#------------------------------------------------------------------------------
#$Date: 2016-03-26 02:58:40 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180163 $
#$URL: svn://www.crystallography.net/cod/cif/7/10/59/7105981.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_7105981
loop_
_publ_author_name
'Peter Roesky'
'Asamanjoy Bhunia'
'Yanhua Lan'
'Annie Powell'
'Sven Kureti'
_publ_section_title
;
 Salen-based metal–organic frameworks of nickel and the lanthanides
;
_journal_name_full               Chem.Commun.
_journal_page_first              2035
_journal_paper_doi               10.1039/c0cc04881j
_journal_volume                  47
_journal_year                    2011
_chemical_formula_moiety         'C20 H18 Dy Ni N3 O10 S, C2 H10 O3 S'
_chemical_formula_sum            'C22 H28 Dy N3 Ni O13 S2'
_chemical_formula_weight         827.80
_chemical_name_systematic
;
?
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 95.88(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   7.5226(15)
_cell_length_b                   22.668(5)
_cell_length_c                   17.349(4)
_cell_measurement_reflns_used    19806
_cell_measurement_temperature    200(2)
_cell_measurement_theta_max      27.13
_cell_measurement_theta_min      1.48
_cell_volume                     2942.8(11)
_computing_cell_refinement       'STOE X-AREA, PLATON (A.L.Spek, 2005)'
_computing_data_collection       'STOE X-AREA'
_computing_data_reduction        'STOE X-RED, PLATON (A.L.Spek, 2005)'
_computing_molecular_graphics    'Diamond 2.1e/3'
_computing_publication_material  'X-STEP32, Microsoft Word'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      200(2)
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0891
_diffrn_reflns_av_sigmaI/netI    0.0717
_diffrn_reflns_limit_h_max       9
_diffrn_reflns_limit_h_min       -9
_diffrn_reflns_limit_k_max       28
_diffrn_reflns_limit_k_min       -28
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            20559
_diffrn_reflns_theta_full        26.75
_diffrn_reflns_theta_max         26.75
_diffrn_reflns_theta_min         1.48
_exptl_absorpt_coefficient_mu    3.369
_exptl_absorpt_correction_T_max  0.7515
_exptl_absorpt_correction_T_min  0.5533
_exptl_absorpt_correction_type   integration
_exptl_absorpt_process_details   'STOE X-RED & X-SHAPE'
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    1.868
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       needle
_exptl_crystal_F_000             1644
_exptl_crystal_size_max          0.200
_exptl_crystal_size_mid          0.150
_exptl_crystal_size_min          0.100
_refine_diff_density_max         0.992
_refine_diff_density_min         -1.779
_refine_diff_density_rms         0.153
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.040
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     381
_refine_ls_number_reflns         6252
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.040
_refine_ls_R_factor_all          0.0838
_refine_ls_R_factor_gt           0.0582
_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)+(0.0645P)²+7.7292P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1315
_refine_ls_wR_factor_ref         0.1424
_reflns_number_gt                4665
_reflns_number_total             6252
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            C0CC04881J.TXT
_cod_data_source_block           4
_cod_original_cell_volume        2942.9(10)
_cod_original_sg_symbol_H-M      P21/n
_cod_database_code               7105981
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'
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 -0.1323(12) 0.3592(3) -0.0498(5) 0.0428(18) Uani 1 1 d . A .
C2 C -0.0984(11) 0.2993(3) -0.0299(5) 0.0426(18) Uani 1 1 d . . .
H2 H -0.1211 0.2859 0.0200 0.051 Uiso 1 1 calc R . .
C3 C -0.0334(11) 0.2598(4) -0.0809(5) 0.0431(18) Uani 1 1 d . . .
C4 C -0.0007(12) 0.2789(4) -0.1561(5) 0.049(2) Uani 1 1 d . . .
H4 H 0.0410 0.2523 -0.1925 0.059 Uiso 1 1 calc R . .
C5 C -0.0316(13) 0.3373(4) -0.1743(5) 0.051(2) Uani 1 1 d . . .
H5 H -0.0066 0.3507 -0.2240 0.061 Uiso 1 1 calc R . .
C6 C -0.0969(11) 0.3778(4) -0.1245(5) 0.0432(18) Uani 1 1 d . . .
C7 C -0.1218(12) 0.4373(4) -0.1497(5) 0.0461(19) Uani 1 1 d . A .
