data_shelxl _audit_creation_method SHELXL-97 _chemical_name_systematic ; ? ; _chemical_name_common ? _chemical_melting_point ? _chemical_formula_moiety ? _chemical_formula_sum 'C19 H26 Dy N5 O16 Zn' _chemical_formula_weight 808.27 loop_ _atom_type_symbol _atom_type_description _atom_type_scat_dispersion_real _atom_type_scat_dispersion_imag _atom_type_scat_source 'C' 'C' 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 'H' 'H' 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 'Dy' 'Dy' -0.1892 4.4098 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' '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' 'Zn' 'Zn' 0.2839 1.4301 '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 9.3967(8) _cell_length_b 9.5343(8) _cell_length_c 16.0729(14) _cell_angle_alpha 103.557(7) _cell_angle_beta 100.567(7) _cell_angle_gamma 97.521(7) _cell_volume 1353.2(2) _cell_formula_units_Z 2 _cell_measurement_temperature 293(2) _cell_measurement_reflns_used 12367 _cell_measurement_theta_min 2.67 _cell_measurement_theta_max 29.19 _exptl_crystal_description prism _exptl_crystal_colour yellow _exptl_crystal_size_max 0.5 _exptl_crystal_size_mid 0.35 _exptl_crystal_size_min 0.2 _exptl_crystal_density_meas 'not measured' _exptl_crystal_density_diffrn 1.969 _exptl_crystal_density_method 'not measured' _exptl_crystal_F_000 786 _exptl_absorpt_coefficient_mu 3.711 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_correction_T_min 0.1992 _exptl_absorpt_correction_T_max 0.5310 _exptl_absorpt_process_details ? _exptl_special_details ; ? ; _diffrn_ambient_temperature 293(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 'STOE-IPDS II' _diffrn_measurement_method 'omega scans' _diffrn_detector_area_resol_mean ? _diffrn_standards_number ? _diffrn_standards_interval_count ? _diffrn_standards_interval_time ? _diffrn_standards_decay_% ? _diffrn_reflns_number 15919 _diffrn_reflns_av_R_equivalents 0.0615 _diffrn_reflns_av_sigmaI/netI 0.0496 _diffrn_reflns_limit_h_min -12 _diffrn_reflns_limit_h_max 12 _diffrn_reflns_limit_k_min -13 _diffrn_reflns_limit_k_max 12 _diffrn_reflns_limit_l_min -22 _diffrn_reflns_limit_l_max 22 _diffrn_reflns_theta_min 2.67 _diffrn_reflns_theta_max 29.19 _reflns_number_total 7210 _reflns_number_gt 6520 _reflns_threshold_expression >2sigma(I) _computing_data_collection 'X-Area' _computing_cell_refinement 'X-Area' _computing_data_reduction 