#------------------------------------------------------------------------------
#$Date: 2016-03-22 11:02:04 +0200 (Tue, 22 Mar 2016) $
#$Revision: 178882 $
#$URL: svn://www.crystallography.net/cod/cif/4/11/11/4111167.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_4111167
loop_
_publ_author_name
'Shigehisa Akine'
'Takanori Taniguchi'
'Tatsuya Nabeshima'
_publ_contact_author_address
;
Tsukuba, Ibaraki 305-8571, Japan
;
_publ_contact_author_email       nabesima@chem.tsukuba.ac.jp
_publ_contact_author_fax         +81-29-853-4507
_publ_contact_author_name        'Tatsuya Nabeshima'
_publ_contact_author_phone       +81-29-853-4507
_publ_section_title
;
 Helical Metallohost-Guest Complexes via Site-Selective Transmetalation of
 Homotrinuclear Complexes
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              15765
_journal_page_last               15774
_journal_paper_doi               10.1021/ja0646702
_journal_volume                  128
_journal_year                    2006
_chemical_formula_moiety         C39H51DyN4O19Zn2
_chemical_formula_sum            'C39 H51 Dy N4 O19 Zn2'
_chemical_formula_weight         1173.08
_chemical_name_common            '[LZn2Dy(OAc)3(MeOH)](H2O)(Et2O)'
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                74.158(12)
_cell_angle_beta                 83.194(14)
_cell_angle_gamma                87.200(16)
_cell_formula_units_Z            2
_cell_length_a                   13.019(7)
_cell_length_b                   13.279(6)
_cell_length_c                   13.444(7)
_cell_measurement_reflns_used    15779
_cell_measurement_temperature    120
_cell_measurement_theta_max      26.00
_cell_measurement_theta_min      3.06
_cell_volume                     2219.8(19)
_computing_cell_refinement       'CrystalClear (Rigaku Corp., 2000)'
_computing_data_collection       'CrystalClear (Rigaku Corp., 2000)'
_computing_data_reduction        'CrystalClear (Rigaku Corp., 2000)'
_computing_molecular_graphics    ORTEP-3
_computing_publication_material  ORTEP-3
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'DIRDIF99 (Beurskens et al., 1999)'
_diffrn_ambient_temperature      120
_diffrn_measured_fraction_theta_full 0.966
_diffrn_measured_fraction_theta_max 0.966
_diffrn_measurement_device_type  'Rigaku Mercury CCD system'
_diffrn_measurement_method       CCD
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_diffrn_reflns_av_R_equivalents  0.0351
_diffrn_reflns_av_sigmaI/netI    0.0475
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -11
_diffrn_reflns_number            15779
_diffrn_reflns_theta_full        26.00
_diffrn_reflns_theta_max         26.00
_diffrn_reflns_theta_min         3.06
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    2.820
_exptl_absorpt_correction_T_max  0.6771
_exptl_absorpt_correction_T_min  0.3330
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'CrystalClear (Rigaku Corp., 2000)'
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.755
_exptl_crystal_description       prismatic
_exptl_crystal_F_000             1182
_exptl_crystal_size_max          0.50
_exptl_crystal_size_mid          0.25
_exptl_crystal_size_min          0.15
_refine_diff_density_max         1.040
_refine_diff_density_min         -1.206
_refine_diff_density_rms         0.125
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.036
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     619
_refine_ls_number_reflns         8437
_refine_ls_number_restraints     4
_refine_ls_restrained_S_all      1.036
_refine_ls_R_factor_all          0.0522
_refine_ls_R_factor_gt           0.0439
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0653P)²+5.2676P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1085
_refine_ls_wR_factor_ref         0.1131
_reflns_number_gt                7625
_reflns_number_total             8437
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ja0646702si20060630_083835.cif
_cod_data_source_block           LZn2Dy
_cod_database_code               4111167
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
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 0.236782(17) 0.361337(17) 0.275701(17) 0.01598(8) Uani 1 1 d . . .
Zn1 Zn 0.28361(4) 0.49352(4) 0.45418(4) 0.01736(13) Uani 1 1 d . . .
Zn2 Zn 0.25970(5) 0.09816(5) 0.27881(5) 0.02242(14) Uani 1 1 d . . .
C1 C 0.0465(4) 0.6074(4) 0.4222(4) 0.0197(10) Uani 1 1 d . . .
C2 C 0.0836(4) 0.5398(4) 0.3600(4) 0.0190(10) Uani 1 1 d . . .
C3 C 0.0311(4) 0.5433(4) 0.2728(4) 0.0205(10) Uani 1 1 d . . .
C4 C -0.0521(4) 0.6083(4) 0.2480(4) 0.0274(12) Uani 1 1 d . . .
H1 H -0.0849 0.6094 0.1882 0.033 Uiso 1 1 calc R . .
C5 C -0.0886(4) 0.6733(4) 0.3113(4) 0.0278(12) Uani 1 1 d . . .
H2 H -0.1465 0.7186 0.2945 0.033 Uiso 1 1 calc R . .
C6 C -0.0412(4) 0.6716(4) 0.3972(4) 0.0242(11) Uani 1 1 d . . .
H3 H -0.0679 0.7144 0.4408 0.029 Uiso 1 1 calc R . .
O1 O 0.1599(2) 0.4717(3) 0.3806(3) 0.0183(7) Uani 1 1 d . . .
O2 O 0.0729(3) 0.4724(3) 0.2176(3) 0.0228(8) Uani 1 1 d . . .
C7 C 0.0042(4) 0.4411(5) 0.1555(4) 0.0321(13) Uani 1 1 d . . .
H4 H -0.0620 0.4203 0.1974 0.048 Uiso 1 1 calc R . .
H5 H 0.0351 0.3818 0.1316 0.048 Uiso 1 1 calc R . .
H6 H -0.0073 0.4998 0.0952 0.048 Uiso 1 1 calc R . .
C8 C 0.0906(4) 0.6077(4) 0.5165(4) 0.0222(11) Uani 1 1 d . . .
H7 H 0.0492 0.6356 0.5661 0.027 Uiso 1 1 calc R . .
N1 N 0.1811(3) 0.5730(3) 0.5376(3) 0.0204(9) Uani 1 1 d . . .
O3 O 0.1987(3) 0.5759(3) 0.6395(3) 0.0231(8) Uani 1 1 d . . .
C9 C 0.2809(4) 0.6450(4) 0.6359(4) 0.0249(11) Uani 1 1 d . . .
H8 H 0.2889 0.6462 0.7079 0.030 Uiso 1 1 calc R . .
H9 H 0.2607 0.7167 0.5975 0.030 Uiso 1 1 calc R . .
C10 C 0.3848(4) 0.6173(5) 0.5855(4) 0.0278(12) Uani 1 1 d . . .
H10 H 0.3811 0.6287 0.5101 0.033 Uiso 1 1 calc R . .
H11 H 0.4378 0.6645 0.5938 0.033 Uiso 1 1 calc R . .
O4 O 0.4156(3) 0.5113(3) 0.6294(3) 0.0294(9) Uani 1 1 d . . .
N2 N 0.3829(3) 0.4444(4) 0.5729(3) 0.0222(9) Uani 1 1 d . . .
