reflns_av_sigmaI/netI    0.1237
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_limit_l_max       18
_diffrn_reflns_theta_min         3.04
_diffrn_reflns_theta_max         27.45
_reflns_number_total             7916
_reflns_number_gt                5329
_reflns_threshold_expression     >2sigma(I)

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics    ?
_computing_publication_material  ?

_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)+(0.0406P)²+0.0000P] 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         7916
_refine_ls_number_parameters     444
_refine_ls_number_restraints     7
_refine_ls_R_factor_all          0.0947
_refine_ls_R_factor_gt           0.0578
_refine_ls_wR_factor_ref         0.1250
_refine_ls_wR_factor_gt          0.1096
_refine_ls_goodness_of_fit_ref   1.017
_refine_ls_restrained_S_all      1.018
_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
Dy1 Dy 0.29015(4) 0.38095(3) 0.20597(3) 0.01727(12) Uani 1 1 d . . .
Dy2 Dy 0.52533(4) 0.40566(3) -0.09688(3) 0.01712(12) Uani 1 1 d . . .
Br1 Br 0.49703(10) 0.20205(8) 0.28101(7) 0.0253(2) Uani 1 1 d . . .
Br2 Br 0.10631(10) 0.66311(8) 0.42634(7) 0.0308(2) Uani 1 1 d . . .
O1 O 0.4793(6) 0.4082(5) 0.0783(4) 0.0173(13) Uani 1 1 d . . .
H1O H 0.5438 0.3574 0.0969 0.021 Uiso 1 1 d R . .
O2 O 0.3168(6) 0.5469(5) 0.2210(4) 0.0184(13) Uani 1 1 d . . .
H2O H 0.2721 0.5875 0.2686 0.022 Uiso 1 1 d R . .
O1W O 0.2002(6) 0.3867(5) 0.3818(4) 0.0244(15) Uani 1 1 d . . .
H1WA H 0.2507 0.3348 0.4144 0.029 Uiso 1 1 d R . .
H1WB H 0.1867 0.4549 0.3949 0.029 Uiso 1 1 d R . .
O2W O 0.7101(6) 0.2612(5) -0.0602(5) 0.0278(16) Uani 1 1 d . . .
H2WA H 0.6953 0.1977 -0.0283 0.033 Uiso 1 1 d R . .
H2WB H 0.7696 0.2458 -0.1135 0.033 Uiso 1 1 d R . .
O3W O 0.9431(8) 0.2065(6) -0.2076(5) 0.048(2) Uani 1 1 d . . .
H3WA H 0.9319 0.2414 -0.2646 0.057 Uiso 1 1 d R . .
H3WB H 0.9930 0.2325 -0.1938 0.057 Uiso 1 1 d R . .
N1 N 0.1809(7) 0.2121(6) 0.2571(6) 0.0229(18) Uani 1 1 d . . .
N2 N 0.3551(8) 0.2433(6) 0.0873(5) 0.0218(17) Uani 1 1 d . . .
N3 N 0.4340(8) 0.2464(6) -0.0058(5) 0.0223(17) Uani 1 1 d . . .
N4 N 0.3394(8) 0.1123(6) 0.0110(6) 0.0226(18) Uani 1 1 d . . .
N5 N 0.5474(8) 0.2438(6) -0.2007(5) 0.0232(18) Uani 1 1 d . . .
N6 N 0.0392(8) 0.5056(6) 0.2303(5) 0.0209(17) Uani 1 1 d . . .
N7 N 0.2220(8) 0.4926(6) 0.0586(5) 0.0212(17) Uani 1 1 d . . .
N8 N 0.2963(8) 0.4989(7) -0.0375(6) 0.0252(18) Uani 1 1 d . . .
N9 N 0.0925(7) 0.6103(6) -0.0395(5) 0.0198(17) Uani 1 1 d . . .
N10 N 0.3995(8) 0.5324(6) -0.2327(5) 0.0197(17) Uani 1 1 d . . .
C1 C 0.1002(10) 0.1929(8) 0.3476(7) 0.030(2) Uani 1 1 d . . .
H1 H 0.0782 0.2438 0.3956 0.035 Uiso 1 1 calc R . .
C2 C 0.0495(9) 0.1031(8) 0.3723(7) 0.027(2) Uani 1 1 d . . .
H2 H -0.0046 0.0909 0.4373 0.033 Uiso 1 1 calc R . .
C3 C 0.0765(9) 0.0288(8) 0.3028(7) 0.028(2) Uani 1 1 d . . .
H3 H 0.0399 -0.0329 0.3188 0.033 Uiso 1 1 calc R . .
C4 C 0.1580(9) 0.0475(8) 0.2098(7) 0.026(2) Uani 1 1 d . . .
H4 H 0.1793 -0.0020 0.1608 0.031 Uiso 1 1 calc R . .
C5 C 0.2083(9) 0.1389(8) 0.1889(6) 0.020(2) Uani 1 1 d . . .
C6 C 0.2998(8) 0.1614(7) 0.0949(6) 0.0175(19) Uani 1 1 d . . .
C7 C 0.4235(9) 0.1690(7) -0.0496(6) 0.0176(19) Uani 1 1 d . . .
C8 C 0.4925(8) 0.1589(7) -0.1542(6) 0.0177(19) Uani 1 1 d . . .
C9 C 0.5006(9) 0.0683(7) -0.2037(7) 0.023(2) Uani 1 1 d . . .
H9 H 0.4616 0.0091 -0.1698 0.028 Uiso 1 1 calc R . .
C10 C 0.5683(10) 0.0699(8) -0.3041(7) 0.025(2) Uani 1 1 d . . .
H10 H 0.5766 0.0107 -0.3401 0.030 Uiso 1 1 calc R . .
C11 C 0.6237(10) 0.1583(8) -0.3515(7) 0.029(2) Uani 1 1 d . . .
H11 H 0.6698 0.1602 -0.4200 0.035 Uiso 1 1 calc R . .
C12 C 0.6105(9) 0.2428(8) -0.2976(6) 0.021(2) Uani 1 1 d . . .
H12 H 0.6479 0.3033 -0.3306 0.025 Uiso 1 1 calc R . .
C13 C -0.0504(9) 0.5148(8) 0.3166(7) 0.023(2) Uani 1 1 d . . .
H13 H -0.0255 0.4702 0.3753 0.027 Uiso 1 1 calc R . .
C14 C -0.1781(10) 0.5853(8) 0.3271(7) 0.029(2) Uani 1 1 d . . .
H14 H -0.2380 0.5894 0.3910 0.035 Uiso 1 1 calc R . .
C15 C -0.2162(11) 0.6498(9) 0.2414(8) 0.034(3) Uani 1 1 d . . .
H15 H -0.3027 0.6986 0.2452 0.041 Uiso 1 1 calc R . .
C16 C -0.1245(9) 0.6408(8) 0.1508(8) 0.030(2) Uani 1 1 d . . .
H16 H -0.1479 0.6838 0.0912 0.035 Uiso 1 1 calc R . .