'X-Area' _computing_structure_solution 'SHELXS-97 (Sheldrick, 1997)' _computing_structure_refinement 'SHELXL-97 (Sheldrick, 1997)' _computing_molecular_graphics ? _computing_publication_material ? _refine_special_details ; Refinement of F^2^ against ALL reflections. The weighted R-factor wR and goodness of fit S are based on F^2^, conventional R-factors R are based on F, with F set to zero for negative F^2^. The threshold expression of F^2^ > 2sigma(F^2^) is used only for calculating R-factors(gt) etc. and is not relevant to the choice of reflections for refinement. R-factors based on F^2^ 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/[\s^2^(Fo^2^)+(0.0653P)^2^+2.4899P] where P=(Fo^2^+2Fc^2^)/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 SHELXL _refine_ls_extinction_coef 0.0067(8) _refine_ls_extinction_expression 'Fc^*^=kFc[1+0.001xFc^2^\l^3^/sin(2\q)]^-1/4^' _refine_ls_number_reflns 7210 _refine_ls_number_parameters 380 _refine_ls_number_restraints 0 _refine_ls_R_factor_all 0.0489 _refine_ls_R_factor_gt 0.0434 _refine_ls_wR_factor_ref 0.1131 _refine_ls_wR_factor_gt 0.1105 _refine_ls_goodness_of_fit_ref 1.040 _refine_ls_restrained_S_all 1.040 _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 0.5210(6) -0.1759(6) 0.1201(5) 0.0471(13) Uani 1 1 d . . . H1A H 0.5051 -0.1780 0.1771 0.071 Uiso 1 1 calc R . . H1B H 0.5349 -0.2710 0.0899 0.071 Uiso 1 1 calc R . . H1C H 0.4370 -0.1503 0.0870 0.071 Uiso 1 1 calc R . . C2 C 0.6885(5) -0.0525(5) 0.0525(3) 0.0301(9) Uani 1 1 d . . . C3 C 0.6187(6) -0.1375(6) -0.0305(4) 0.0424(12) Uani 1 1 d . . . H3 H 0.5376 -0.2105 -0.0386 0.051 Uiso 1 1 calc R . . C4 C 0.6718(7) -0.1125(7) -0.1025(4) 0.0468(13) Uani 1 1 d . . . H4 H 0.6283 -0.1717 -0.1586 0.056 Uiso 1 1 calc R . . C5 C 0.7867(7) -0.0020(7) -0.0908(3) 0.0424(12) Uani 1 1 d . . . H5 H 0.8209 0.0130 -0.1394 0.051 Uiso 1 1 calc R . . C6 C 0.8554(5) 0.0907(5) -0.0067(3) 0.0311(9) Uani 1 1 d . . . C7 C 0.8092(5) 0.0619(5) 0.0673(3) 0.0270(8) Uani 1 1 d . . . C8 C 0.9728(6) 0.2083(6) -0.0019(3) 0.0356(10) Uani 1 1 d . . . H8 H 1.0000 0.2101 -0.0545 0.043 Uiso 1 1 calc R . . C9 C 1.1568(7) 0.4164(6) 0.0470(4) 0.0464(13) Uani 1 1 d . . . H9A H 1.1156 0.4427 -0.0059 0.056 Uiso 1 1 calc R . . H9B H 1.2404 0.3703 0.0368 0.056 Uiso 1 1 calc R . . C10 C 1.2078(8) 0.5518(6) 0.1208(5) 0.0516(15) Uani 1 1 d . . . H10A H 1.1218 0.5899 0.1347 0.062 Uiso 