C11 C 0.4186(4) 0.3506(4) 0.6090(4) 0.0240(11) Uani 1 1 d . . .
H12 H 0.4602 0.3393 0.6647 0.029 Uiso 1 1 calc R . .
C12 C 0.4008(4) 0.2620(4) 0.5722(4) 0.0233(11) Uani 1 1 d . . .
C13 C 0.3542(4) 0.2693(4) 0.4815(4) 0.0186(10) Uani 1 1 d . . .
C14 C 0.3412(4) 0.1789(4) 0.4473(4) 0.0198(10) Uani 1 1 d . . .
C15 C 0.3691(4) 0.0797(4) 0.5090(4) 0.0278(12) Uani 1 1 d . . .
C16 C 0.4179(5) 0.0740(5) 0.5983(5) 0.0358(14) Uani 1 1 d . . .
H13 H 0.4403 0.0078 0.6383 0.043 Uiso 1 1 calc R . .
C17 C 0.4337(5) 0.1615(5) 0.6290(4) 0.0336(13) Uani 1 1 d . . .
H14 H 0.4673 0.1550 0.6895 0.040 Uiso 1 1 calc R . .
O5 O 0.3204(3) 0.3585(3) 0.4215(3) 0.0194(7) Uani 1 1 d . . .
O6 O 0.2992(3) 0.1958(3) 0.3599(3) 0.0208(7) Uani 1 1 d . . .
C18 C 0.3474(5) -0.0186(4) 0.4876(4) 0.0302(13) Uani 1 1 d . . .
H15 H 0.3675 -0.0814 0.5354 0.036 Uiso 1 1 calc R . .
N3 N 0.3039(4) -0.0279(3) 0.4104(4) 0.0282(10) Uani 1 1 d . . .
O7 O 0.2920(4) -0.1359(3) 0.4205(3) 0.0391(10) Uani 1 1 d . . .
C19 C 0.2782(5) -0.1515(4) 0.3215(5) 0.0390(15) Uani 1 1 d . . .
H16 H 0.2937 -0.2257 0.3236 0.047 Uiso 1 1 calc R . .
H17 H 0.3283 -0.1081 0.2676 0.047 Uiso 1 1 calc R . .
C20 C 0.1698(5) -0.1238(5) 0.2909(5) 0.0376(15) Uani 1 1 d . . .
H18 H 0.1291 -0.1885 0.3070 0.045 Uiso 1 1 calc R . .
H19 H 0.1351 -0.0779 0.3321 0.045 Uiso 1 1 calc R . .
O8 O 0.1723(4) -0.0716(3) 0.1823(3) 0.0392(10) Uani 1 1 d . . .
N4 N 0.2050(4) 0.0328(4) 0.1628(4) 0.0293(11) Uani 1 1 d . . .
C21 C 0.2190(5) 0.0759(5) 0.0657(5) 0.0325(13) Uani 1 1 d . . .
H20 H 0.2118 0.0336 0.0203 0.039 Uiso 1 1 calc R . .
C22 C 0.2453(4) 0.1851(4) 0.0185(4) 0.0250(11) Uani 1 1 d . . .
C23 C 0.2418(4) 0.2625(4) 0.0735(4) 0.0194(10) Uani 1 1 d . . .
C24 C 0.2547(4) 0.3675(4) 0.0139(4) 0.0198(10) Uani 1 1 d . . .
C25 C 0.2780(4) 0.3957(5) -0.0914(4) 0.0258(12) Uani 1 1 d . . .
H21 H 0.2893 0.4669 -0.1283 0.031 Uiso 1 1 calc R . .
C26 C 0.2848(4) 0.3181(5) -0.1438(4) 0.0328(13) Uani 1 1 d . . .
H22 H 0.3013 0.3364 -0.2172 0.039 Uiso 1 1 calc R . .
C27 C 0.2679(4) 0.2156(5) -0.0906(4) 0.0322(13) Uani 1 1 d . . .
H23 H 0.2714 0.1640 -0.1279 0.039 Uiso 1 1 calc R . .
O9 O 0.2221(3) 0.2423(3) 0.1760(3) 0.0210(7) Uani 1 1 d . . .
O10 O 0.2409(3) 0.4372(3) 0.0747(3) 0.0224(8) Uani 1 1 d . . .
C28 C 0.2325(4) 0.5453(4) 0.0196(4) 0.0275(12) Uani 1 1 d . . .
H24 H 0.2996 0.5693 -0.0187 0.041 Uiso 1 1 calc R . .
H25 H 0.2116 0.5866 0.0692 0.041 Uiso 1 1 calc R . .
H26 H 0.1806 0.5540 -0.0294 0.041 Uiso 1 1 calc R . .
O11 O 0.3149(3) 0.5270(3) 0.2184(3) 0.0216(8) Uani 1 1 d . . .
O12 O 0.3544(3) 0.6029(3) 0.3378(3) 0.0194(7) Uani 1 1 d . . .
C29 C 0.3541(4) 0.5986(4) 0.2441(4) 0.0222(11) Uani 1 1 d . . .
C30 C 0.4054(5) 0.6865(5) 0.1585(4) 0.0344(14) Uani 1 1 d . . .
H27 H 0.4748 0.6637 0.1357 0.052 Uiso 1 1 calc R . .
H28 H 0.4107 0.7478 0.1848 0.052 Uiso 1 1 calc R . .
H29 H 0.3640 0.7049 0.0996 0.052 Uiso 1 1 calc R . .
O13 O 0.0879(3) 0.2638(3) 0.3559(3) 0.0247(8) Uani 1 1 d . . .
O14 O 0.1087(3) 0.0959(3) 0.3510(3) 0.0270(8) Uani 1 1 d . . .
C31 C 0.0568(4) 0.1707(4) 0.3731(4) 0.0260(12) Uani 1 1 d . . .
C32 C -0.0525(5) 0.1467(5) 0.4231(6) 0.0491(19) Uani 1 1 d . . .
H30 H -0.1011 0.1764 0.3720 0.074 Uiso 1 1 calc R . .
H31 H -0.0664 0.1773 0.4820 0.074 Uiso 1 1 calc R . .
H32 H -0.0608 0.0706 0.4478 0.074 Uiso 1 1 calc R . .
O15 O 0.4005(3) 0.0717(3) 0.1962(3) 0.0389(10) Uani 1 1 d . . .
O16 O 0.5233(3) 0.1698(4) 0.2173(4) 0.0484(12) Uani 1 1 d D . .
C33 C 0.4894(5) 0.1012(5) 0.1792(5) 0.0357(14) Uani 1 1 d . . .
C34 C 0.5671(5) 0.0516(6) 0.1126(5) 0.0477(17) Uani 1 1 d . . .
H33 H 0.5380 -0.0118 0.1041 0.072 Uiso 1 1 calc R . .
H34 H 0.6307 0.0334 0.1464 0.072 Uiso 1 1 calc R . .
H35 H 0.5829 0.1013 0.0441 0.072 Uiso 1 1 calc R . .
O17 O 0.4123(3) 0.3405(3) 0.2049(3) 0.0259(8) Uani 1 1 d . . .