C17 C 0.0001(10) 0.5701(8) 0.1464(7) 0.024(2) Uani 1 1 d . . .
C18 C 0.1029(9) 0.5590(8) 0.0536(7) 0.024(2) Uani 1 1 d . . .
C19 C 0.2144(10) 0.5691(8) -0.0923(7) 0.023(2) Uani 1 1 d . . .
C20 C 0.2693(9) 0.5915(7) -0.2004(6) 0.020(2) Uani 1 1 d . . .
C21 C 0.1964(9) 0.6617(8) -0.2665(6) 0.023(2) Uani 1 1 d . . .
H21 H 0.1070 0.7010 -0.2424 0.028 Uiso 1 1 calc R . .
C22 C 0.2562(10) 0.6738(8) -0.3685(7) 0.027(2) Uani 1 1 d . . .
H22 H 0.2079 0.7202 -0.4151 0.032 Uiso 1 1 calc R . .
C23 C 0.3859(10) 0.6176(9) -0.4007(7) 0.030(2) Uani 1 1 d . . .
H23 H 0.4288 0.6249 -0.4698 0.036 Uiso 1 1 calc R . .
C24 C 0.4540(11) 0.5494(8) -0.3305(7) 0.029(2) Uani 1 1 d . . .
H24 H 0.5442 0.5131 -0.3536 0.035 Uiso 1 1 calc R . .
O3 O 0.7364(8) 0.0477(6) 0.0398(5) 0.0377(19) Uani 1 1 d . . .
H3O H 0.7344 -0.0037 0.0104 0.045 Uiso 1 1 d R . .
C25 C 0.8177(11) -0.0077(8) 0.1064(8) 0.038(3) Uani 1 1 d . . .
H25A H 0.8942 -0.0705 0.0753 0.046 Uiso 1 1 calc R . .
H25B H 0.7705 -0.0449 0.1690 0.046 Uiso 1 1 calc R . .
C26 C 0.8587(12) 0.0811(10) 0.1291(9) 0.048(3) Uani 1 1 d . . .
H26A H 0.9217 0.0412 0.1685 0.072 Uiso 1 1 calc R . .
H26B H 0.7838 0.1377 0.1674 0.072 Uiso 1 1 calc R . .
H26C H 0.8976 0.1234 0.0666 0.072 Uiso 1 1 calc R . .
O4 O 0.3219(9) 0.2189(6) 0.5122(6) 0.062(3) Uani 1 1 d . . .
H4O H 0.3924 0.1863 0.4719 0.075 Uiso 1 1 d R . .
C27 C 0.2912(15) 0.1287(11) 0.5887(9) 0.064(4) Uani 1 1 d DU . .
H27A H 0.2164 0.1674 0.6409 0.077 Uiso 1 1 calc R . .
H27B H 0.3645 0.0898 0.6193 0.077 Uiso 1 1 calc R . .
C28 C 0.2610(17) 0.0334(12) 0.5625(11) 0.080(5) Uani 1 1 d D . .
H28A H 0.2566 -0.0293 0.6197 0.119 Uiso 1 1 calc R . .
H28B H 0.3284 0.0002 0.5050 0.119 Uiso 1 1 calc R . .
H28C H 0.1781 0.0669 0.5458 0.119 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 O2 2.243(6) . ?
Dy1 O1W 2.393(6) . ?
Dy1 N7 2.412(7) . ?
Dy1 O1 2.432(6) . ?
Dy1 N2 2.432(7) . ?
Dy1 N1 2.662(8) . ?
Dy1 N6 2.688(8) . ?
Dy1 Br1 2.8886(9) . ?
Dy1 Dy2 3.7359(6) 2_665 ?
Dy1 Dy2 4.3094(6) . ?
Dy2 O2 2.243(6) 2_665 ?
Dy2 O2W 2.338(6) . ?
Dy2 O1 2.346(6) 2_665 ?
Dy2 O1 2.390(5) . ?
Dy2 N8 2.415(8) . ?
Dy2 N3 2.464(8) . ?
Dy2 N10 2.648(7) . ?
Dy2 N5 2.651(7) . ?
Dy2 Dy1 3.7359(6) 2_665 ?
Dy2 Dy2 3.7989(8) 2_665 ?
O1 Dy2 2.346(6) 2_665 ?
O1 H1O 0.8500 . ?
O2 Dy2 2.243(6) 2_665 ?
O2 H2O 0.8500 . ?
O1W H1WA 0.8499 . ?
O1W H1WB 0.8501 . ?
O2W H2WA 0.8499 . ?
O2W H2WB 0.8500 . ?
O3W H3WA 0.8501 . ?
O3W H3WB 0.8500 . ?
N1 C1 1.356(12) . ?
N1 C5 1.367(11) . ?
N2 N3 1.349(10) . ?
N2 C6 1.351(11) . ?
N3 C7 1.318(11) . ?
N4 C6 1.341(11) . ?
N4 C7 1.363(12) . ?
N5 C12 1.340(11) . ?
N5 C8 1.351(11) . ?
N6 C13 1.328(11) . ?
N6 C17 1.376(11) . ?
N7 C18 1.334(11) . ?
N7 N8 1.365(10) . ?
N8 C19 1.344(11) . ?
N9 C19 1.336(12) . ?
N9 C18 1.350(10) . ?
N10 C24 1.333(11) . ?
N10 C20 1.383(11) . ?
C1 C2 1.361(14) . ?
C1 H1 0.9500 . ?
C2 C3 1.393(13) . ?
C2 H2 0.9500 . ?
C3 C4 1.382(12) . ?
C3 H3 0.9500 . ?
C4 C5 1.381(13) . ?
C4 H4 0.9500 . ?
C5 C6 1.457(12) . ?
C7 C8 1.459(12) . ?
C8 C9 1.417(12) . ?
C9 C10 1.393(12) . ?
C9 H9 0.9500 . ?
C10 C11 1.391(13) . ?
C10 H10 0.9500 . ?
C11 C12 1.375(13) . ?
C11 H11 0.9500 . ?
C12 H12 0.9500 . ?
C13 C14 1.390(13) . ?
C13 H13 0.9500 . ?
C14 C15 1.394(13) . ?
C14 H14 0.9500 . ?
C15 C16 1.381(14) . ?
C15 H15 0.9500 . ?
C16 C17 1.372(13) . ?
C16 H16 0.9500 . ?
C17 C18 1.462(13) . ?
C19 C20 1.468(12) . ?
C20 C21 1.390(11) . ?
C21 C22 1.394(12) . ?
C21 H21 0.9500 . ?
C22 C23 1.372(14) . ?
C22 H22 0.9500 . ?
C23 C24 1.396(12) . ?
C23 H23 0.9500 . ?
C24 H24 0.9500 . ?
O3 C25 1.432(10) . ?
O3 H3O 0.8501 . ?
C25 C26 1.480(15) . ?
C25 H25A 0.9900 . ?
C25 H25B 0.9900 . ?
C26 H26A 0.9800 . ?