1 1 calc R . . H10B H 1.2641 0.6245 0.1004 0.062 Uiso 1 1 calc R . . C11 C 1.3001(6) 0.5370(7) 0.2040(5) 0.0502(14) Uani 1 1 d . . . H11A H 1.3766 0.4827 0.1897 0.060 Uiso 1 1 calc R . . H11B H 1.3475 0.6339 0.2408 0.060 Uiso 1 1 calc R . . C12 C 1.2669(6) 0.4902(5) 0.3367(4) 0.0392(11) Uani 1 1 d . . . H12 H 1.3575 0.5532 0.3570 0.047 Uiso 1 1 calc R . . C13 C 1.2057(6) 0.4381(5) 0.4023(3) 0.0358(10) Uani 1 1 d . . . C14 C 1.2839(7) 0.4936(7) 0.4910(4) 0.0506(14) Uani 1 1 d . . . H14 H 1.3713 0.5608 0.5043 0.061 Uiso 1 1 calc R . . C15 C 1.2338(8) 0.4505(7) 0.5568(4) 0.0558(16) Uani 1 1 d . . . H15 H 1.2876 0.4881 0.6143 0.067 Uiso 1 1 calc R . . C16 C 1.1024(8) 0.3504(7) 0.5390(4) 0.0466(13) Uani 1 1 d . . . H16 H 1.0670 0.3227 0.5842 0.056 Uiso 1 1 calc R . . C17 C 1.0264(6) 0.2934(5) 0.4530(3) 0.0330(9) Uani 1 1 d . . . C18 C 1.0756(5) 0.3340(5) 0.3832(3) 0.0293(8) Uani 1 1 d . . . C19 C 0.8381(9) 0.1444(8) 0.4939(4) 0.0551(16) Uani 1 1 d . . . H19A H 0.7481 0.0750 0.4678 0.083 Uiso 1 1 calc R . . H19B H 0.8190 0.2274 0.5345 0.083 Uiso 1 1 calc R . . H19C H 0.9083 0.0988 0.5245 0.083 Uiso 1 1 calc R . . Dy1 Dy 0.82391(2) 0.06472(2) 0.268270(13) 0.02512(9) Uani 1 1 d . . . N1 N 1.0441(5) 0.3101(5) 0.0653(3) 0.0344(8) Uani 1 1 d . . . N2 N 1.2124(5) 0.4609(4) 0.2540(3) 0.0359(9) Uani 1 1 d . . . N3 N 0.7622(5) 0.4892(5) 0.1681(4) 0.0427(10) Uani 1 1 d . . . N4 N 1.0507(6) -0.1130(5) 0.2686(3) 0.0416(10) Uani 1 1 d . . . N5 N 0.5808(5) 0.2092(5) 0.2986(3) 0.0346(8) Uani 1 1 d . . . O1 O 0.6499(4) -0.0688(4) 0.1293(2) 0.0360(7) Uani 1 1 d . . . O2 O 0.8729(4) 0.1350(3) 0.1492(2) 0.0293(6) Uani 1 1 d . . . O1W O 0.7356(5) -0.1493(4) 0.3087(3) 0.0435(9) Uani 1 1 d . . . O3 O 0.9974(4) 0.2707(4) 0.3023(2) 0.0316(7) Uani 1 1 d . . . O2W O 0.5171(6) -0.1682(5) 0.3964(3) 0.0574(11) Uani 1 1 d . . . O4 O 0.8961(4) 0.1922(4) 0.4265(2) 0.0378(8) Uani 1 1 d . . . O3W O 1.3598(6) 0.0888(7) 0.4240(4) 0.0640(13) Uani 1 1 d . . . O5 O 0.8869(5) 0.5014(5) 0.2178(3) 0.0485(10) Uani 1 1 d . . . O6 O 0.7266(6) 0.3905(6) 0.0972(4) 0.0639(13) Uani 1 1 d . . . O7 O 0.6805(6) 0.5731(5) 0.1896(4) 0.0699(15) Uani 1 1 d . . . O8 O 0.9461(5) -0.1341(5) 0.2028(3) 0.0440(9) Uani 1 1 d . . . O9 O 1.0500(5) -0.0092(4) 0.3339(3) 0.0441(9) Uani 1 1 d . . . O10 O 1.1468(7) -0.1862(7) 0.2697(4) 0.084(2) Uani 1 1 d . . . O11 O 0.6705(5) 0.2583(4) 0.2599(3) 0.0430(8) Uani 1 1 d . . . O12 O 0.5950(5) 0.0876(5) 0.3152(3) 0.0461(9) Uani 1 1 d . . . O13 O 0.4828(5) 0.2723(5) 0.3202(3) 0.0501(10) Uani 1 1 d . . . Zn1 Zn 1.00713(6) 0.33902(6) 0.19004(4) 0.02784(12) Uani 1 1 d . . . loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_23 _atom_site_aniso_U_13 _atom_site_aniso_U_12 C1 0.033(3) 0.037(3) 0.064(4) 0.018(3) 0.000(2) -0.011(2) C2 0.027(2) 0.029(2) 0.028(2) 0.0020(16) -0.0001(16) 0.0025(16) C3 0.035(3) 0.038(2) 0.038(3) -0.002(2) -0.010(2) -0.001(2) C4 0.048(3) 0.051(3) 0.030(2) 0.000(2) -0.006(2) 0.008(3) C5 0.047(3) 0.052(3) 0.026(2) 0.009(2) 0.002(2) 0.012(2) C6 0.033(2) 0.034(2) 0.025(2) 0.0062(17) 0.0032(17) 0.0088(18) C7 0.026(2) 0.0250(18) 0.0268(19) 0.0048(15) 0.0003(15) 0.0037(15) C8 0.042(3) 0.040(2) 0.032(2) 0.0153(19) 0.015(2) 0.014(2) C9 0.050(3) 0.044(3) 0.053(3) 0.020(3) 0.025(3) 0.002(2) C10 0.052(3) 0.038(3) 0.069(4) 0.022(3) 0.023(3) 0.000(2) C11 0.029(2) 0.055(3) 0.069(4) 0.027(3) 0.013(3) -0.008(2) C12 0.024(2) 0.028(2) 0.056(3) 0.003(2) 0.002(2) -0.0044(17) C13 0.030(2) 0.031(2) 0.036(2) 0.0001(19) -0.0029(19) -0.0011(18) C14 0.042(3) 0.043(3) 0.046(3) -0.006(2) -0.013(2) -0.004(2) C15 0.062(4) 0.052(3) 0.035(3) -0.003(2) -0.010(3) 0.002(3) C16 0.058(4) 0.045(3) 0.027(2) 0.003(2) -0.002(2) 0.005(3) C17 0.039(3) 0.0255(19) 0.028(2) 0.0007(16) 0.0022(18) 0.0028(18) C18 0.029(2) 0.0230(18) 0.030(2) 0.0020(16) -0.0013(17) 0.0035(16) C19 0.072(5) 0.057(3) 0.036(3) 0.014(3) 0.021(3) -0.004(3) Dy1 0.02481(12) 0.02425(11) 0.02506(12) 0.00611(7) 0.00629(7) -0.00016(7) N1 0.036(2) 0.0336(19) 0.040(2) 0.0161(17) 0.0156(18) 0.0073(16) N2 0.0278(19) 0.0285(18) 0.049(2) 0.0091(17) 0.0088(17) -0.0004(15) N3 0.038(2) 0.035(2) 0.061(3) 0.019(2) 0.015(2) 0.0123(18) N4 0.041(2) 0.040(2) 0.046(3) 0.0109(19) 0.014(2) 0.0146(19) N5 0.030(2) 0.038(2) 0.0310(19) 0.0039(16) 0.0033(16) 0.0051(16) O1 0.0298(17) 0.0347(17) 0.0378(18) 0.0080(14) 0.0046(14) -0.0070(14) O2 0.0317(16) 0.0268(14) 0.0248(14) 0.0047(12) 0.0042(12) -0.0037(12) O1W 0.050(2) 0.0348(18) 0.051(2) 0.0157(16) 0.0204(19) 0.0033(16) O3 0.0300(16) 0.0316(15) 0.0278(15) 0.0078(13) 0.0010(12) -0.0049(13) O2W 0.059(3) 0.055(3) 0.055(3) 0.008(2) 0.021(2) 0.000(2) O4 0.045(2) 0.0356(17) 0.0292(16) 0.0056(14) 0.0092(15) -0.0020(15) O3W 0.047(3) 0.087(4) 0.060(3) 0.027(3) 0.015(2) 0.002(3) O5 0.040(2) 0.039(2) 0.064(3) 0.0091(19) 0.0098(19) 0.0090(17) O6 0.063(3) 