#------------------------------------------------------------------------------
#$Date: 2016-03-25 15:45:19 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179934 $
#$URL: svn://www.crystallography.net/cod/cif/7/02/29/7022980.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_7022980
loop_
_publ_author_name
'Chen, Yanmei'
'Cao, Yanyuan'
'Chen, Wenqian'
'Gao, Qian'
'Li, Lei'
'Gao, Dandan'
'Liu, Wei'
'Li, Yahong'
'Li, Wu'
_publ_section_title
;
 Seven novel Sr(II)-Sm(III) and Sr(II)-Dy(III) coordination polymers:
 construction of five classes of structural topologies using different
 amounts of imidazole.
;
_journal_issue                   27
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              10011
_journal_page_last               10018
_journal_paper_doi               10.1039/c3dt50453k
_journal_volume                  42
_journal_year                    2013
_chemical_formula_moiety         'C56 H43 Dy3 N8 O41 Sr3, 6(H20)'
_chemical_formula_sum            'C56 H55 Dy3 N8 O47 Sr3'
_chemical_formula_weight         2342.44
_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                103.278(3)
_cell_angle_beta                 110.883(3)
_cell_angle_gamma                94.123(3)
_cell_formula_units_Z            2
_cell_length_a                   15.389(3)
_cell_length_b                   15.434(3)
_cell_length_c                   18.241(3)
_cell_measurement_reflns_used    4469
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      26.1
_cell_measurement_theta_min      2.232
_cell_volume                     3882.9(13)
_computing_cell_refinement       'SAINT (Bruker, 2005)'
_computing_data_collection       'APEX-II (Bruker, 2005)'
_computing_data_reduction        'SAINT (Bruker, 2005)'
_computing_molecular_graphics
'SHELXTL (Sheldrick, 2008) and DIAMOND (Brandenburg, 1999)'
_computing_publication_material  'SHELXTL (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.972
_diffrn_measured_fraction_theta_max 0.972
_diffrn_measurement_device_type  'Bruker APEXII CCD'
_diffrn_measurement_method       'φ and ω scans'
_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  0.0699
_diffrn_reflns_av_sigmaI/netI    0.1535
_diffrn_reflns_limit_h_max       18
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_l_max       20
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            19368
_diffrn_reflns_theta_full        25.03
_diffrn_reflns_theta_max         25.03
_diffrn_reflns_theta_min         1.81
_exptl_absorpt_coefficient_mu    5.004
_exptl_absorpt_correction_T_max  0.4343
_exptl_absorpt_correction_T_min  0.3797
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS (Bruker, 2005)'
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    2.003
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       flake
_exptl_crystal_F_000             2270
_exptl_crystal_size_max          0.24
_exptl_crystal_size_mid          0.23
_exptl_crystal_size_min          0.20
_platon_squeeze_details          ' ?'
_refine_diff_density_max         3.972
_refine_diff_density_min         -4.326
_refine_diff_density_rms         0.348
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.115
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1001
_refine_ls_number_reflns         13324
_refine_ls_number_restraints     124
_refine_ls_restrained_S_all      1.134
_refine_ls_R_factor_all          0.1408
_refine_ls_R_factor_gt           0.0851
_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)+(0.0100P)²+120.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1816
_refine_ls_wR_factor_ref         0.2099
_reflns_number_gt                7249
_reflns_number_total             13324
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c3dt50453k.cif
_cod_data_source_block           CCDC899490
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to /home/saulius/struct/CIF-dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 1891 2012-01-12 08:04:46Z andrius 

The following automatic conversions were performed:

'_exptl_crystal_density_meas' value 'not measured' was changed to '?'
- the value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 3008 2015-01-20 13:52:24Z robertas 
;
_cod_original_cell_volume        3883.0(11)
_cod_database_code               7022980
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
Dy1 Dy 0.36524(8) 0.19755(6) 0.40911(5) 0.0309(3) Uani 1 1 d .