C26 H26B 0.9800 . ?
C26 H26C 0.9800 . ?
O4 C27 1.416(14) . ?
O4 H4O 0.8499 . ?
C27 C28 1.497(9) . ?
C27 H27A 0.9900 . ?
C27 H27B 0.9900 . ?
C28 H28A 0.9800 . ?
C28 H28B 0.9800 . ?
C28 H28C 0.9800 . ?

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
O2 Dy1 O1W 79.3(2) . . ?
O2 Dy1 N7 85.6(2) . . ?
O1W Dy1 N7 134.6(2) . . ?
O2 Dy1 O1 71.0(2) . . ?
O1W Dy1 O1 138.2(2) . . ?
N7 Dy1 O1 72.4(2) . . ?
O2 Dy1 N2 141.2(2) . . ?
O1W Dy1 N2 138.4(2) . . ?
N7 Dy1 N2 72.5(2) . . ?
O1 Dy1 N2 71.9(2) . . ?
O2 Dy1 N1 155.7(2) . . ?
O1W Dy1 N1 78.7(2) . . ?
N7 Dy1 N1 102.9(2) . . ?
O1 Dy1 N1 133.2(2) . . ?
N2 Dy1 N1 62.7(2) . . ?
O2 Dy1 N6 86.9(2) . . ?
O1W Dy1 N6 73.9(2) . . ?
N7 Dy1 N6 62.7(2) . . ?
O1 Dy1 N6 131.17(19) . . ?
N2 Dy1 N6 109.5(2) . . ?
N1 Dy1 N6 77.3(2) . . ?
O2 Dy1 Br1 101.02(14) . . ?
O1W Dy1 Br1 79.75(14) . . ?
N7 Dy1 Br1 145.45(19) . . ?
O1 Dy1 Br1 77.82(12) . . ?
N2 Dy1 Br1 82.02(17) . . ?
N1 Dy1 Br1 84.98(15) . . ?
N6 Dy1 Br1 150.57(15) . . ?
O2 Dy1 Dy2 33.60(16) . 2_665 ?
O1W Dy1 Dy2 110.16(15) . 2_665 ?
N7 Dy1 Dy2 73.36(19) . 2_665 ?
O1 Dy1 Dy2 37.74(13) . 2_665 ?
N2 Dy1 Dy2 107.98(18) . 2_665 ?
N1 Dy1 Dy2 170.64(17) . 2_665 ?
N6 Dy1 Dy2 107.64(16) . 2_665 ?
Br1 Dy1 Dy2 93.45(2) . 2_665 ?
O2 Dy1 Dy2 88.30(15) . . ?
O1W Dy1 Dy2 164.38(16) . . ?
N7 Dy1 Dy2 52.49(19) . . ?
O1 Dy1 Dy2 26.39(13) . . ?
N2 Dy1 Dy2 52.90(18) . . ?
N1 Dy1 Dy2 115.02(17) . . ?
N6 Dy1 Dy2 115.20(15) . . ?
Br1 Dy1 Dy2 93.51(2) . . ?
Dy2 Dy1 Dy2 55.804(12) 2_665 . ?
O2 Dy2 O2W 77.5(2) 2_665 . ?
O2 Dy2 O1 72.7(2) 2_665 2_665 ?
O2W Dy2 O1 109.3(2) . 2_665 ?
O2 Dy2 O1 128.7(2) 2_665 . ?
O2W Dy2 O1 78.9(2) . . ?
O1 Dy2 O1 73.3(2) 2_665 . ?
O2 Dy2 N8 135.1(2) 2_665 . ?
O2W Dy2 N8 146.3(2) . . ?
O1 Dy2 N8 79.9(2) 2_665 . ?
O1 Dy2 N8 72.8(2) . . ?
O2 Dy2 N3 145.5(2) 2_665 . ?
O2W Dy2 N3 80.7(2) . . ?
O1 Dy2 N3 140.6(2) 2_665 . ?
O1 Dy2 N3 71.4(2) . . ?
N8 Dy2 N3 73.3(2) . . ?
O2 Dy2 N10 78.7(2) 2_665 . ?
O2W Dy2 N10 148.4(2) . . ?
O1 Dy2 N10 82.8(2) 2_665 . ?
O1 Dy2 N10 132.6(2) . . ?
N8 Dy2 N10 62.9(2) . . ?
N3 Dy2 N10 108.9(2) . . ?
O2 Dy2 N5 87.7(2) 2_665 . ?
O2W Dy2 N5 81.4(2) . . ?
O1 Dy2 N5 154.3(2) 2_665 . ?
O1 Dy2 N5 132.3(2) . . ?
N8 Dy2 N5 104.4(3) . . ?
N3 Dy2 N5 62.8(2) . . ?
N10 Dy2 N5 77.1(2) . . ?
O2 Dy2 Dy1 33.61(14) 2_665 2_665 ?
O2W Dy2 Dy1 89.40(16) . 2_665 ?
O1 Dy2 Dy1 39.39(14) 2_665 2_665 ?
O1 Dy2 Dy1 102.05(15) . 2_665 ?
N8 Dy2 Dy1 113.95(18) . 2_665 ?
N3 Dy2 Dy1 168.97(18) . 2_665 ?
N10 Dy2 Dy1 82.12(16) . 2_665 ?
N5 Dy2 Dy1 120.71(17) . 2_665 ?
O2 Dy2 Dy2 102.09(15) 2_665 2_665 ?
O2W Dy2 Dy2 94.79(16) . 2_665 ?
O1 Dy2 Dy2 37.05(13) 2_665 2_665 ?
O1 Dy2 Dy2 36.26(13) . 2_665 ?
N8 Dy2 Dy2 72.90(18) . 2_665 ?
N3 Dy2 Dy2 106.07(18) . 2_665 ?
N10 Dy2 Dy2 110.39(15) . 2_665 ?
N5 Dy2 Dy2 168.56(16) . 2_665 ?
Dy1 Dy2 Dy2 69.765(14) 2_665 2_665 ?
O2 Dy2 Dy1 155.04(15) 2_665 . ?
O2W Dy2 Dy1 94.74(16) . . ?
O1 Dy2 Dy1 88.08(14) 2_665 . ?
O1 Dy2 Dy1 26.90(15) . . ?
N8 Dy2 Dy1 52.33(17) . . ?
N3 Dy2 Dy1 52.63(17) . . ?
N10 Dy2 Dy1 115.22(16) . . ?
N5 Dy2 Dy1 114.91(17) . . ?
Dy1 Dy2 Dy1 124.196(12) 2_665 . ?
Dy2 Dy2 Dy1 54.431(12) 2_665 . ?
Dy2 O1 Dy2 106.7(2) 2_665 . ?
Dy2 O1 Dy1 102.9(2) 2_665 . ?
Dy2 O1 Dy1 126.7(3) . . ?
Dy2 O1 H1O 106.8 2_665 . ?
Dy2 O1 H1O 106.2 . . ?
Dy1 O1 H1O 106.2 . . ?