0.059(3) 0.059(3) 0.004(2) 0.004(2) 0.010(2) O7 0.052(3) 0.047(2) 0.109(5) 0.010(3) 0.015(3) 0.026(2) O8 0.051(2) 0.046(2) 0.0337(18) 0.0042(16) 0.0120(17) 0.0095(18) O9 0.046(2) 0.0405(19) 0.042(2) 0.0032(16) 0.0048(17) 0.0136(17) O10 0.067(4) 0.078(4) 0.097(4) -0.003(3) 0.006(3) 0.048(3) O11 0.042(2) 0.0410(19) 0.050(2) 0.0169(17) 0.0151(18) 0.0061(16) O12 0.044(2) 0.044(2) 0.061(3) 0.0219(19) 0.0238(19) 0.0107(17) O13 0.040(2) 0.053(2) 0.056(3) 0.005(2) 0.0137(19) 0.0202(19) Zn1 0.0247(2) 0.0261(2) 0.0318(3) 0.00834(19) 0.00646(19) -0.00035(18) _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 O1 1.439(6) . ? C1 H1A 0.9600 . ? C1 H1B 0.9600 . ? C1 H1C 0.9600 . ? C2 C3 1.379(7) . ? C2 O1 1.385(6) . ? C2 C7 1.410(6) . ? C3 C4 1.398(9) . ? C3 H3 0.9300 . ? C4 C5 1.359(9) . ? C4 H4 0.9300 . ? C5 C6 1.413(7) . ? C5 H5 0.9300 . ? C6 C7 1.411(6) . ? C6 C8 1.444(7) . ? C7 O2 1.322(5) . ? C8 N1 1.277(7) . ? C8 H8 0.9300 . ? C9 N1 1.485(6) . ? C9 C10 1.488(9) . ? C9 H9A 0.9700 . ? C9 H9B 0.9700 . ? C10 C11 1.502(10) . ? C10 H10A 0.9700 . ? C10 H10B 0.9700 . ? C11 N2 1.487(7) . ? C11 H11A 0.9700 . ? C11 H11B 0.9700 . ? C12 N2 1.283(8) . ? C12 C13 1.444(8) . ? C12 H12 0.9300 . ? C13 C18 1.405(7) . ? C13 C14 1.419(7) . ? C14 C15 1.358(10) . ? C14 H14 0.9300 . ? C15 C16 1.397(10) . ? C15 H15 0.9300 . ? C16 C17 1.378(7) . ? C16 H16 0.9300 . ? C17 O4 1.385(6) . ? C17 C18 1.404(7) . ? C18 O3 1.326(5) . ? C19 O4 1.437(6) . ? C19 H19A 0.9600 . ? C19 H19B 0.9600 . ? C19 H19C 0.9600 . ? Dy1 O3 2.268(3) . ? Dy1 O2 2.274(3) . ? Dy1 O1W 2.378(4) . ? Dy1 O12 2.426(4) . ? Dy1 O9 2.458(4) . ? Dy1 O1 2.463(4) . ? Dy1 O8 2.469(4) . ? Dy1 O4 2.471(4) . ? Dy1 O11 2.499(4) . ? Dy1 N5 2.876(4) . ? Dy1 N4 2.891(5) . ? Dy1 Zn1 3.5414(6) . ? N1 Zn1 2.059(4) . ? N2 Zn1 2.062(4) . ? N3 O7 1.216(6) . ? N3 O6 1.253(7) . ? N3 O5 1.265(7) . ? N4 O10 1.211(6) . ? N4 O8 1.262(6) . ? N4 O9 1.264(6) . ? N5 O13 1.223(6) . ? N5 O11 1.241(6) . ? N5 O12 1.268(6) . ? O2 Zn1 2.064(3) . ? O3 Zn1 2.070(3) . ? O5 Zn1 2.048(4) . ? 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 C1 H1A 109.5 . . ? O1 C1 H1B 109.5 . . ? H1A C1 H1B 109.5 . . ? O1 C1 H1C 109.5 . . ? H1A C1 H1C 109.5 . . ? H1B C1 H1C 109.5 . . ? C3 C2 O1 124.8(5) . . ? C3 C2 C7 122.2(5) . . ? O1 C2 C7 113.0(4) . . ? C2 C3 C4 119.0(5) . . ? C2 C3 H3 120.5 . . ? C4 C3 H3 120.5 . . ? C5 C4 C3 120.3(5) . . ? C5 C4 H4 119.9 . . ? C3 C4 H4 119.9 . . ? C4 C5 C6 121.6(5) . . ? C4 C5 H5 119.2 . . ? C6 C5 H5 119.2 . . ? C7 C6 C5 119.0(5) . . ? C7 C6 C8 123.8(4) . . ? C5 C6 C8 117.2(5) . . ? O2 C7 C2 118.4(4) . . ? O2 C7 C6 123.9(4) . . ? C2 C7 C6 117.7(4) . . ? N1 C8 C6 128.4(4) . . ? N1 C8 H8 115.8 . . ? C6 C8 H8 115.8 . . ? N1 C9 C10 112.0(5) . . ? N1 C9 H9A 109.2 . . ? C10 C9 H9A 109.2 . . ? N1 C9 H9B 109.2 . . ? C10 C9 H9B 109.2 . . ? H9A C9 H9B 107.9 . . ? C9 C10 C11 116.9(6) . . ? C9 C10 H10A 108.1 . . ? C11 C10 H10A 108.1 . . ? C9 C10 H10B 108.1 . . ? C11 C10 H10B 108.1 . . ? H10A C10 H10B 107.3 . . ? N2 C11 C10 112.6(5) . . ? N2 C11 H11A 109.1 . . ? C10 C11 H11A 109.1 . . ? N2 C11 H11B 109.1 . . ? C10 C11 H11B 109.1 . . ? H11A C11 H11B 107.8 . . ? N2 C12 C13 128.3(5) . . ? N2 C12 H12 115.8 . . ? C13 C12 H12 115.8 . . ? C18 C13 C14 118.5(5) . . ? C18 C13 C12 123.9(4) . . ? C14 C13 C12 117.6(5) . . ? C15 C14 C13 121.3(6) . . ? C15 C14 H14 119.3 . . ? C13 C14 H14 119.3 . . ? C14 C15 C16 120.7(5) . . ? C14 C15 H15 119.6 . . ? C16 C15 H15 119.6 . . ? C17 C16 C15 118.7(6) . . ? C17 C16 H16 120.7 . . ? C15 C16 H16 120.7 . . ? C16 C17 O4 124.4(5) . . ? C16 C17 C18 122.3(5) . . ? O4 C17 C18 113.4(4) . . ? O3 C18 C17 118.1(4) . . ? O3 C18 C13 123.4(4) . . ? C17 C18 C13 118.5(4) . . ? O4 C19 H19A 109.5 . . ? O4 C19 H19B 109.5 . . ? H19A C19 H19B 109.5 . . ? O4 C19 H19C 109.5 . . ? H19A C19 H19C 109.5 . . ? H19B C19 H19C 109.5 . . ? O3 Dy1 O2 66.22(12) . . ? O3 Dy1 O1W 146.65(14) . . ? O2 Dy1 O1W 140.35(13) . . ? O3 Dy1 O12 117.55(14) . . ? O2 Dy1 O12 122.37(13) . . ? O1W Dy1 O12 69.93(14) . . ? O3 Dy1 O9 76.12(13) . . ? O2 Dy1 O9 105.38(13) . . ? O1W Dy1 O9 76.43(15) . . ? O12 Dy1 O9 132.05(14) . . ? O3 Dy1 O1 131.10(11) . . ? O2 Dy1 O1 65.92(11) . . ? O1W Dy1 O1 81.07(13) . . ? O12 Dy1 O1 81.09(14) . . ? O9 Dy1 O1 126.44(13) . . ? O3 Dy1 O8 104.38(14) . . ? O2 Dy1 O8 78.78(13) . . ? O1W Dy1 O8 71.91(14) . . ? O12 Dy1 O8 137.66(15) . . ? O9 Dy1 O8 51.46(13) . . ? O1 Dy1 O8 75.51(13) . . ? O3 Dy1 O4 65.82(12) . . ? O2 Dy1 O4 131.25(11) . . ? O1W Dy1 O4 87.47(13) . . ? O12 Dy1 O4 74.40(15) . . ? O9 Dy1 O4 70.89(13) . . ? O1 Dy1 O4 155.28(13) . . ? O8 Dy1 O4 121.52(13) . . ? O3 Dy1 O11 77.91(13) . . ? O2 Dy1 O11 77.81(13) . . ? O1W Dy1 O11 120.73(14) . . ? O12 Dy1 O11 51.31(13) . . ? O9 Dy1 O11 149.63(14) . . ? O1 Dy1 O11 82.94(13) . . ? O8 Dy1 O11 153.09(14) . . ? O4 Dy1 O11 