Dy2 Dy 0.74737(7) 0.29970(6) 0.33195(5) 0.0278(3) Uani 1 1 d .
Dy3 Dy 0.37366(8) 0.25262(6) -0.00395(5) 0.0296(3) Uani 1 1 d .
Sr1 Sr 0.50538(16) 0.50916(12) 0.24279(10) 0.0364(5) Uani 1 1 d .
Sr2 Sr 0.20892(17) 0.14230(13) -0.31808(12) 0.0397(6) Uani 1 1 d D
Sr3 Sr 0.44057(17) -0.00703(12) -0.28758(11) 0.0375(5) Uani 1 1 d D
O1 O 0.3761(10) 0.1065(9) 0.5015(8) 0.040(4) Uani 1 1 d .
O2 O 0.4594(12) 0.0505(10) 0.6015(8) 0.054(5) Uani 1 1 d .
O3 O 0.4922(12) 0.2734(9) 0.3814(8) 0.040(4) Uani 1 1 d .
O4 O 0.6429(11) 0.2932(9) 0.3936(7) 0.040(4) Uani 1 1 d .
O5 O 0.2782(12) 0.2162(9) 0.2726(8) 0.043(4) Uani 1 1 d .
O6 O 0.1796(15) 0.2896(15) 0.1967(10) 0.092(7) Uani 1 1 d .
O7 O 0.4318(10) 0.3126(9) 0.5375(7) 0.038(4) Uani 1 1 d .
O8 O 0.4632(12) 0.4586(9) 0.6066(8) 0.056(5) Uani 1 1 d .
O9 O 0.2209(12) 0.1982(9) 0.4314(9) 0.052(4) Uani 1 1 d .
O10 O 0.0810(12) 0.1320(11) 0.4169(10) 0.063(5) Uani 1 1 d .
O11 O 0.4091(11) 0.0809(9) 0.3240(7) 0.040(4) Uani 1 1 d .
O12 O 0.3774(11) -0.0500(9) 0.2293(7) 0.041(4) Uani 1 1 d .
O13 O 0.6721(10) 0.4289(9) 0.3061(8) 0.039(3) Uani 1 1 d U
O14 O 0.6823(10) 0.5792(9) 0.3324(8) 0.046(4) Uani 1 1 d .
O15 O 0.8629(11) 0.2840(8) 0.4513(7) 0.044(4) Uani 1 1 d .
O16 O 0.9746(11) 0.3431(10) 0.5762(9) 0.057(5) Uani 1 1 d .
O17 O 0.8541(10) 0.3727(8) 0.2935(8) 0.032(3) Uani 1 1 d .
O18 O 0.9521(13) 0.3798(10) 0.2288(9) 0.062(5) Uani 1 1 d .
O19 O 0.7140(10) 0.1382(8) 0.3177(7) 0.032(3) Uani 1 1 d .
O20 O 0.7309(12) -0.0027(9) 0.2760(9) 0.054(5) Uani 1 1 d .
O21 O 0.4988(13) 0.2306(9) 0.1127(7) 0.051(5) Uani 1 1 d .
O22 O 0.6474(10) 0.2552(8) 0.1969(8) 0.034(3) Uani 1 1 d .
O23 O 0.3877(11) 0.3434(9) -0.0915(8) 0.041(4) Uani 1 1 d U
O24 O 0.4641(11) 0.4314(10) -0.1371(8) 0.052(5) Uani 1 1 d .
O25 O 0.3878(11) 0.3877(8) 0.0983(7) 0.036(4) Uani 1 1 d .
O26 O 0.3200(11) 0.4876(9) 0.1592(8) 0.046(4) Uani 1 1 d .
O27 O 0.2431(12) 0.1828(9) -0.1324(8) 0.044(4) Uani 1 1 d .