H36 H 0.4303 0.2776 0.2120 0.039 Uiso 1 1 calc R . .
C35 C 0.4845(5) 0.4058(5) 0.1315(6) 0.0476(18) Uani 1 1 d . . .
H37 H 0.4484 0.4510 0.0753 0.071 Uiso 1 1 calc R . .
H38 H 0.5364 0.3625 0.1027 0.071 Uiso 1 1 calc R . .
H39 H 0.5187 0.4492 0.1658 0.071 Uiso 1 1 calc R . .
O18 O 0.7266(4) 0.2380(5) 0.1708(6) 0.0725(18) Uani 1 1 d D . .
H40 H 0.654(3) 0.212(8) 0.197(5) 0.109 Uiso 1 1 d D . .
H41 H 0.779(6) 0.180(6) 0.167(5) 0.109 Uiso 1 1 d D . .
O19 O 0.8692(5) 0.0726(4) 0.1245(5) 0.0702(17) Uani 1 1 d D . .
C36 C 0.9142(7) -0.0024(7) 0.2080(8) 0.071(2) Uani 1 1 d . A .
H42 H 0.9458 -0.0613 0.1825 0.085 Uiso 1 1 calc R . .
H43 H 0.9694 0.0313 0.2315 0.085 Uiso 1 1 calc R . .
C37 C 0.8381(7) -0.0410(7) 0.2926(8) 0.072(3) Uani 1 1 d . . .
H44 H 0.8028 0.0178 0.3141 0.109 Uiso 1 1 calc R A .
H45 H 0.8711 -0.0863 0.3510 0.109 Uiso 1 1 calc R . .
H46 H 0.7876 -0.0812 0.2714 0.109 Uiso 1 1 calc R . .
C38 C 0.936(3) 0.128(3) 0.0273(18) 0.059(7) Uani 0.47(3) 1 d P A 1
H47 H 0.8951 0.1488 -0.0331 0.071 Uiso 0.47(3) 1 calc PR A 1
H48 H 0.9948 0.0830 0.0116 0.071 Uiso 0.47(3) 1 calc PR A 1
C39 C 0.9728(12) 0.2232(12) 0.0528(17) 0.050(6) Uani 0.47(3) 1 d P A 1
H49 H 1.0182 0.2637 -0.0066 0.074 Uiso 0.47(3) 1 calc PR A 1
H50 H 1.0111 0.2008 0.1139 0.074 Uiso 0.47(3) 1 calc PR A 1
H51 H 0.9131 0.2667 0.0677 0.074 Uiso 0.47(3) 1 calc PR A 1
C40 C 0.958(2) 0.126(2) 0.066(2) 0.076(9) Uani 0.53(3) 1 d P A 2
H52 H 1.0047 0.0754 0.0399 0.091 Uiso 0.53(3) 1 calc PR A 2
H53 H 0.9956 0.1540 0.1123 0.091 Uiso 0.53(3) 1 calc PR A 2
C41 C 0.931(2) 0.2100(15) -0.020(2) 0.088(10) Uani 0.53(3) 1 d P A 2
H54 H 0.9939 0.2467 -0.0564 0.132 Uiso 0.53(3) 1 calc PR A 2
H55 H 0.8835 0.2590 0.0059 0.132 Uiso 0.53(3) 1 calc PR A 2
H56 H 0.8976 0.1817 -0.0677 0.132 Uiso 0.53(3) 1 calc PR A 2
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'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
O6 Dy1 O5 66.14(12)
O6 Dy1 O11 132.12(13)
O5 Dy1 O11 80.12(12)
O6 Dy1 O9 69.62(12)
O5 Dy1 O9 134.94(12)
O11 Dy1 O9 126.98(12)
O6 Dy1 O13 74.80(13)
O5 Dy1 O13 100.70(13)
O11 Dy1 O13 147.35(12)
O9 Dy1 O13 75.17(12)
O6 Dy1 O1 118.29(12)
O5 Dy1 O1 64.58(11)
O11 Dy1 O1 70.63(12)
O9 Dy1 O1 150.99(12)
O13 Dy1 O1 80.22(12)
O6 Dy1 O2 145.31(12)
O5 Dy1 O2 126.41(11)
O11 Dy1 O2 82.15(12)
O9 Dy1 O2 95.32(12)
O13 Dy1 O2 71.10(12)
O1 Dy1 O2 61.84(11)
O6 Dy1 O10 125.22(11)
O5 Dy1 O10 144.78(12)
O11 Dy1 O10 68.64(12)
O9 Dy1 O10 62.39(12)
O13 Dy1 O10 114.34(12)
O1 Dy1 O10 116.48(11)
O2 Dy1 O10 66.09(11)
O6 Dy1 Zn1 98.75(9)
O5 Dy1 Zn1 33.49(8)
O11 Dy1 Zn1 59.94(9)
O9 Dy1 Zn1 168.33(9)
O13 Dy1 Zn1 103.30(9)
O1 Dy1 Zn1 35.69(8)
O2 Dy1 Zn1 95.07(8)
O10 Dy1 Zn1 127.27(8)
O6 Dy1 Zn2 34.04(9)
O5 Dy1 Zn2 100.18(8)
O11 Dy1 Zn2 146.05(9)
O9 Dy1 Zn2 36.25(9)
O13 Dy1 Zn2 66.42(9)
O1 Dy1 Zn2 140.37(8)
O2 Dy1 Zn2 121.28(8)
O10 Dy1 Zn2 97.07(8)
Zn1 Dy1 Zn2 132.34(2)
O5 Zn1 O12 105.72(14)
O5 Zn1 O1 77.77(13)
O12 Zn1 O1 97.91(14)
O5 Zn1 N1 146.32(16)
O12 Zn1 N1 105.94(16)
O1 Zn1 N1 86.80(15)
O5 Zn1 N2 86.19(16)
O12 Zn1 N2 108.62(16)
O1 Zn1 N2 151.93(16)
N1 Zn1 N2 94.38(16)
O5 Zn1 Dy1 40.68(10)
O12 Zn1 Dy1 88.59(10)
O1 Zn1 Dy1 43.02(9)
N1 Zn1 Dy1 129.63(12)
N2 Zn1 Dy1 126.79(12)
O6 Zn2 O14 89.68(15)
O6 Zn2 O15 102.89(16)
O14 Zn2 O15 167.07(16)
O6 Zn2 O9 80.94(14)
O14 Zn2 O9 87.85(14)
O15 Zn2 O9 97.02(16)
O6 Zn2 N4 164.45(16)
O14 Zn2 N4 89.22(16)
O15 Zn2 N4 79.48(18)
O9 Zn2 N4 83.52(16)