H7 H -0.0998 0.4463 -0.2014 0.055 Uiso 1 1 calc R . .
C8A C -0.157(2) 0.5422(7) -0.1349(9) 0.031(3) Uiso 0.50 1 d P A 1
H8A1 H -0.0310 0.5500 -0.1439 0.037 Uiso 0.50 1 calc PR A 1
H8A2 H -0.2310 0.5468 -0.1851 0.037 Uiso 0.50 1 calc PR A 1
C9A C -0.207(3) 0.5816(9) -0.0857(11) 0.055(4) Uiso 0.50 1 d P A 1
H9A1 H -0.3028 0.6063 -0.1125 0.066 Uiso 0.50 1 calc PR A 1
H9A2 H -0.1046 0.6077 -0.0695 0.066 Uiso 0.50 1 calc PR A 1
C8B C -0.218(3) 0.5377(8) -0.1492(11) 0.043(4) Uiso 0.50 1 d P A 2
H8B1 H -0.3028 0.5306 -0.1956 0.051 Uiso 0.50 1 calc PR A 2
H8B2 H -0.1082 0.5560 -0.1659 0.051 Uiso 0.50 1 calc PR A 2
C9B C -0.301(2) 0.5778(7) -0.0924(8) 0.035(3) Uiso 0.50 1 d P A 2
H9B1 H -0.2465 0.6176 -0.0937 0.043 Uiso 0.50 1 calc PR A 2
H9B2 H -0.4304 0.5817 -0.1084 0.043 Uiso 0.50 1 calc PR A 2
C10 C -0.3262(12) 0.5896(3) 0.0389(5) 0.0467(19) Uani 1 1 d . A .
H10 H -0.3465 0.6299 0.0260 0.056 Uiso 1 1 calc R . .
C11 C -0.3224(10) 0.5122(3) 0.1410(5) 0.0369(16) Uani 1 1 d . A .
C12 C -0.3548(11) 0.5712(3) 0.1156(5) 0.0421(17) Uani 1 1 d . . .
C13 C -0.4109(12) 0.6143(3) 0.1670(5) 0.0440(19) Uani 1 1 d . . .
H13 H -0.4310 0.6537 0.1495 0.053 Uiso 1 1 calc R . .
C14 C -0.4366(12) 0.5998(4) 0.2418(5) 0.0469(19) Uani 1 1 d . . .
H14 H -0.4761 0.6289 0.2756 0.056 Uiso 1 1 calc R . .
C15 C -0.4043(11) 0.5420(3) 0.2681(5) 0.0411(17) Uani 1 1 d . . .
C16 C -0.3513(10) 0.4994(3) 0.2185(5) 0.0408(17) Uani 1 1 d . . .
H16 H -0.3335 0.4602 0.2370 0.049 Uiso 1 1 calc R . .
C17 C 0.0007(11) 0.1981(3) -0.0578(5) 0.0409(17) Uani 1 1 d . . .
C18 C -0.4344(11) 0.5259(3) 0.3507(5) 0.0411(17) Uani 1 1 d . . .
C19 C 0.6151(14) 0.1553(5) 0.1048(7) 0.073(3) Uani 1 1 d . . .
H19A H 0.5995 0.1271 0.1464 0.109 Uiso 1 1 calc R . .
H19B H 0.6738 0.1910 0.1269 0.109 Uiso 1 1 calc R . .
H19C H 0.6891 0.1375 0.0677 0.109 Uiso 1 1 calc R . .
C20 C 0.481(2) 0.2130(7) -0.0224(11) 0.117(6) Uani 1 1 d . . .
H20A H 0.5834 0.1922 -0.0399 0.175 Uiso 1 1 calc R . .
H20B H 0.5166 0.2529 -0.0057 0.175 Uiso 1 1 calc R . .
H20C H 0.3849 0.2153 -0.0651 0.175 Uiso 1 1 calc R . .
C21 C -0.109(3) -0.2699(11) -0.1884(13) 0.166(9) Uani 1 1 d . . .
H21A H -0.0691 -0.2945 -0.1435 0.249 Uiso 1 1 calc R . .
H21B H -0.2229 -0.2852 -0.2132 0.249 Uiso 1 1 calc R . .
H21C H -0.1257 -0.2292 -0.1714 0.249 Uiso 1 1 calc R . .