O28 O 0.1029(12) 0.1725(10) -0.2284(8) 0.048(4) Uani 1 1 d .
O29 O 0.3012(11) 0.2124(9) 0.0898(8) 0.042(4) Uani 1 1 d .
O30 O 0.250(2) 0.1063(11) 0.1393(14) 0.100(8) Uani 1 1 d .
H30A H 0.2366 0.1487 0.1669 0.150 Uiso 1 1 calc R
O31 O 0.4442(10) 0.1608(9) -0.0813(7) 0.035(3) Uani 1 1 d .
O32 O 0.4620(13) 0.0246(10) -0.1424(8) 0.057(5) Uani 1 1 d .
O33 O 0.4487(12) 0.3584(9) 0.2552(7) 0.054(5) Uani 1 1 d .
H33A H 0.4023 0.3269 0.2132 0.082 Uiso 1 1 d R
H33B H 0.4551 0.3332 0.2933 0.082 Uiso 1 1 d R
O34 O 0.4835(15) 0.6779(11) 0.2880(11) 0.083(6) Uani 1 1 d D
H34A H 0.4667 0.6980 0.3267 0.125 Uiso 1 1 d RD
H34B H 0.4782 0.6510 0.2409 0.125 Uiso 1 1 d RD
O35 O 0.2402(10) 0.3106(9) -0.2452(8) 0.044(4) Uani 1 1 d .
H35A H 0.2827 0.3232 -0.1974 0.066 Uiso 1 1 d R
H35B H 0.2284 0.3602 -0.2562 0.066 Uiso 1 1 d R
O36 O 0.0858(13) 0.2008(11) -0.4255(9) 0.066(5) Uani 1 1 d .
H36A H 0.0627 0.2493 -0.4238 0.099 Uiso 1 1 d R
H36B H 0.0987 0.1884 -0.4679 0.099 Uiso 1 1 d R
O37 O 0.2986(12) 0.2318(10) -0.3810(9) 0.058(5) Uani 1 1 d .
H37A H 0.3056 0.2195 -0.4262 0.088 Uiso 1 1 d R
H37B H 0.3060 0.2889 -0.3636 0.088 Uiso 1 1 d R
O38 O 0.0625(13) 0.0071(11) -0.4011(10) 0.074(6) Uani 1 1 d .
H38A H 0.0299 -0.0146 -0.3784 0.111 Uiso 1 1 d R
H38B H 0.0349 0.0471 -0.4208 0.111 Uiso 1 1 d R
O39 O 0.2508(13) 0.0366(10) -0.4320(10) 0.096(7) Uani 1 1 d D
H39A H 0.2578 0.0583 -0.4670 0.144 Uiso 1 1 d RD
H39B H 0.3039 0.0234 -0.4185 0.144 Uiso 1 1 d RD
O40 O 0.4075(7) 0.1627(8) -0.2446(7) 0.046(4) Uani 1 1 d D
H40A H 0.4264 0.1922 -0.1967 0.069 Uiso 1 1 d RD
H40B H 0.4323 0.2046 -0.2551 0.069 Uiso 1 1 d RD
O41 O 0.5042(13) -0.1362(9) -0.2295(9) 0.062(5) Uani 1 1 d .
H41A H 0.5511 -0.1417 -0.2435 0.093 Uiso 1 1 d R
H41B H 0.5113 -0.1616 -0.1915 0.093 Uiso 1 1 d R
N1 N 0.5294(12) 0.1763(10) 0.4879(8) 0.027(4) Uani 1 1 d .
N2 N 0.3310(16) 0.3510(11) 0.4007(10) 0.054(6) Uani 1 1 d .
N3 N 0.2457(10) 0.0560(8) 0.3302(7) 0.017(2) Uani 1 1 d U
N4 N 0.8187(12) 0.4431(10) 0.4418(9) 0.030(4) Uani 1 1 d .
N5 N 0.8370(12) 0.2029(10) 0.2689(8) 0.032(4) Uani 1 1 d .