O6 Zn2 N3 85.34(16)
O14 Zn2 N3 90.10(17)
O15 Zn2 N3 87.94(17)
O9 Zn2 N3 166.14(15)
N4 Zn2 N3 110.17(18)
O6 Zn2 Dy1 40.23(10)
O14 Zn2 Dy1 82.02(10)
O15 Zn2 Dy1 109.53(13)
O9 Zn2 Dy1 41.54(9)
N4 Zn2 Dy1 124.34(13)
N3 Zn2 Dy1 124.60(12)
C6 C1 C2 119.5(5)
C6 C1 C8 117.9(4)
C2 C1 C8 122.5(5)
O1 C2 C3 118.4(4)
O1 C2 C1 124.4(4)
C3 C2 C1 117.2(4)
C4 C3 O2 125.0(5)
C4 C3 C2 122.4(5)
O2 C3 C2 112.6(4)
C3 C4 C5 119.6(5)
C3 C4 H1 120.2
C5 C4 H1 120.2
C6 C5 C4 120.1(5)
C6 C5 H2 120.0
C4 C5 H2 120.0
C5 C6 C1 121.2(5)
C5 C6 H3 119.4
C1 C6 H3 119.4
C2 O1 Zn1 123.8(3)
C2 O1 Dy1 127.4(3)
Zn1 O1 Dy1 101.29(13)
C3 O2 C7 115.7(4)
C3 O2 Dy1 119.4(3)
C7 O2 Dy1 121.7(3)
O2 C7 H4 109.5
O2 C7 H5 109.5
H4 C7 H5 109.5
O2 C7 H6 109.5
H4 C7 H6 109.5
H5 C7 H6 109.5
N1 C8 C1 124.7(5)
N1 C8 H7 117.6
C1 C8 H7 117.6
C8 N1 O3 111.4(4)
C8 N1 Zn1 127.0(3)
O3 N1 Zn1 120.5(3)
N1 O3 C9 111.2(4)
O3 C9 C10 115.3(4)
O3 C9 H8 108.5
C10 C9 H8 108.5
O3 C9 H9 108.5
C10 C9 H9 108.5
H8 C9 H9 107.5
O4 C10 C9 112.4(4)
O4 C10 H10 109.1
C9 C10 H10 109.1
O4 C10 H11 109.1
C9 C10 H11 109.1
H10 C10 H11 107.9
N2 O4 C10 110.9(4)
C11 N2 O4 109.7(4)
C11 N2 Zn1 126.5(4)
O4 N2 Zn1 123.7(3)
N2 C11 C12 125.6(5)
N2 C11 H12 117.2
C12 C11 H12 117.2
C13 C12 C17 117.9(5)
C13 C12 C11 123.5(5)
C17 C12 C11 118.5(5)
O5 C13 C12 123.8(5)
O5 C13 C14 115.3(4)
C12 C13 C14 120.9(5)
O6 C14 C15 125.0(5)
O6 C14 C13 115.5(4)
C15 C14 C13 119.5(5)
C16 C15 C14 118.6(5)
C16 C15 C18 117.6(5)
C14 C15 C18 123.8(5)
C17 C16 C15 121.6(5)
C17 C16 H13 119.2
C15 C16 H13 119.2
C16 C17 C12 121.2(5)
C16 C17 H14 119.4
C12 C17 H14 119.4
C13 O5 Zn1 129.8(3)
C13 O5 Dy1 121.1(3)
Zn1 O5 Dy1 105.83(14)
C14 O6 Zn2 132.3(3)
C14 O6 Dy1 121.7(3)
Zn2 O6 Dy1 105.73(15)
N3 C18 C15 125.8(5)
N3 C18 H15 117.1
C15 C18 H15 117.1
C18 N3 O7 108.6(4)
C18 N3 Zn2 127.2(4)
O7 N3 Zn2 124.2(4)
N3 O7 C19 109.9(4)
O7 C19 C20 113.2(5)
O7 C19 H16 108.9
C20 C19 H16 108.9
O7 C19 H17 108.9
C20 C19 H17 108.9
H16 C19 H17 107.8
O8 C20 C19 111.0(5)
O8 C20 H18 109.4
C19 C20 H18 109.4
O8 C20 H19 109.4
C19 C20 H19 109.4
H18 C20 H19 108.0
N4 O8 C20 110.1(4)
C21 N4 O8 110.5(5)
C21 N4 Zn2 123.4(4)
O8 N4 Zn2 124.5(4)
N4 C21 C22 125.1(5)
N4 C21 H20 117.5
C22 C21 H20 117.5
C27 C22 C23 118.9(5)
C27 C22 C21 116.5(5)
C23 C22 C21 124.5(5)
O9 C23 C24 118.9(4)
O9 C23 C22 123.8(5)
C24 C23 C22 117.2(4)
C25 C24 O10 124.5(5)
C25 C24 C23 123.2(5)
O10 C24 C23 112.3(4)
C24 C25 C26 118.7(5)
C24 C25 H21 120.6
C26 C25 H21 120.6
C27 C26 C25 120.6(5)
C27 C26 H22 119.7
C25 C26 H22 119.7
C26 C27 C22 121.3(5)
C26 C27 H23 119.3
C22 C27 H23 119.3
C23 O9 Zn2 123.2(3)
C23 O9 Dy1 125.9(3)
Zn2 O9 Dy1 102.21(14)
C24 O10 C28 115.8(4)
C24 O10 Dy1 117.9(3)
C28 O10 Dy1 126.3(3)
O10 C28 H24 109.5
O10 C28 H25 109.5
H24 C28 H25 109.5
O10 C28 H26 109.5
H24 C28 H26 109.5
H25 C28 H26 109.5
C29 O11 Dy1 146.4(3)
C29 O12 Zn1 120.0(3)
O11 C29 O12 124.5(5)
O11 C29 C30 117.9(5)
O12 C29 C30 117.6(5)
C29 C30 H27 109.5
C29 C30 H28 109.5
H27 C30 H28 109.5
C29 C30 H29 109.5
H27 C30 H29 109.5
H28 C30 H29 109.5
C31 O13 Dy1 137.9(3)
C31 O14 Zn2 127.8(4)
O14 C31 O13 125.8(5)
O14 C31 C32 116.2(5)
O13 C31 C32 118.0(5)
C31 C32 H30 109.5
C31 C32 H31 109.5
H30 C32 H31 109.5
C31 C32 H32 109.5
H30 C32 H32 109.5
H31 C32 H32 109.5
C33 O15 Zn2 140.1(4)
O15 C33 O16 123.9(6)
O15 C33 C34 119.0(6)
O16 C33 C34 117.0(6)
C33 C34 H33 109.5
C33 C34 H34 109.5
H33 C34 H34 109.5
C33 C34 H35 109.5
H33 C34 H35 109.5