C22 C 0.046(2) -0.3480(7) -0.2709(11) 0.127(6) Uani 1 1 d . . .
H22A H 0.1087 -0.3565 -0.3165 0.190 Uiso 1 1 calc R . .
H22B H -0.0780 -0.3616 -0.2803 0.190 Uiso 1 1 calc R . .
H22C H 0.1057 -0.3684 -0.2257 0.190 Uiso 1 1 calc R . .
N1 N -0.2746(10) 0.5551(3) -0.0142(4) 0.0459(16) Uani 1 1 d . . .
N2 N -0.1721(9) 0.4803(3) -0.1074(4) 0.0426(15) Uani 1 1 d . . .
N3 N -0.2967(11) 0.0383(4) -0.0697(5) 0.063(2) Uani 1 1 d . . .
O1 O -0.1892(9) 0.3944(2) 0.0027(3) 0.0500(15) Uani 1 1 d . . .
O2 O -0.2740(8) 0.4701(2) 0.0969(3) 0.0416(12) Uani 1 1 d . . .
O3 O -0.0265(8) 0.1807(2) 0.0095(3) 0.0450(13) Uani 1 1 d . . .
O4 O 0.0648(8) 0.1624(2) -0.1048(3) 0.0459(13) Uani 1 1 d . . .
O5 O -0.4164(7) 0.4729(2) 0.3711(3) 0.0416(12) Uani 1 1 d . . .
O6 O -0.4728(9) 0.5682(2) 0.3935(3) 0.0485(14) Uani 1 1 d . . .
O7 O -0.2552(8) 0.0912(2) -0.0795(4) 0.0522(15) Uani 1 1 d . . .
O8 O -0.1920(7) 0.0056(2) -0.0255(3) 0.0406(12) Uani 1 1 d . . .
O9 O -0.4670(14) 0.0116(5) -0.1118(7) 0.121(4) Uani 1 1 d . . .
O10 O 0.3275(8) 0.1159(3) 0.0247(4) 0.0512(14) Uani 1 1 d . . .
O11 O 0.2254(16) -0.2598(5) -0.2056(6) 0.116(4) Uani 1 1 d . . .
O12 O 0.091(2) -0.1397(7) 0.2581(8) 0.163(5) Uani 1 1 d . . .
O13 O 0.0911(14) 0.1697(5) -0.3967(7) 0.116(4) Uani 1 1 d . . .
S1 S 0.4027(3) 0.17417(12) 0.05658(19) 0.0666(7) Uani 1 1 d . . .
S2 S 0.0489(7) -0.27144(17) -0.2537(2) 0.1072(13) Uani 1 1 d . . .
Ni1 Ni -0.22823(14) 0.47541(4) -0.00592(6) 0.0366(2) Uani 1 1 d . A .
Dy1 Dy 0.04809(5) 0.080680(15) -0.01760(2) 0.03726(12) Uani 1 1 d . . .
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'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ni Ni 0.3393 1.1124 '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'
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 C6 124.0(7) . . ?
O1 C1 C2 118.5(7) . . ?
C6 C1 C2 117.5(7) . . ?
C3 C2 C1 122.1(7) . . ?
C2 C3 C4 119.7(7) . . ?
C2 C3 C17 120.3(7) . . ?
C4 C3 C17 120.0(7) . . ?
C5 C4 C3 117.7(8) . . ?
C4 C5 C6 123.8(8) . . ?
C5 C6 C1 119.2(7) . . ?
C5 C6 C7 118.6(7) . . ?
C1 C6 C7 122.2(7) . . ?
N2 C7 C6 125.0(8) . . ?
C9A C8A N2 113.2(14) . . ?
C8A C9A N1 113.8(16) . . ?
N2 C8B C9B 106.9(13) . . ?
N1 C9B C8B 111.6(12) . . ?
N1 C10 C12 124.7(7) . . ?
O2 C11 C16 119.3(7) . . ?
O2 C11 C12 124.0(7) . . ?
C16 C11 C12 116.7(7) . . ?
C13 C12 C11 120.4(7) . . ?
C13 C12 C10 117.8(7) . . ?
C11 C12 C10 121.7(7) . . ?
C14 C13 C12 120.8(7) . . ?
C13 C14 C15 119.7(7) . . ?
C16 C15 C14 120.2(7) . . ?