Dy2 O2 Dy1 112.8(2) 2_665 . ?
Dy2 O2 H2O 123.5 2_665 . ?
Dy1 O2 H2O 123.8 . . ?
Dy1 O1W H1WA 110.7 . . ?
Dy1 O1W H1WB 109.7 . . ?
H1WA O1W H1WB 109.4 . . ?
Dy2 O2W H2WA 111.8 . . ?
Dy2 O2W H2WB 110.6 . . ?
H2WA O2W H2WB 109.3 . . ?
H3WA O3W H3WB 108.2 . . ?
C1 N1 C5 117.4(8) . . ?
C1 N1 Dy1 123.9(7) . . ?
C5 N1 Dy1 118.6(6) . . ?
N3 N2 C6 105.6(7) . . ?
N3 N2 Dy1 127.8(6) . . ?
C6 N2 Dy1 125.6(6) . . ?
C7 N3 N2 107.1(8) . . ?
C7 N3 Dy2 123.7(6) . . ?
N2 N3 Dy2 126.5(6) . . ?
C6 N4 C7 101.9(7) . . ?
C12 N5 C8 118.5(8) . . ?
C12 N5 Dy2 122.8(6) . . ?
C8 N5 Dy2 118.7(6) . . ?
C13 N6 C17 116.5(8) . . ?
C13 N6 Dy1 125.9(6) . . ?
C17 N6 Dy1 117.4(6) . . ?
C18 N7 N8 105.4(7) . . ?
C18 N7 Dy1 127.1(6) . . ?
N8 N7 Dy1 127.4(6) . . ?
C19 N8 N7 105.0(8) . . ?
C19 N8 Dy2 127.3(6) . . ?
N7 N8 Dy2 127.7(5) . . ?
C19 N9 C18 100.7(7) . . ?
C24 N10 C20 117.0(8) . . ?
C24 N10 Dy2 124.6(7) . . ?
C20 N10 Dy2 118.3(5) . . ?
N1 C1 C2 122.3(9) . . ?
N1 C1 H1 118.9 . . ?
C2 C1 H1 118.9 . . ?
C1 C2 C3 120.4(9) . . ?
C1 C2 H2 119.8 . . ?
C3 C2 H2 119.8 . . ?
C4 C3 C2 118.2(9) . . ?
C4 C3 H3 120.9 . . ?
C2 C3 H3 120.9 . . ?
C5 C4 C3 119.2(9) . . ?
C5 C4 H4 120.4 . . ?
C3 C4 H4 120.4 . . ?
N1 C5 C4 122.5(8) . . ?
N1 C5 C6 114.4(8) . . ?
C4 C5 C6 123.0(8) . . ?
N4 C6 N2 112.7(8) . . ?
N4 C6 C5 129.4(9) . . ?
N2 C6 C5 117.9(8) . . ?
N3 C7 N4 112.6(8) . . ?
N3 C7 C8 119.2(8) . . ?
N4 C7 C8 128.1(8) . . ?
N5 C8 C9 122.5(8) . . ?
N5 C8 C7 114.4(8) . . ?
C9 C8 C7 123.1(8) . . ?
C10 C9 C8 117.1(8) . . ?
C10 C9 H9 121.4 . . ?
C8 C9 H9 121.4 . . ?
C11 C10 C9 120.0(9) . . ?
C11 C10 H10 120.0 . . ?
C9 C10 H10 120.0 . . ?
C12 C11 C10 118.9(9) . . ?
C12 C11 H11 120.5 . . ?
C10 C11 H11 120.5 . . ?
N5 C12 C11 123.0(9) . . ?
N5 C12 H12 118.5 . . ?
C11 C12 H12 118.5 . . ?
N6 C13 C14 124.4(9) . . ?
N6 C13 H13 117.8 . . ?
C14 C13 H13 117.8 . . ?
C13 C14 C15 118.3(10) . . ?
C13 C14 H14 120.8 . . ?
C15 C14 H14 120.8 . . ?
C16 C15 C14 118.1(9) . . ?
C16 C15 H15 120.9 . . ?
C14 C15 H15 120.9 . . ?
C17 C16 C15 120.3(9) . . ?
C17 C16 H16 119.9 . . ?
C15 C16 H16 119.9 . . ?
C16 C17 N6 122.3(9) . . ?
C16 C17 C18 123.2(8) . . ?
N6 C17 C18 114.4(8) . . ?
N7 C18 N9 114.3(8) . . ?
N7 C18 C17 118.3(8) . . ?
N9 C18 C17 127.4(8) . . ?
N9 C19 N8 114.5(8) . . ?
N9 C19 C20 128.7(8) . . ?
N8 C19 C20 116.8(9) . . ?
N10 C20 C21 122.1(8) . . ?
N10 C20 C19 114.6(7) . . ?
C21 C20 C19 123.2(9) . . ?
C20 C21 C22 119.1(9) . . ?
C20 C21 H21 120.5 . . ?
C22 C21 H21 120.5 . . ?
C23 C22 C21 119.0(8) . . ?
C23 C22 H22 120.5 . . ?
C21 C22 H22 120.5 . . ?
C22 C23 C24 119.2(9) . . ?
C22 C23 H23 120.4 . . ?
C24 C23 H23 120.4 . . ?
N10 C24 C23 123.6(10) . . ?
N10 C24 H24 118.2 . . ?
C23 C24 H24 118.2 . . ?
C25 O3 H3O 110.3 . . ?
O3 C25 C26 110.0(8) . . ?
O3 C25 H25A 109.7 . . ?
C26 C25 H25A 109.7 . . ?
O3 C25 H25B 109.7 . . ?
C26 C25 H25B 109.7 . . ?
H25A C25 H25B 108.2 . . ?
C25 C26 H26A 109.5 . . ?
C25 C26 H26B 109.5 . . ?
H26A C26 H26B 109.5 . . ?
C25 C26 H26C 109.5 . . ?
H26A C26 H26C 109.5 . . ?
H26B C26 H26C 109.5 . . ?
C27 O4 H4O 107.1 . . ?
O4 C27 C28 118.9(11) . . ?
O4 C27 H27A 107.6 . . ?
C28 C27 H27A 107.6 . . ?
O4 C27 H27B 107.6 . . ?
C28 C27 H27B 107.6 . . ?
H27A C27 H27B 107.0 . . ?
C27 C28 H28A 109.5 . . ?
C27 C28 H28B 109.5 . . ?
H28A C28 H28B 109.5 . . ?
C27 C28 H28C 109.5 . . ?
H28A C28 H28C 109.5 . . ?
H28B C28 H28C 109.5 . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
O2 Dy1 Dy2 O2 31.3(4) . . . 2_665 ?
O1W Dy1 Dy2 O2 -5.9(6) . . . 2_665 ?
N7 Dy1 Dy2 O2 117.0(4) . . . 2_665 ?
O1 Dy1 Dy2 O2 -16.5(4) . . . 2_665 ?
N2 Dy1 Dy2 O2 -146.9(4) . . . 2_665 ?