H34 C34 H35 109.5
C35 O17 H36 109.5
O17 C35 H37 109.5
O17 C35 H38 109.5
H37 C35 H38 109.5
O17 C35 H39 109.5
H37 C35 H39 109.5
H38 C35 H39 109.5
H40 O18 H41 113(8)
C40 O19 C36 101.6(15)
C40 O19 C38 24.3(14)
C36 O19 C38 120.6(13)
C37 C36 O19 110.7(8)
C37 C36 H42 109.5
O19 C36 H42 109.5
C37 C36 H43 109.5
O19 C36 H43 109.5
H42 C36 H43 108.1
C36 C37 H44 109.5
C36 C37 H45 109.5
H44 C37 H45 109.5
C36 C37 H46 109.5
H44 C37 H46 109.5
H45 C37 H46 109.5
O19 C38 C39 104.0(17)
O19 C38 H47 111.0
C39 C38 H47 111.0
O19 C38 H48 111.0
C39 C38 H48 111.0
H47 C38 H48 109.0
C38 C39 H49 109.5
C38 C39 H50 109.5
H49 C39 H50 109.5
C38 C39 H51 109.5
H49 C39 H51 109.5
H50 C39 H51 109.5
O19 C40 C41 112(3)
O19 C40 H52 109.3
C41 C40 H52 109.3
O19 C40 H53 109.3
C41 C40 H53 109.3
H52 C40 H53 107.9
C40 C41 H54 109.5
C40 C41 H55 109.5
H54 C41 H55 109.5
C40 C41 H56 109.5
H54 C41 H56 109.5
H55 C41 H56 109.5
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
Dy1 O6 2.336(3)
Dy1 O5 2.343(3)
Dy1 O11 2.361(4)
Dy1 O9 2.363(3)
Dy1 O13 2.363(4)
Dy1 O1 2.406(3)
Dy1 O2 2.607(4)
Dy1 O10 2.608(4)
Dy1 Zn1 3.4583(13)
Dy1 Zn2 3.4822(18)
Zn1 O5 1.983(3)
Zn1 O12 1.989(3)
Zn1 O1 2.058(3)
Zn1 N1 2.075(4)
Zn1 N2 2.118(4)
Zn2 O6 2.025(3)
Zn2 O14 2.084(4)
Zn2 O15 2.094(4)
Zn2 O9 2.107(4)
Zn2 N4 2.181(5)
Zn2 N3 2.190(5)
C1 C6 1.408(7)
C1 C2 1.419(7)
C1 C8 1.453(7)
C2 O1 1.312(6)
C2 C3 1.415(7)
C3 C4 1.366(7)
C3 O2 1.402(6)
C4 C5 1.400(8)
C4 H1 0.9500
C5 C6 1.368(8)
C5 H2 0.9500
C6 H3 0.9500
O2 C7 1.440(6)
C7 H4 0.9800
C7 H5 0.9800
C7 H6 0.9800
C8 N1 1.279(7)
C8 H7 0.9500
N1 O3 1.427(5)
O3 C9 1.432(6)
C9 C10 1.515(7)
C9 H8 0.9900
C9 H9 0.9900
C10 O4 1.427(7)
C10 H10 0.9900
C10 H11 0.9900
O4 N2 1.424(6)
N2 C11 1.292(7)
C11 C12 1.433(8)
C11 H12 0.9500
C12 C13 1.403(7)
C12 C17 1.418(8)
C13 O5 1.326(6)
C13 C14 1.422(7)
C14 O6 1.314(6)
C14 C15 1.408(7)
C15 C16 1.407(8)
C15 C18 1.457(8)
C16 C17 1.367(9)
C16 H13 0.9500
C17 H14 0.9500
C18 N3 1.276(8)
C18 H15 0.9500
N3 O7 1.419(6)
O7 C19 1.434(8)
C19 C20 1.517(10)
C19 H16 0.9900
C19 H17 0.9900
C20 O8 1.433(8)
C20 H18 0.9900
C20 H19 0.9900
O8 N4 1.415(6)
N4 C21 1.270(8)
C21 C22 1.455(8)
C21 H20 0.9500
C22 C27 1.409(8)
C22 C23 1.417(7)
C23 O9 1.325(6)
C23 C24 1.413(7)
C24 C25 1.363(7)
C24 O10 1.385(6)
C25 C26 1.393(8)
C25 H21 0.9500
C26 C27 1.369(9)
C26 H22 0.9500
C27 H23 0.9500
O10 C28 1.429(6)
C28 H24 0.9800
C28 H25 0.9800
C28 H26 0.9800
O11 C29 1.246(6)
O12 C29 1.277(6)
C29 C30 1.514(7)
C30 H27 0.9800
C30 H28 0.9800
C30 H29 0.9800
O13 C31 1.271(6)
O14 C31 1.257(6)
C31 C32 1.509(8)
C32 H30 0.9800
C32 H31 0.9800
C32 H32 0.9800
O15 C33 1.216(7)
O16 C33 1.279(8)
C33 C34 1.517(8)
C34 H33 0.9800
C34 H34 0.9800
C34 H35 0.9800
O17 C35 1.415(7)
O17 H36 0.8400
C35 H37 0.9800
C35 H38 0.9800
C35 H39 0.9800
O18 H40 1.006(10)
O18 H41 1.010(10)
O19 C40 1.42(3)
O19 C36 1.443(11)
O19 C38 1.51(3)
C36 C37 1.415(12)
C36 H42 0.9900
C36 H43 0.9900
C37 H44 0.9800
C37 H45 0.9800
C37 H46 0.9800
C38 C39 1.51(4)
C38 H47 0.9900
C38 H48 0.9900
C39 H49 0.9800
C39 H50 0.9800
C39 H51 0.9800
C40 C41 1.44(5)
C40 H52 0.9900
C40 H53 0.9900
C41 H54 0.9800
C41 H55 0.9800
C41 H56 0.9800
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
O6 Dy1 Zn1 O5 12.99(18)
O11 Dy1 Zn1 O5 -121.03(18)
O9 Dy1 Zn1 O5 8.3(4)
O13 Dy1 Zn1 O5 89.33(18)
O1 Dy1 Zn1 O5 140.4(2)
O2 Dy1 Zn1 O5 161.08(17)
O10 Dy1 Zn1 O5 -135.26(18)
Zn2 Dy1 Zn1 O5 19.26(15)
O6 Dy1 Zn1 O12 129.39(13)