84.27(14) . . ? O3 Dy1 N5 96.83(13) . . ? O2 Dy1 N5 100.98(12) . . ? O1W Dy1 N5 95.79(14) . . ? O12 Dy1 N5 25.93(13) . . ? O9 Dy1 N5 146.75(13) . . ? O1 Dy1 N5 82.84(12) . . ? O8 Dy1 N5 156.41(14) . . ? O4 Dy1 N5 76.58(13) . . ? O11 Dy1 N5 25.49(13) . . ? O3 Dy1 N4 90.33(14) . . ? O2 Dy1 N4 92.29(13) . . ? O1W Dy1 N4 72.34(14) . . ? O12 Dy1 N4 141.39(14) . . ? O9 Dy1 N4 25.75(13) . . ? O1 Dy1 N4 100.98(14) . . ? O8 Dy1 N4 25.71(14) . . ? O4 Dy1 N4 96.23(14) . . ? O11 Dy1 N4 166.91(14) . . ? N5 Dy1 N4 166.58(13) . . ? O3 Dy1 Zn1 33.47(8) . . ? O2 Dy1 Zn1 33.36(8) . . ? O1W Dy1 Zn1 168.00(10) . . ? O12 Dy1 Zn1 121.81(9) . . ? O9 Dy1 Zn1 95.12(11) . . ? O1 Dy1 Zn1 97.69(8) . . ? O8 Dy1 Zn1 96.18(10) . . ? O4 Dy1 Zn1 97.91(8) . . ? O11 Dy1 Zn1 70.68(9) . . ? N5 Dy1 Zn1 95.89(9) . . ? N4 Dy1 Zn1 96.33(10) . . ? C8 N1 C9 114.6(4) . . ? C8 N1 Zn1 125.2(3) . . ? C9 N1 Zn1 120.1(4) . . ? C12 N2 C11 115.5(5) . . ? C12 N2 Zn1 125.5(4) . . ? C11 N2 Zn1 118.7(4) . . ? O7 N3 O6 121.6(6) . . ? O7 N3 O5 119.7(6) . . ? O6 N3 O5 118.7(5) . . ? O10 N4 O8 122.7(5) . . ? O10 N4 O9 121.5(6) . . ? O8 N4 O9 115.7(4) . . ? O10 N4 Dy1 179.1(5) . . ? O8 N4 Dy1 58.1(3) . . ? O9 N4 Dy1 57.6(3) . . ? O13 N5 O11 123.1(5) . . ? O13 N5 O12 120.4(5) . . ? O11 N5 O12 116.5(4) . . ? O13 N5 Dy1 173.6(4) . . ? O11 N5 Dy1 60.1(3) . . ? O12 N5 Dy1 56.8(2) . . ? C2 O1 C1 116.7(4) . . ? C2 O1 Dy1 117.0(3) . . ? C1 O1 Dy1 125.8(3) . . ? C7 O2 Zn1 126.5(3) . . ? C7 O2 Dy1 123.6(3) . . ? Zn1 O2 Dy1 109.35(14) . . ? C18 O3 Zn1 127.6(3) . . ? C18 O3 Dy1 123.0(3) . . ? Zn1 O3 Dy1 109.36(14) . . ? C17 O4 C19 117.0(4) . . ? C17 O4 Dy1 115.7(3) . . ? C19 O4 Dy1 125.1(4) . . ? N3 O5 Zn1 118.6(4) . . ? N4 O8 Dy1 96.2(3) . . ? N4 O9 Dy1 96.6(3) . . ? N5 O11 Dy1 94.5(3) . . ? N5 O12 Dy1 97.3(3) . . ? O5 Zn1 N1 111.03(18) . . ? O5 Zn1 N2 97.90(17) . . ? N1 Zn1 N2 95.92(18) . . ? O5 Zn1 O2 110.83(16) . . ? N1 Zn1 O2 88.93(15) . . ? N2 Zn1 O2 146.93(15) . . ? O5 Zn1 O3 95.18(17) . . ? N1 Zn1 O3 152.57(15) . . ? N2 Zn1 O3 88.06(16) . . ? O2 Zn1 O3 73.76(13) . . ? O5 Zn1 Dy1 100.82(13) . . ? N1 Zn1 Dy1 125.21(12) . . ? N2 Zn1 Dy1 122.99(13) . . ? O2 Zn1 Dy1 37.29(9) . . ? O3 Zn1 Dy1 37.17(9) . . ? _diffrn_measured_fraction_theta_max 0.986 _diffrn_reflns_theta_full 29.19 _diffrn_measured_fraction_theta_full 0.986 _refine_diff_density_max 1.683 _refine_diff_density_min -2.604 _refine_diff_density_rms 0.157