N1 Dy1 Dy2 O2 -155.7(4) . . . 2_665 ?
N6 Dy1 Dy2 O2 117.0(4) . . . 2_665 ?
Br1 Dy1 Dy2 O2 -69.6(3) . . . 2_665 ?
Dy2 Dy1 Dy2 O2 22.1(3) 2_665 . . 2_665 ?
O2 Dy1 Dy2 O2W 101.7(2) . . . . ?
O1W Dy1 Dy2 O2W 64.4(5) . . . . ?
N7 Dy1 Dy2 O2W -172.6(3) . . . . ?
O1 Dy1 Dy2 O2W 53.9(3) . . . . ?
N2 Dy1 Dy2 O2W -76.5(3) . . . . ?
N1 Dy1 Dy2 O2W -85.4(2) . . . . ?
N6 Dy1 Dy2 O2W -172.6(2) . . . . ?
Br1 Dy1 Dy2 O2W 0.72(16) . . . . ?
Dy2 Dy1 Dy2 O2W 92.50(16) 2_665 . . . ?
O2 Dy1 Dy2 O1 -7.57(19) . . . 2_665 ?
O1W Dy1 Dy2 O1 -44.8(5) . . . 2_665 ?
N7 Dy1 Dy2 O1 78.2(3) . . . 2_665 ?
O1 Dy1 Dy2 O1 -55.3(3) . . . 2_665 ?
N2 Dy1 Dy2 O1 174.2(3) . . . 2_665 ?
N1 Dy1 Dy2 O1 165.4(2) . . . 2_665 ?
N6 Dy1 Dy2 O1 78.2(2) . . . 2_665 ?
Br1 Dy1 Dy2 O1 -108.51(14) . . . 2_665 ?
Dy2 Dy1 Dy2 O1 -16.72(13) 2_665 . . 2_665 ?
O2 Dy1 Dy2 O1 47.8(3) . . . . ?
O1W Dy1 Dy2 O1 10.5(6) . . . . ?
N7 Dy1 Dy2 O1 133.5(4) . . . . ?
N2 Dy1 Dy2 O1 -130.4(3) . . . . ?
N1 Dy1 Dy2 O1 -139.3(3) . . . . ?
N6 Dy1 Dy2 O1 133.5(3) . . . . ?
Br1 Dy1 Dy2 O1 -53.2(3) . . . . ?
Dy2 Dy1 Dy2 O1 38.6(3) 2_665 . . . ?
O2 Dy1 Dy2 N8 -86.3(3) . . . . ?
O1W Dy1 Dy2 N8 -123.6(6) . . . . ?
N7 Dy1 Dy2 N8 -0.6(3) . . . . ?
O1 Dy1 Dy2 N8 -134.1(3) . . . . ?
N2 Dy1 Dy2 N8 95.5(3) . . . . ?
N1 Dy1 Dy2 N8 86.6(3) . . . . ?
N6 Dy1 Dy2 N8 -0.6(3) . . . . ?
Br1 Dy1 Dy2 N8 172.7(2) . . . . ?
Dy2 Dy1 Dy2 N8 -95.5(2) 2_665 . . . ?
O2 Dy1 Dy2 N3 176.1(3) . . . . ?
O1W Dy1 Dy2 N3 138.9(5) . . . . ?
N7 Dy1 Dy2 N3 -98.2(3) . . . . ?
O1 Dy1 Dy2 N3 128.4(3) . . . . ?
N2 Dy1 Dy2 N3 -2.1(3) . . . . ?
N1 Dy1 Dy2 N3 -10.9(3) . . . . ?
N6 Dy1 Dy2 N3 -98.1(3) . . . . ?
Br1 Dy1 Dy2 N3 75.2(2) . . . . ?
Dy2 Dy1 Dy2 N3 167.0(2) 2_665 . . . ?
O2 Dy1 Dy2 N10 -88.7(2) . . . . ?
O1W Dy1 Dy2 N10 -125.9(5) . . . . ?
N7 Dy1 Dy2 N10 -3.0(3) . . . . ?
O1 Dy1 Dy2 N10 -136.5(3) . . . . ?
N2 Dy1 Dy2 N10 93.1(3) . . . . ?
N1 Dy1 Dy2 N10 84.3(2) . . . . ?
N6 Dy1 Dy2 N10 -3.0(2) . . . . ?
Br1 Dy1 Dy2 N10 170.35(17) . . . . ?
Dy2 Dy1 Dy2 N10 -97.86(17) 2_665 . . . ?
O2 Dy1 Dy2 N5 -175.7(2) . . . . ?
O1W Dy1 Dy2 N5 147.1(5) . . . . ?
N7 Dy1 Dy2 N5 -90.0(3) . . . . ?
O1 Dy1 Dy2 N5 136.6(3) . . . . ?
N2 Dy1 Dy2 N5 6.1(3) . . . . ?
N1 Dy1 Dy2 N5 -2.7(2) . . . . ?
N6 Dy1 Dy2 N5 -90.0(2) . . . . ?
Br1 Dy1 Dy2 N5 83.37(18) . . . . ?
Dy2 Dy1 Dy2 N5 175.16(18) 2_665 . . . ?
O2 Dy1 Dy2 Dy1 9.15(14) . . . 2_665 ?
O1W Dy1 Dy2 Dy1 -28.1(5) . . . 2_665 ?
N7 Dy1 Dy2 Dy1 94.9(2) . . . 2_665 ?
O1 Dy1 Dy2 Dy1 -38.6(3) . . . 2_665 ?
N2 Dy1 Dy2 Dy1 -169.0(2) . . . 2_665 ?
N1 Dy1 Dy2 Dy1 -177.88(16) . . . 2_665 ?
N6 Dy1 Dy2 Dy1 94.88(18) . . . 2_665 ?
Br1 Dy1 Dy2 Dy1 -91.79(2) . . . 2_665 ?
Dy2 Dy1 Dy2 Dy1 0.0 2_665 . . 2_665 ?
O2 Dy1 Dy2 Dy2 9.15(14) . . . 2_665 ?
O1W Dy1 Dy2 Dy2 -28.1(5) . . . 2_665 ?
N7 Dy1 Dy2 Dy2 94.9(2) . . . 2_665 ?
O1 Dy1 Dy2 Dy2 -38.6(3) . . . 2_665 ?
N2 Dy1 Dy2 Dy2 -169.0(2) . . . 2_665 ?
N1 Dy1 Dy2 Dy2 -177.88(16) . . . 2_665 ?
N6 Dy1 Dy2 Dy2 94.88(18) . . . 2_665 ?
Br1 Dy1 Dy2 Dy2 -91.79(2) . . . 2_665 ?
O2 Dy2 O1 Dy2 50.3(3) 2_665 . . 2_665 ?
O2W Dy2 O1 Dy2 114.2(3) . . . 2_665 ?
O1 Dy2 O1 Dy2 0.0 2_665 . . 2_665 ?
N8 Dy2 O1 Dy2 -84.4(3) . . . 2_665 ?