O5 Dy1 Zn1 O12 116.39(18)
O11 Dy1 Zn1 O12 -4.63(14)
O9 Dy1 Zn1 O12 124.7(4)
O13 Dy1 Zn1 O12 -154.27(13)
O1 Dy1 Zn1 O12 -103.19(17)
O2 Dy1 Zn1 O12 -82.52(13)
O10 Dy1 Zn1 O12 -18.87(14)
Zn2 Dy1 Zn1 O12 135.65(10)
O6 Dy1 Zn1 O1 -127.42(17)
O5 Dy1 Zn1 O1 -140.4(2)
O11 Dy1 Zn1 O1 98.56(17)
O9 Dy1 Zn1 O1 -132.1(4)
O13 Dy1 Zn1 O1 -51.08(17)
O2 Dy1 Zn1 O1 20.67(16)
O10 Dy1 Zn1 O1 84.33(17)
Zn2 Dy1 Zn1 O1 -121.15(14)
O6 Dy1 Zn1 N1 -120.97(18)
O5 Dy1 Zn1 N1 -134.0(2)
O11 Dy1 Zn1 N1 105.02(18)
O9 Dy1 Zn1 N1 -125.7(4)
O13 Dy1 Zn1 N1 -44.62(18)
O1 Dy1 Zn1 N1 6.5(2)
O2 Dy1 Zn1 N1 27.13(18)
O10 Dy1 Zn1 N1 90.78(18)
Zn2 Dy1 Zn1 N1 -114.70(16)
O6 Dy1 Zn1 N2 17.02(17)
O5 Dy1 Zn1 N2 4.0(2)
O11 Dy1 Zn1 N2 -116.99(18)
O9 Dy1 Zn1 N2 12.3(4)
O13 Dy1 Zn1 N2 93.37(17)
O1 Dy1 Zn1 N2 144.4(2)
O2 Dy1 Zn1 N2 165.11(17)
O10 Dy1 Zn1 N2 -131.23(18)
Zn2 Dy1 Zn1 N2 23.29(15)
O5 Dy1 Zn2 O6 -0.46(18)
O11 Dy1 Zn2 O6 86.9(2)
O9 Dy1 Zn2 O6 165.2(2)
O13 Dy1 Zn2 O6 -97.78(19)
O1 Dy1 Zn2 O6 -62.6(2)
O2 Dy1 Zn2 O6 -145.03(18)
O10 Dy1 Zn2 O6 148.71(18)
Zn1 Dy1 Zn2 O6 -11.11(16)
O6 Dy1 Zn2 O14 99.04(19)
O5 Dy1 Zn2 O14 98.58(14)
O11 Dy1 Zn2 O14 -174.03(19)
O9 Dy1 Zn2 O14 -95.81(18)
O13 Dy1 Zn2 O14 1.26(15)
O1 Dy1 Zn2 O14 36.41(17)
O2 Dy1 Zn2 O14 -45.99(15)
O10 Dy1 Zn2 O14 -112.26(14)
Zn1 Dy1 Zn2 O14 87.93(12)
O6 Dy1 Zn2 O15 -87.0(2)
O5 Dy1 Zn2 O15 -87.43(16)
O11 Dy1 Zn2 O15 0.0(2)
O9 Dy1 Zn2 O15 78.2(2)
O13 Dy1 Zn2 O15 175.26(16)
O1 Dy1 Zn2 O15 -149.59(18)
O2 Dy1 Zn2 O15 128.01(16)
O10 Dy1 Zn2 O15 61.74(15)
Zn1 Dy1 Zn2 O15 -98.08(14)
O6 Dy1 Zn2 O9 -165.2(2)
O5 Dy1 Zn2 O9 -165.61(17)
O11 Dy1 Zn2 O9 -78.2(2)
O13 Dy1 Zn2 O9 97.07(18)
O1 Dy1 Zn2 O9 132.22(19)
O2 Dy1 Zn2 O9 49.82(17)
O10 Dy1 Zn2 O9 -16.44(16)
Zn1 Dy1 Zn2 O9 -176.26(14)
O6 Dy1 Zn2 N4 -177.4(2)
O5 Dy1 Zn2 N4 -177.87(17)
O11 Dy1 Zn2 N4 -90.5(2)
O9 Dy1 Zn2 N4 -12.3(2)
O13 Dy1 Zn2 N4 84.81(18)
O1 Dy1 Zn2 N4 119.96(19)
O2 Dy1 Zn2 N4 37.56(18)
O10 Dy1 Zn2 N4 -28.71(17)
Zn1 Dy1 Zn2 N4 171.47(15)
O6 Dy1 Zn2 N3 14.5(2)
O5 Dy1 Zn2 N3 14.01(17)
O11 Dy1 Zn2 N3 101.4(2)
O9 Dy1 Zn2 N3 179.6(2)
O13 Dy1 Zn2 N3 -83.31(18)
O1 Dy1 Zn2 N3 -48.2(2)
O2 Dy1 Zn2 N3 -130.56(18)
O10 Dy1 Zn2 N3 163.17(17)
Zn1 Dy1 Zn2 N3 3.35(16)
C6 C1 C2 O1 -175.0(5)
C8 C1 C2 O1 0.1(8)
C6 C1 C2 C3 1.9(7)
C8 C1 C2 C3 177.0(5)
O1 C2 C3 C4 177.0(5)
C1 C2 C3 C4 0.0(7)
O1 C2 C3 O2 -2.0(6)
C1 C2 C3 O2 -179.1(4)
O2 C3 C4 C5 178.0(5)
C2 C3 C4 C5 -1.0(8)
C3 C4 C5 C6 0.0(9)
C4 C5 C6 C1 1.9(8)
C2 C1 C6 C5 -2.9(8)
C8 C1 C6 C5 -178.2(5)
C3 C2 O1 Zn1 151.3(4)
C1 C2 O1 Zn1 -31.8(6)
C3 C2 O1 Dy1 7.5(6)
C1 C2 O1 Dy1 -175.6(3)
O5 Zn1 O1 C2 -176.6(4)
O12 Zn1 O1 C2 -72.1(4)
N1 Zn1 O1 C2 33.5(4)
N2 Zn1 O1 C2 126.9(4)
Dy1 Zn1 O1 C2 -151.4(4)
O5 Zn1 O1 Dy1 -25.15(13)
O12 Zn1 O1 Dy1 79.32(15)
N1 Zn1 O1 Dy1 -175.02(16)
N2 Zn1 O1 Dy1 -81.7(3)
O6 Dy1 O1 C2 -146.9(4)
O5 Dy1 O1 C2 172.9(4)
O11 Dy1 O1 C2 84.9(4)
O9 Dy1 O1 C2 -48.0(5)
O13 Dy1 O1 C2 -80.2(4)
O2 Dy1 O1 C2 -6.5(4)
O10 Dy1 O1 C2 32.2(4)
Zn1 Dy1 O1 C2 150.0(4)
Zn2 Dy1 O1 C2 -112.6(4)
O6 Dy1 O1 Zn1 63.06(17)
O5 Dy1 O1 Zn1 22.91(12)
O11 Dy1 O1 Zn1 -65.12(14)
O9 Dy1 O1 Zn1 161.98(18)
O13 Dy1 O1 Zn1 129.80(15)
O2 Dy1 O1 Zn1 -156.50(18)
O10 Dy1 O1 Zn1 -117.78(13)
Zn2 Dy1 O1 Zn1 97.43(14)
C4 C3 O2 C7 -22.1(7)
C2 C3 O2 C7 156.9(5)
C4 C3 O2 Dy1 177.6(4)
C2 C3 O2 Dy1 -3.4(5)
O6 Dy1 O2 C3 104.6(4)
O5 Dy1 O2 C3 4.1(4)
O11 Dy1 O2 C3 -67.4(3)
O9 Dy1 O2 C3 165.9(3)
O13 Dy1 O2 C3 93.6(3)
O1 Dy1 O2 C3 4.8(3)