C16 C15 C18 120.1(7) . . ?
C14 C15 C18 119.7(7) . . ?
C15 C16 C11 122.3(7) . . ?
O3 C17 O4 119.8(7) . . ?
O3 C17 C3 120.4(7) . . ?
O4 C17 C3 119.7(7) . . ?
O3 C17 Dy1 59.9(4) . . ?
O4 C17 Dy1 60.2(4) . . ?
C3 C17 Dy1 177.2(6) . . ?
O5 C18 O6 125.7(8) . . ?
O5 C18 C15 118.4(7) . . ?
O6 C18 C15 115.9(7) . . ?
C10 N1 C9B 115.4(9) . . ?
C10 N1 C9A 119.5(10) . . ?
C9B N1 C9A 27.6(8) . . ?
C10 N1 Ni1 127.1(6) . . ?
C9B N1 Ni1 115.5(8) . . ?
C9A N1 Ni1 112.2(9) . . ?
C7 N2 C8A 119.2(8) . . ?
C7 N2 C8B 116.0(9) . . ?
C8A N2 C8B 19.5(8) . . ?
C7 N2 Ni1 126.9(6) . . ?
C8A N2 Ni1 113.1(7) . . ?
C8B N2 Ni1 116.4(8) . . ?
O7 N3 O8 119.3(8) . . ?
O7 N3 O9 121.4(8) . . ?
O8 N3 O9 119.3(8) . . ?
O7 N3 Dy1 59.1(4) . . ?
O8 N3 Dy1 61.1(4) . . ?
O9 N3 Dy1 168.9(7) . . ?
C1 O1 Ni1 127.0(5) . . ?
C11 O2 Ni1 127.5(5) . . ?
C17 O3 Dy1 92.9(5) . . ?
C17 O4 Dy1 92.3(4) . . ?
C18 O5 Dy1 135.9(5) . 4_566 ?
C18 O6 Dy1 137.5(5) . 2_455 ?
N3 O7 Dy1 94.7(5) . . ?
N3 O8 Dy1 157.0(6) . 3 ?
N3 O8 Dy1 92.1(5) . . ?
Dy1 O8 Dy1 104.3(2) 3 . ?
S1 O10 Dy1 135.5(4) . . ?
O10 S1 C20 106.9(6) . . ?
O10 S1 C19 104.2(5) . . ?
C20 S1 C19 97.5(7) . . ?
O11 S2 C21 105.0(9) . . ?
O11 S2 C22 105.0(8) . . ?
C21 S2 C22 97.7(10) . . ?
N1 Ni1 O2 95.0(3) . . ?
N1 Ni1 N2 85.8(3) . . ?
O2 Ni1 N2 177.5(3) . . ?
N1 Ni1 O1 178.1(3) . . ?
O2 Ni1 O1 84.3(2) . . ?
N2 Ni1 O1 94.9(3) . . ?
O10 Dy1 O6 92.8(2) . 2_445 ?
O10 Dy1 O5 105.6(2) . 4_665 ?
O6 Dy1 O5 140.82(18) 2_445 4_665 ?
O10 Dy1 O8 79.0(2) . 3 ?
O6 Dy1 O8 75.3(2) 2_445 3 ?
O5 Dy1 O8 74.8(2) 4_665 3 ?
O10 Dy1 O3 80.4(2) . . ?
O6 Dy1 O3 81.25(18) 2_445 . ?
O5 Dy1 O3 135.13(18) 4_665 . ?
O8 Dy1 O3 147.7(2) 3 . ?
O10 Dy1 O4 80.1(2) . . ?
O6 Dy1 O4 135.92(18) 2_445 . ?
O5 Dy1 O4 82.06(18) 4_665 . ?
O8 Dy1 O4 143.08(19) 3 . ?
O3 Dy1 O4 54.68(17) . . ?
O10 Dy1 O7 153.3(2) . . ?
O6 Dy1 O7 96.7(2) 2_445 . ?
O5 Dy1 O7 82.3(2) 4_665 . ?
O8 Dy1 O7 127.59(19) 3 . ?
O3 Dy1 O7 76.5(2) . . ?
O4 Dy1 O7 75.7(2) . . ?
O10 Dy1 O8 153.53(19) . . ?
O6 Dy1 O8 73.7(2) 2_445 . ?
O5 Dy1 O8 74.88(19) 4_665 . ?