N3 Dy2 O1 Dy2 -162.0(3) . . . 2_665 ?
N10 Dy2 O1 Dy2 -63.1(4) . . . 2_665 ?
N5 Dy2 O1 Dy2 -178.4(2) . . . 2_665 ?
Dy1 Dy2 O1 Dy2 27.2(2) 2_665 . . 2_665 ?
Dy1 Dy2 O1 Dy2 -120.9(4) . . . 2_665 ?
O2 Dy2 O1 Dy1 171.2(2) 2_665 . . . ?
O2W Dy2 O1 Dy1 -124.9(3) . . . . ?
O1 Dy2 O1 Dy1 120.9(4) 2_665 . . . ?
N8 Dy2 O1 Dy1 36.5(3) . . . . ?
N3 Dy2 O1 Dy1 -41.1(3) . . . . ?
N10 Dy2 O1 Dy1 57.8(4) . . . . ?
N5 Dy2 O1 Dy1 -57.5(4) . . . . ?
Dy1 Dy2 O1 Dy1 148.1(2) 2_665 . . . ?
Dy2 Dy2 O1 Dy1 120.9(4) 2_665 . . . ?
O2 Dy1 O1 Dy2 -5.98(18) . . . 2_665 ?
O1W Dy1 O1 Dy2 -53.2(3) . . . 2_665 ?
N7 Dy1 O1 Dy2 85.4(2) . . . 2_665 ?
N2 Dy1 O1 Dy2 162.2(3) . . . 2_665 ?
N1 Dy1 O1 Dy2 176.7(2) . . . 2_665 ?
N6 Dy1 O1 Dy2 61.8(3) . . . 2_665 ?
Br1 Dy1 O1 Dy2 -112.30(17) . . . 2_665 ?
Dy2 Dy1 O1 Dy2 122.5(3) . . . 2_665 ?
O2 Dy1 O1 Dy2 -128.5(3) . . . . ?
O1W Dy1 O1 Dy2 -175.8(2) . . . . ?
N7 Dy1 O1 Dy2 -37.2(3) . . . . ?
N2 Dy1 O1 Dy2 39.7(3) . . . . ?
N1 Dy1 O1 Dy2 54.1(4) . . . . ?
N6 Dy1 O1 Dy2 -60.7(4) . . . . ?
Br1 Dy1 O1 Dy2 125.2(3) . . . . ?
Dy2 Dy1 O1 Dy2 -122.5(3) 2_665 . . . ?
O1W Dy1 O2 Dy2 156.7(3) . . . 2_665 ?
N7 Dy1 O2 Dy2 -66.3(3) . . . 2_665 ?
O1 Dy1 O2 Dy2 6.6(2) . . . 2_665 ?
N2 Dy1 O2 Dy2 -11.4(5) . . . 2_665 ?
N1 Dy1 O2 Dy2 -178.1(4) . . . 2_665 ?
N6 Dy1 O2 Dy2 -129.1(3) . . . 2_665 ?
Br1 Dy1 O2 Dy2 79.5(2) . . . 2_665 ?
Dy2 Dy1 O2 Dy2 -13.8(2) . . . 2_665 ?
O2 Dy1 N1 C1 -15.0(10) . . . . ?
O1W Dy1 N1 C1 10.3(7) . . . . ?
N7 Dy1 N1 C1 -123.3(7) . . . . ?
O1 Dy1 N1 C1 158.9(6) . . . . ?
N2 Dy1 N1 C1 174.4(8) . . . . ?
N6 Dy1 N1 C1 -65.5(7) . . . . ?
Br1 Dy1 N1 C1 90.8(7) . . . . ?
Dy2 Dy1 N1 C1 171.5(6) 2_665 . . . ?
Dy2 Dy1 N1 C1 -177.7(6) . . . . ?
O2 Dy1 N1 C5 165.8(5) . . . . ?
O1W Dy1 N1 C5 -168.9(6) . . . . ?
N7 Dy1 N1 C5 57.5(6) . . . . ?
O1 Dy1 N1 C5 -20.3(7) . . . . ?
N2 Dy1 N1 C5 -4.8(6) . . . . ?
N6 Dy1 N1 C5 115.3(6) . . . . ?
Br1 Dy1 N1 C5 -88.4(6) . . . . ?
Dy2 Dy1 N1 C5 -7.7(14) 2_665 . . . ?
Dy2 Dy1 N1 C5 3.1(6) . . . . ?
O2 Dy1 N2 N3 0.9(9) . . . . ?
O1W Dy1 N2 N3 -161.4(6) . . . . ?
N7 Dy1 N2 N3 59.6(7) . . . . ?
O1 Dy1 N2 N3 -17.0(7) . . . . ?
N1 Dy1 N2 N3 174.8(8) . . . . ?
N6 Dy1 N2 N3 111.2(7) . . . . ?
Br1 Dy1 N2 N3 -96.8(7) . . . . ?
Dy2 Dy1 N2 N3 -5.7(7) 2_665 . . . ?
Dy2 Dy1 N2 N3 3.8(6) . . . . ?
O2 Dy1 N2 C6 -165.6(6) . . . . ?
O1W Dy1 N2 C6 32.1(8) . . . . ?
N7 Dy1 N2 C6 -107.0(7) . . . . ?
O1 Dy1 N2 C6 176.4(7) . . . . ?
N1 Dy1 N2 C6 8.2(6) . . . . ?
N6 Dy1 N2 C6 -55.3(7) . . . . ?
Br1 Dy1 N2 C6 96.7(7) . . . . ?
Dy2 Dy1 N2 C6 -172.3(6) 2_665 . . . ?
Dy2 Dy1 N2 C6 -162.7(8) . . . . ?
C6 N2 N3 C7 0.1(9) . . . . ?
Dy1 N2 N3 C7 -168.5(5) . . . . ?
C6 N2 N3 Dy2 162.1(5) . . . . ?
Dy1 N2 N3 Dy2 -6.6(10) . . . . ?
O2 Dy2 N3 C7 -42.6(9) 2_665 . . . ?
O2W Dy2 N3 C7 -93.9(7) . . . . ?
O1 Dy2 N3 C7 157.0(6) 2_665 . . . ?
O1 Dy2 N3 C7 -175.2(7) . . . . ?
N8 Dy2 N3 C7 107.8(7) . . . . ?
N10 Dy2 N3 C7 55.0(7) . . . . ?
N5 Dy2 N3 C7 -8.8(6) . . . . ?
Dy1 Dy2 N3 C7 -120.0(9) 2_665 . . . ?
Dy2 Dy2 N3 C7 173.8(6) 2_665 . . . ?
Dy1 Dy2 N3 C7 162.8(8) . . . . ?
O2 Dy2 N3 N2 158.3(6) 2_665 . . . ?
O2W Dy2 N3 N2 107.0(7) . . . . ?
O1 Dy2 N3 N2 -2.1(9) 2_665 . . . ?
O1 Dy2 N3 N2 25.7(6) . . . . ?