O10 Dy1 O2 C3 -137.5(4)
Zn1 Dy1 O2 C3 -8.7(3)
Zn2 Dy1 O2 C3 138.9(3)
O6 Dy1 O2 C7 -54.4(4)
O5 Dy1 O2 C7 -154.9(3)
O11 Dy1 O2 C7 133.6(4)
O9 Dy1 O2 C7 6.9(4)
O13 Dy1 O2 C7 -65.4(4)
O1 Dy1 O2 C7 -154.2(4)
O10 Dy1 O2 C7 63.5(4)
Zn1 Dy1 O2 C7 -167.7(4)
Zn2 Dy1 O2 C7 -20.1(4)
C6 C1 C8 N1 -163.8(5)
C2 C1 C8 N1 21.1(8)
C1 C8 N1 O3 -175.0(4)
C1 C8 N1 Zn1 -7.0(8)
O5 Zn1 N1 C8 -77.2(5)
O12 Zn1 N1 C8 82.3(5)
O1 Zn1 N1 C8 -15.0(4)
N2 Zn1 N1 C8 -166.9(5)
Dy1 Zn1 N1 C8 -19.4(5)
O5 Zn1 N1 O3 89.8(4)
O12 Zn1 N1 O3 -110.7(3)
O1 Zn1 N1 O3 152.0(3)
N2 Zn1 N1 O3 0.1(3)
Dy1 Zn1 N1 O3 147.6(3)
C8 N1 O3 C9 -116.9(5)
Zn1 N1 O3 C9 74.3(4)
N1 O3 C9 C10 -59.9(6)
O3 C9 C10 O4 -52.5(6)
C9 C10 O4 N2 92.3(5)
C10 O4 N2 C11 175.0(4)
C10 O4 N2 Zn1 -8.2(5)
O5 Zn1 N2 C11 -14.8(4)
O12 Zn1 N2 C11 -120.2(4)
O1 Zn1 N2 C11 40.0(6)
N1 Zn1 N2 C11 131.4(4)
Dy1 Zn1 N2 C11 -17.5(5)
O5 Zn1 N2 O4 168.9(4)
O12 Zn1 N2 O4 63.6(4)
O1 Zn1 N2 O4 -136.3(3)
N1 Zn1 N2 O4 -44.9(4)
Dy1 Zn1 N2 O4 166.3(3)
O4 N2 C11 C12 179.4(4)
Zn1 N2 C11 C12 2.7(7)
N2 C11 C12 C13 9.6(8)
N2 C11 C12 C17 -171.6(5)
C17 C12 C13 O5 -179.8(5)
C11 C12 C13 O5 -1.1(8)
C17 C12 C13 C14 -0.6(7)
C11 C12 C13 C14 178.2(5)
O5 C13 C14 O6 1.1(6)
C12 C13 C14 O6 -178.2(4)
O5 C13 C14 C15 -176.3(4)
C12 C13 C14 C15 4.4(7)
O6 C14 C15 C16 177.1(5)
C13 C14 C15 C16 -5.7(8)
O6 C14 C15 C18 -4.9(8)
C13 C14 C15 C18 172.2(5)
C14 C15 C16 C17 3.4(9)
C18 C15 C16 C17 -174.7(6)
C15 C16 C17 C12 0.5(9)
C13 C12 C17 C16 -1.9(8)
C11 C12 C17 C16 179.3(5)
C12 C13 O5 Zn1 -20.6(7)
C14 C13 O5 Zn1 160.1(3)
C12 C13 O5 Dy1 -177.2(3)
C14 C13 O5 Dy1 3.5(5)
O12 Zn1 O5 C13 132.2(4)
O1 Zn1 O5 C13 -132.9(4)
N1 Zn1 O5 C13 -68.3(5)
N2 Zn1 O5 C13 23.9(4)
Dy1 Zn1 O5 C13 -159.4(5)
O12 Zn1 O5 Dy1 -68.48(17)
O1 Zn1 O5 Dy1 26.41(14)
N1 Zn1 O5 Dy1 91.1(3)
N2 Zn1 O5 Dy1 -176.76(17)
O6 Dy1 O5 C13 -4.4(3)
O11 Dy1 O5 C13 -149.6(3)
O9 Dy1 O5 C13 -16.1(4)
O13 Dy1 O5 C13 63.6(3)
O1 Dy1 O5 C13 137.3(4)
O2 Dy1 O5 C13 137.9(3)
O10 Dy1 O5 C13 -122.2(3)
Zn1 Dy1 O5 C13 161.6(4)
Zn2 Dy1 O5 C13 -4.1(3)
O6 Dy1 O5 Zn1 -165.94(19)
O11 Dy1 O5 Zn1 48.84(15)
O9 Dy1 O5 Zn1 -177.64(13)
O13 Dy1 O5 Zn1 -97.98(16)
O1 Dy1 O5 Zn1 -24.31(13)
O2 Dy1 O5 Zn1 -23.7(2)
O10 Dy1 O5 Zn1 76.2(2)
Zn2 Dy1 O5 Zn1 -165.66(11)
C15 C14 O6 Zn2 -0.8(8)
C13 C14 O6 Zn2 -178.0(3)
C15 C14 O6 Dy1 171.9(4)
C13 C14 O6 Dy1 -5.3(6)
O14 Zn2 O6 C14 95.6(4)
O15 Zn2 O6 C14 -81.3(4)
O9 Zn2 O6 C14 -176.5(4)
N4 Zn2 O6 C14 -178.4(5)
N3 Zn2 O6 C14 5.5(4)
Dy1 Zn2 O6 C14 173.6(5)
O14 Zn2 O6 Dy1 -77.97(16)
O15 Zn2 O6 Dy1 105.10(17)
O9 Zn2 O6 Dy1 9.91(14)
N4 Zn2 O6 Dy1 8.0(7)
N3 Zn2 O6 Dy1 -168.10(18)
O5 Dy1 O6 C14 5.1(3)
O11 Dy1 O6 C14 54.3(4)
O9 Dy1 O6 C14 176.3(4)
O13 Dy1 O6 C14 -104.2(4)
O1 Dy1 O6 C14 -34.5(4)
O2 Dy1 O6 C14 -115.0(4)
O10 Dy1 O6 C14 146.5(3)
Zn1 Dy1 O6 C14 -2.7(4)
Zn2 Dy1 O6 C14 -174.4(4)
O5 Dy1 O6 Zn2 179.51(19)
O11 Dy1 O6 Zn2 -131.25(15)
O9 Dy1 O6 Zn2 -9.30(13)
O13 Dy1 O6 Zn2 70.21(16)
O1 Dy1 O6 Zn2 139.96(13)
O2 Dy1 O6 Zn2 59.4(3)
O10 Dy1 O6 Zn2 -39.1(2)
Zn1 Dy1 O6 Zn2 171.71(12)
C16 C15 C18 N3 -180.0(6)
C14 C15 C18 N3 2.0(9)
C15 C18 N3 O7 -176.9(5)
C15 C18 N3 Zn2 5.7(9)
O6 Zn2 N3 C18 -7.7(5)
O14 Zn2 N3 C18 -97.4(5)
O15 Zn2 N3 C18 95.4(5)
O9 Zn2 N3 C18 -16.0(10)
N4 Zn2 N3 C18 173.4(5)
Dy1 Zn2 N3 C18 -17.0(5)
O6 Zn2 N3 O7 175.2(4)
O14 Zn2 N3 O7 85.5(4)
O15 Zn2 N3 O7 -81.7(4)
O9 Zn2 N3 O7 167.0(5)
N4 Zn2 N3 O7 -3.7(4)
Dy1 Zn2 N3 O7 165.9(3)
C18 N3 O7 C19 -159.8(5)
Zn2 N3 O7 C19 17.7(6)