O8 Dy1 O8 75.7(2) 3 . ?
O3 Dy1 O8 118.53(18) . . ?
O4 Dy1 O8 125.44(19) . . ?
O7 Dy1 O8 52.86(17) . . ?
O10 Dy1 C17 80.6(2) . . ?
O6 Dy1 C17 108.5(2) 2_445 . ?
O5 Dy1 C17 108.5(2) 4_665 . ?
O8 Dy1 C17 159.4(2) 3 . ?
O3 Dy1 C17 27.3(2) . . ?
O4 Dy1 C17 27.5(2) . . ?
O7 Dy1 C17 72.8(2) . . ?
O8 Dy1 C17 125.0(2) . . ?
O10 Dy1 N3 179.5(2) . . ?
O6 Dy1 N3 87.2(2) 2_445 . ?
O5 Dy1 N3 74.7(2) 4_665 . ?
O8 Dy1 N3 101.5(2) 3 . ?
O3 Dy1 N3 99.1(2) . . ?
O4 Dy1 N3 99.6(2) . . ?
O7 Dy1 N3 26.2(2) . . ?
O8 Dy1 N3 26.9(2) . . ?
C17 Dy1 N3 99.0(2) . . ?
O10 Dy1 Dy1 117.85(15) . 3 ?
O6 Dy1 Dy1 70.16(13) 2_445 3 ?
O5 Dy1 Dy1 70.66(13) 4_665 3 ?
O8 Dy1 Dy1 39.25(13) 3 3 ?
O3 Dy1 Dy1 146.09(13) . 3 ?
O4 Dy1 Dy1 150.29(14) . 3 ?
O7 Dy1 Dy1 88.83(13) . 3 ?
O8 Dy1 Dy1 36.42(11) . 3 ?
C17 Dy1 Dy1 161.39(17) . 3 ?
N3 Dy1 Dy1 62.59(18) . 3 ?
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 1.315(9) . ?
C1 C6 1.414(11) . ?
C1 C2 1.416(11) . ?
C2 C3 1.383(11) . ?
C3 C4 1.420(12) . ?
C3 C17 1.471(11) . ?
C4 C5 1.374(11) . ?
C5 C6 1.385(11) . ?
C6 C7 1.426(11) . ?
C7 N2 1.299(11) . ?
C8A C9A 1.32(2) . ?
C8A N2 1.492(17) . ?
C9A N1 1.51(2) . ?
C8B N2 1.512(19) . ?
C8B C9B 1.52(2) . ?
C9B N1 1.445(16) . ?
C10 N1 1.299(11) . ?
C10 C12 1.431(12) . ?
C11 O2 1.299(9) . ?
C11 C16 1.415(11) . ?
C11 C12 1.421(10) . ?
C12 C13 1.418(11) . ?
C13 C14 1.371(12) . ?
C14 C15 1.402(11) . ?
C15 C16 1.379(11) . ?
C15 C18 1.517(11) . ?
C17 O3 1.268(9) . ?
C17 O4 1.278(9) . ?
C17 Dy1 2.766(8) . ?
C18 O5 1.255(9) . ?
C18 O6 1.265(9) . ?
C19 S1 1.778(11) . ?
C20 S1 1.778(15) . ?
C21 S2 1.725(19) . ?
C22 S2 1.761(16) . ?
N1 Ni1 1.842(7) . ?
N2 Ni1 1.855(7) . ?
N3 O7 1.254(10) . ?
N3 O8 1.278(10) . ?
N3 O9 1.533(13) . ?
N3 Dy1 2.826(9) . ?
O1 Ni1 1.864(5) . ?
O2 Ni1 1.855(5) . ?
O3 Dy1 2.395(5) . ?
O4 Dy1 2.403(5) . ?
O5 Dy1 2.319(5) 4_566 ?
O6 Dy1 2.299(5) 2_455 ?
O7 Dy1 2.432(6) . ?
O8 Dy1 2.323(5) 3 ?
O8 Dy1 2.475(5) . ?
O10 S1 1.519(6) . ?
O10 Dy1 2.298(6) . ?
O11 S2 1.518(11) . ?
Dy1 O6 2.299(5) 2_445 ?
Dy1 O5 2.319(5) 4_665 ?
Dy1 O8 2.323(5) 3 ?
Dy1 Dy1 3.7902(10) 3 ?