N8 Dy2 N3 N2 -51.3(7) . . . . ?
N10 Dy2 N3 N2 -104.1(7) . . . . ?
N5 Dy2 N3 N2 -167.9(8) . . . . ?
Dy1 Dy2 N3 N2 80.9(12) 2_665 . . . ?
Dy2 Dy2 N3 N2 14.7(7) 2_665 . . . ?
Dy1 Dy2 N3 N2 3.7(6) . . . . ?
O2 Dy2 N5 C12 -15.1(7) 2_665 . . . ?
O2W Dy2 N5 C12 -92.8(7) . . . . ?
O1 Dy2 N5 C12 24.3(10) 2_665 . . . ?
O1 Dy2 N5 C12 -159.2(6) . . . . ?
N8 Dy2 N5 C12 121.1(7) . . . . ?
N3 Dy2 N5 C12 -176.7(8) . . . . ?
N10 Dy2 N5 C12 63.9(7) . . . . ?
Dy1 Dy2 N5 C12 -8.7(8) 2_665 . . . ?
Dy2 Dy2 N5 C12 -163.8(6) 2_665 . . . ?
Dy1 Dy2 N5 C12 175.9(6) . . . . ?
O2 Dy2 N5 C8 165.1(6) 2_665 . . . ?
O2W Dy2 N5 C8 87.3(6) . . . . ?
O1 Dy2 N5 C8 -155.6(5) 2_665 . . . ?
O1 Dy2 N5 C8 21.0(8) . . . . ?
N8 Dy2 N5 C8 -58.7(6) . . . . ?
N3 Dy2 N5 C8 3.4(6) . . . . ?
N10 Dy2 N5 C8 -116.0(7) . . . . ?
Dy1 Dy2 N5 C8 171.5(5) 2_665 . . . ?
Dy2 Dy2 N5 C8 16.3(14) 2_665 . . . ?
Dy1 Dy2 N5 C8 -3.9(7) . . . . ?
O2 Dy1 N6 C13 -90.8(7) . . . . ?
O1W Dy1 N6 C13 -11.1(7) . . . . ?
N7 Dy1 N6 C13 -177.5(8) . . . . ?
O1 Dy1 N6 C13 -152.1(7) . . . . ?
N2 Dy1 N6 C13 125.3(7) . . . . ?
N1 Dy1 N6 C13 70.6(7) . . . . ?
Br1 Dy1 N6 C13 16.2(9) . . . . ?
Dy2 Dy1 N6 C13 -117.6(7) 2_665 . . . ?
Dy2 Dy1 N6 C13 -177.5(7) . . . . ?
O2 Dy1 N6 C17 86.1(6) . . . . ?
O1W Dy1 N6 C17 165.9(7) . . . . ?
N7 Dy1 N6 C17 -0.5(6) . . . . ?
O1 Dy1 N6 C17 24.9(7) . . . . ?
N2 Dy1 N6 C17 -57.8(7) . . . . ?
N1 Dy1 N6 C17 -112.4(6) . . . . ?
Br1 Dy1 N6 C17 -166.9(5) . . . . ?
Dy2 Dy1 N6 C17 59.4(6) 2_665 . . . ?
Dy2 Dy1 N6 C17 -0.5(7) . . . . ?
O2 Dy1 N7 C18 -89.4(8) . . . . ?
O1W Dy1 N7 C18 -19.2(9) . . . . ?
O1 Dy1 N7 C18 -160.9(8) . . . . ?
N2 Dy1 N7 C18 123.1(8) . . . . ?
N1 Dy1 N7 C18 67.5(8) . . . . ?
N6 Dy1 N7 C18 -0.7(7) . . . . ?
Br1 Dy1 N7 C18 167.5(6) . . . . ?
Dy2 Dy1 N7 C18 -121.3(8) 2_665 . . . ?
Dy2 Dy1 N7 C18 179.3(9) . . . . ?
O2 Dy1 N7 N8 92.3(7) . . . . ?
O1W Dy1 N7 N8 162.5(6) . . . . ?
O1 Dy1 N7 N8 20.8(7) . . . . ?
N2 Dy1 N7 N8 -55.2(7) . . . . ?
N1 Dy1 N7 N8 -110.8(7) . . . . ?
N6 Dy1 N7 N8 -179.0(8) . . . . ?
Br1 Dy1 N7 N8 -10.7(9) . . . . ?
Dy2 Dy1 N7 N8 60.4(7) 2_665 . . . ?
Dy2 Dy1 N7 N8 1.0(6) . . . . ?
C18 N7 N8 C19 -0.1(10) . . . . ?
Dy1 N7 N8 C19 178.4(6) . . . . ?
C18 N7 N8 Dy2 179.5(6) . . . . ?
Dy1 N7 N8 Dy2 -1.9(10) . . . . ?
O2 Dy2 N8 C19 32.7(9) 2_665 . . . ?
O2W Dy2 N8 C19 -164.9(6) . . . . ?
O1 Dy2 N8 C19 85.3(8) 2_665 . . . ?
O1 Dy2 N8 C19 160.8(8) . . . . ?
N3 Dy2 N8 C19 -124.0(8) . . . . ?
N10 Dy2 N8 C19 -1.8(7) . . . . ?
N5 Dy2 N8 C19 -68.8(8) . . . . ?
Dy1 Dy2 N8 C19 64.9(8) 2_665 . . . ?
Dy2 Dy2 N8 C19 122.8(8) 2_665 . . . ?
Dy1 Dy2 N8 C19 -179.3(9) . . . . ?
O2 Dy2 N8 N7 -146.9(6) 2_665 . . . ?
O2W Dy2 N8 N7 15.5(10) . . . . ?
O1 Dy2 N8 N7 -94.3(7) 2_665 . . . ?
O1 Dy2 N8 N7 -18.8(7) . . . . ?
N3 Dy2 N8 N7 56.4(7) . . . . ?
N10 Dy2 N8 N7 178.6(8) . . . . ?
N5 Dy2 N8 N7 111.6(7) . . . . ?
Dy1 Dy2 N8 N7 -114.7(7) 2_665 . . . ?
Dy2 Dy2 N8 N7 -56.9(7) 2_665 . . . ?
Dy1 Dy2 N8 N7 1.0(6) . . . . ?
O2 Dy2 N10 C24 22.9(7) 2_665 . . . ?
O2W Dy2 N10 C24 -18.9(10) . . . . ?
O1 Dy2 N10 C24 96.6(7) 2_665 . . . ?
O1 Dy2 N10 C24 156.0(7) . . . . ?
N8 Dy2 N10 C24 178.9(8) . . . . ?
N3 Dy2 N10 C24 -122.2(7) . . . . ?
N5 Dy2 N10 C24 -67.2(7) . . . . ?
Dy1 Dy2 N10 C24 56.9(7) 2_665 . . . ?
Dy2 Dy2 N10 C24 121.8(7) 2_665 . . . ?
Dy1 Dy2 N10 C24 -178.9(7) . . . . ?
O2 Dy2 N10 C20 -153.0(6) 2_665 . . . ?