N3 O7 C19 C20 -77.7(6)
O7 C19 C20 O8 140.2(5)
C19 C20 O8 N4 -74.8(6)
C20 O8 N4 C21 172.4(5)
C20 O8 N4 Zn2 6.3(6)
O6 Zn2 N4 C21 37.9(9)
O14 Zn2 N4 C21 123.9(5)
O15 Zn2 N4 C21 -62.5(5)
O9 Zn2 N4 C21 36.0(5)
N3 Zn2 N4 C21 -146.3(5)
Dy1 Zn2 N4 C21 44.1(5)
O6 Zn2 N4 O8 -157.7(5)
O14 Zn2 N4 O8 -71.7(4)
O15 Zn2 N4 O8 102.0(4)
O9 Zn2 N4 O8 -159.6(4)
N3 Zn2 N4 O8 18.1(4)
Dy1 Zn2 N4 O8 -151.5(3)
O8 N4 C21 C22 175.2(5)
Zn2 N4 C21 C22 -18.4(8)
N4 C21 C22 C27 173.8(6)
N4 C21 C22 C23 -11.2(9)
C27 C22 C23 O9 -179.5(5)
C21 C22 C23 O9 5.7(8)
C27 C22 C23 C24 4.0(7)
C21 C22 C23 C24 -170.8(5)
O9 C23 C24 C25 178.1(5)
C22 C23 C24 C25 -5.2(7)
O9 C23 C24 O10 -2.0(6)
C22 C23 C24 O10 174.7(4)
O10 C24 C25 C26 -176.9(5)
C23 C24 C25 C26 3.0(8)
C24 C25 C26 C27 0.4(8)
C25 C26 C27 C22 -1.3(9)
C23 C22 C27 C26 -1.0(8)
C21 C22 C27 C26 174.3(5)
C24 C23 O9 Zn2 -154.2(3)
C22 C23 O9 Zn2 29.4(6)
C24 C23 O9 Dy1 -12.4(6)
C22 C23 O9 Dy1 171.2(4)
O6 Zn2 O9 C23 139.5(4)
O14 Zn2 O9 C23 -130.4(4)
O15 Zn2 O9 C23 37.5(4)
N4 Zn2 O9 C23 -41.0(4)
N3 Zn2 O9 C23 147.9(6)
Dy1 Zn2 O9 C23 149.2(4)
O6 Zn2 O9 Dy1 -9.65(14)
O14 Zn2 O9 Dy1 80.37(15)
O15 Zn2 O9 Dy1 -111.65(16)
N4 Zn2 O9 Dy1 169.83(17)
N3 Zn2 O9 Dy1 -1.3(7)
O6 Dy1 O9 C23 -139.2(4)
O5 Dy1 O9 C23 -127.8(4)
O11 Dy1 O9 C23 -11.2(4)
O13 Dy1 O9 C23 141.8(4)
O1 Dy1 O9 C23 108.9(4)
O2 Dy1 O9 C23 73.0(4)
O10 Dy1 O9 C23 13.5(3)
Zn1 Dy1 O9 C23 -134.2(4)
Zn2 Dy1 O9 C23 -148.0(4)
O6 Dy1 O9 Zn2 8.80(13)
O5 Dy1 O9 Zn2 20.2(2)
O11 Dy1 O9 Zn2 136.81(14)
O13 Dy1 O9 Zn2 -70.19(15)
O1 Dy1 O9 Zn2 -103.1(2)
O2 Dy1 O9 Zn2 -139.02(14)
O10 Dy1 O9 Zn2 161.52(18)
Zn1 Dy1 O9 Zn2 13.8(5)
C25 C24 O10 C28 11.7(7)
C23 C24 O10 C28 -168.2(4)
C25 C24 O10 Dy1 -167.0(4)
C23 C24 O10 Dy1 13.1(5)
O6 Dy1 O10 C24 18.2(4)
O5 Dy1 O10 C24 116.3(3)
O11 Dy1 O10 C24 145.4(3)
O9 Dy1 O10 C24 -13.6(3)
O13 Dy1 O10 C24 -70.0(3)
O1 Dy1 O10 C24 -160.9(3)
O2 Dy1 O10 C24 -123.9(3)
Zn1 Dy1 O10 C24 158.6(3)
Zn2 Dy1 O10 C24 -2.7(3)
O6 Dy1 O10 C28 -160.4(4)
O5 Dy1 O10 C28 -62.2(4)
O11 Dy1 O10 C28 -33.1(4)
O9 Dy1 O10 C28 167.9(4)
O13 Dy1 O10 C28 111.5(4)
O1 Dy1 O10 C28 20.5(4)
O2 Dy1 O10 C28 57.6(4)
Zn1 Dy1 O10 C28 -19.9(4)
Zn2 Dy1 O10 C28 178.8(4)
O6 Dy1 O11 C29 -64.7(6)
O5 Dy1 O11 C29 -20.0(6)
O9 Dy1 O11 C29 -160.0(5)
O13 Dy1 O11 C29 74.4(6)
O1 Dy1 O11 C29 46.4(6)
O2 Dy1 O11 C29 109.2(6)
O10 Dy1 O11 C29 176.5(6)
Zn1 Dy1 O11 C29 8.7(5)
Zn2 Dy1 O11 C29 -113.6(6)
O5 Zn1 O12 C29 42.9(4)
O1 Zn1 O12 C29 -36.6(4)
N1 Zn1 O12 C29 -125.5(4)
N2 Zn1 O12 C29 134.1(4)
Dy1 Zn1 O12 C29 5.5(3)
Dy1 O11 C29 O12 -7.4(9)
Dy1 O11 C29 C30 172.3(4)
Zn1 O12 C29 O11 -2.8(7)
Zn1 O12 C29 C30 177.5(4)
O6 Dy1 O13 C31 -38.0(5)
O5 Dy1 O13 C31 -99.4(5)
O11 Dy1 O13 C31 172.2(5)
O9 Dy1 O13 C31 34.5(5)
O1 Dy1 O13 C31 -161.0(5)
O2 Dy1 O13 C31 135.5(5)
O10 Dy1 O13 C31 84.2(5)
Zn1 Dy1 O13 C31 -133.6(5)
Zn2 Dy1 O13 C31 -2.9(5)
O6 Zn2 O14 C31 38.7(5)
O15 Zn2 O14 C31 -154.8(7)
O9 Zn2 O14 C31 -42.2(5)
N4 Zn2 O14 C31 -125.8(5)
N3 Zn2 O14 C31 124.0(5)
Dy1 Zn2 O14 C31 -0.9(5)
Zn2 O14 C31 O13 -0.7(9)
Zn2 O14 C31 C32 178.4(4)
Dy1 O13 C31 O14 3.4(9)
Dy1 O13 C31 C32 -175.6(4)
O6 Zn2 O15 C33 -6.3(7)
O14 Zn2 O15 C33 -172.5(7)
O9 Zn2 O15 C33 75.9(7)
N4 Zn2 O15 C33 158.0(7)
N3 Zn2 O15 C33 -91.1(7)
Dy1 Zn2 O15 C33 35.1(7)
Zn2 O15 C33 O16 0.6(10)
Zn2 O15 C33 C34 177.9(5)
C40 O19 C36 C37 161.3(12)
C38 O19 C36 C37 177.5(14)
C40 O19 C38 C39 -46(4)
C36 O19 C38 C39 -88(2)
C36 O19 C40 C41 -176.8(18)
C38 O19 C40 C41 39(5)