O2W Dy2 N10 C20 165.1(6) . . . . ?
O1 Dy2 N10 C20 -79.3(6) 2_665 . . . ?
O1 Dy2 N10 C20 -19.9(7) . . . . ?
N8 Dy2 N10 C20 3.0(6) . . . . ?
N3 Dy2 N10 C20 61.9(7) . . . . ?
N5 Dy2 N10 C20 116.9(7) . . . . ?
Dy1 Dy2 N10 C20 -119.1(6) 2_665 . . . ?
Dy2 Dy2 N10 C20 -54.1(6) 2_665 . . . ?
Dy1 Dy2 N10 C20 5.1(7) . . . . ?
C5 N1 C1 C2 1.5(14) . . . . ?
Dy1 N1 C1 C2 -177.7(7) . . . . ?
N1 C1 C2 C3 -2.0(15) . . . . ?
C1 C2 C3 C4 1.5(14) . . . . ?
C2 C3 C4 C5 -0.7(14) . . . . ?
C1 N1 C5 C4 -0.6(13) . . . . ?
Dy1 N1 C5 C4 178.6(7) . . . . ?
C1 N1 C5 C6 -177.5(8) . . . . ?
Dy1 N1 C5 C6 1.7(9) . . . . ?
C3 C4 C5 N1 0.2(14) . . . . ?
C3 C4 C5 C6 176.9(8) . . . . ?
C7 N4 C6 N2 0.1(9) . . . . ?
C7 N4 C6 C5 179.8(8) . . . . ?
N3 N2 C6 N4 -0.1(10) . . . . ?
Dy1 N2 C6 N4 168.8(5) . . . . ?
N3 N2 C6 C5 -179.9(7) . . . . ?
Dy1 N2 C6 C5 -10.9(11) . . . . ?
N1 C5 C6 N4 -174.6(8) . . . . ?
C4 C5 C6 N4 8.6(14) . . . . ?
N1 C5 C6 N2 5.2(11) . . . . ?
C4 C5 C6 N2 -171.7(8) . . . . ?
N2 N3 C7 N4 -0.1(10) . . . . ?
Dy2 N3 C7 N4 -162.6(5) . . . . ?
N2 N3 C7 C8 176.1(7) . . . . ?
Dy2 N3 C7 C8 13.5(11) . . . . ?
C6 N4 C7 N3 0.0(9) . . . . ?
C6 N4 C7 C8 -175.7(8) . . . . ?
C12 N5 C8 C9 0.8(13) . . . . ?
Dy2 N5 C8 C9 -179.4(6) . . . . ?
C12 N5 C8 C7 -178.6(8) . . . . ?
Dy2 N5 C8 C7 1.2(10) . . . . ?
N3 C7 C8 N5 -9.1(12) . . . . ?
N4 C7 C8 N5 166.4(8) . . . . ?
N3 C7 C8 C9 171.5(8) . . . . ?
N4 C7 C8 C9 -13.0(14) . . . . ?
N5 C8 C9 C10 -0.1(13) . . . . ?
C7 C8 C9 C10 179.2(8) . . . . ?
C8 C9 C10 C11 -0.3(13) . . . . ?
C9 C10 C11 C12 0.2(14) . . . . ?
C8 N5 C12 C11 -1.0(14) . . . . ?
Dy2 N5 C12 C11 179.2(7) . . . . ?
C10 C11 C12 N5 0.5(14) . . . . ?
C17 N6 C13 C14 -0.7(14) . . . . ?
Dy1 N6 C13 C14 176.3(7) . . . . ?
N6 C13 C14 C15 0.9(15) . . . . ?
C13 C14 C15 C16 -0.5(15) . . . . ?
C14 C15 C16 C17 -0.1(16) . . . . ?
C15 C16 C17 N6 0.3(15) . . . . ?
C15 C16 C17 C18 -178.2(10) . . . . ?
C13 N6 C17 C16 0.1(13) . . . . ?
Dy1 N6 C17 C16 -177.1(7) . . . . ?
C13 N6 C17 C18 178.7(8) . . . . ?
Dy1 N6 C17 C18 1.4(10) . . . . ?
N8 N7 C18 N9 -0.4(11) . . . . ?
Dy1 N7 C18 N9 -179.0(6) . . . . ?
N8 N7 C18 C17 -179.7(8) . . . . ?
Dy1 N7 C18 C17 1.7(13) . . . . ?
C19 N9 C18 N7 0.8(11) . . . . ?
C19 N9 C18 C17 -180.0(10) . . . . ?
C16 C17 C18 N7 176.6(9) . . . . ?
N6 C17 C18 N7 -2.0(13) . . . . ?
C16 C17 C18 N9 -2.6(16) . . . . ?
N6 C17 C18 N9 178.9(9) . . . . ?
C18 N9 C19 N8 -0.9(11) . . . . ?
C18 N9 C19 C20 179.8(10) . . . . ?
N7 N8 C19 N9 0.7(11) . . . . ?
Dy2 N8 C19 N9 -179.0(6) . . . . ?
N7 N8 C19 C20 -179.9(8) . . . . ?
Dy2 N8 C19 C20 0.4(12) . . . . ?
C24 N10 C20 C21 2.6(13) . . . . ?
Dy2 N10 C20 C21 178.8(7) . . . . ?
C24 N10 C20 C19 179.8(8) . . . . ?
Dy2 N10 C20 C19 -4.0(10) . . . . ?
N9 C19 C20 N10 -178.2(9) . . . . ?
N8 C19 C20 N10 2.5(12) . . . . ?
N9 C19 C20 C21 -1.0(16) . . . . ?
N8 C19 C20 C21 179.7(9) . . . . ?
N10 C20 C21 C22 -0.3(14) . . . . ?
C19 C20 C21 C22 -177.3(9) . . . . ?
C20 C21 C22 C23 -1.2(15) . . . . ?
C21 C22 C23 C24 0.4(15) . . . . ?
C20 N10 C24 C23 -3.4(14) . . . . ?
Dy2 N10 C24 C23 -179.4(7) . . . . ?
C22 C23 C24 N10 2.0(16) . . . . ?

loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_site_symmetry_A
O1 H1O Br1 0.85 2.88 3.360(5) 118.1 .
O2 H2O Br2 0.85 2.55 3.374(6) 163.3 .
O1W H1WA O4 0.85 1.89 2.719(9) 164.9 .
O1W H1WB Br2 0.85 2.47 3.312(6) 168.8 .
O2W H2WA O3 0.85 1.83 2.624(8) 154.8 .
O2W H2WB O3W 0.85 1.98 2.797(10) 160.7 .
O3W H3WA Br2 0.85 2.42 3.274(7) 177.6 2_665

_diffrn_measured_fraction_theta_max 0.976
_diffrn_reflns_theta_full        27.45
_diffrn_measured_fraction_theta_full 0.976
_refine_diff_density_max         2.513
_refine_diff_density_min         -2.099
_refine_diff_density_rms         0.259