N6 N 0.5318(14) 0.3397(10) 0.0308(8) 0.039(5) Uani 1 1 d .
N7 N 0.2354(13) 0.3260(11) -0.0247(10) 0.039(4) Uani 1 1 d U
N8 N 0.3493(12) 0.0901(10) -0.0093(8) 0.030(4) Uani 1 1 d .
C1 C 0.5392(13) 0.1359(12) 0.5463(11) 0.031(5) Uani 1 1 d DU
C2 C 0.6308(12) 0.1290(18) 0.5943(14) 0.069(9) Uani 1 1 d D
H2 H 0.6395 0.0972 0.6333 0.083 Uiso 1 1 calc R
C3 C 0.7091(15) 0.168(2) 0.5855(14) 0.083(10) Uani 1 1 d D
H3 H 0.7701 0.1671 0.6202 0.100 Uiso 1 1 calc R
C4 C 0.692(2) 0.2090(17) 0.5225(14) 0.069(8) Uani 1 1 d D
H4 H 0.7422 0.2330 0.5119 0.083 Uiso 1 1 calc R
C5 C 0.6041(19) 0.2136(14) 0.4775(11) 0.045(7) Uani 1 1 d .
C6 C 0.4526(17) 0.0938(13) 0.5518(12) 0.034(5) Uani 1 1 d .
C7 C 0.5760(19) 0.2639(11) 0.4115(10) 0.030(5) Uani 1 1 d .
C8 C 0.2738(16) 0.3681(14) 0.3319(12) 0.038(5) Uani 1 1 d U
C9 C 0.258(3) 0.453(2) 0.3248(19) 0.103(14) Uani 1 1 d .
H9 H 0.2215 0.4635 0.2756 0.124 Uiso 1 1 calc R
C10 C 0.303(3) 0.5256(19) 0.399(2) 0.096(12) Uani 1 1 d .
H10 H 0.2996 0.5852 0.3982 0.115 Uiso 1 1 calc R
C11 C 0.3455(17) 0.5084(16) 0.4653(15) 0.050(6) Uani 1 1 d .
H11 H 0.3617 0.5541 0.5134 0.061 Uiso 1 1 calc R
C12 C 0.371(2) 0.4204(13) 0.4704(14) 0.053(7) Uani 1 1 d .
C13 C 0.2435(17) 0.2848(18) 0.2614(12) 0.047(6) Uani 1 1 d .
C14 C 0.4302(14) 0.3976(12) 0.5462(11) 0.026(4) Uani 1 1 d U
C15 C 0.1630(13) 0.0575(11) 0.3367(10) 0.021(2) Uani 1 1 d U
C16 C 0.089(2) -0.0164(14) 0.2903(13) 0.061(8) Uani 1 1 d .
H16 H 0.0327 -0.0196 0.2986 0.073 Uiso 1 1 calc R
C17 C 0.1014(17) -0.0829(16) 0.2330(14) 0.049(6) Uani 1 1 d .
H17 H 0.0528 -0.1312 0.2010 0.059 Uiso 1 1 calc R
C18 C 0.1841(15) -0.0789(13) 0.2225(12) 0.038(5) Uani 1 1 d .
H18 H 0.1953 -0.1230 0.1842 0.045 Uiso 1 1 calc R
C19 C 0.2532(13) -0.0012(11) 0.2755(10) 0.022(2) Uani 1 1 d U
C20 C 0.1535(15) 0.1349(13) 0.3977(11) 0.031(5) Uani 1 1 d U
C21 C 0.3494(14) 0.0077(13) 0.2738(10) 0.025(4) Uani 1 1 d U
C22 C 0.7929(14) 0.5195(13) 0.4297(12) 0.031(5) Uani 1 1 d .
C23 C 0.8325(15) 0.6018(14) 0.4868(12) 0.042(6) Uani 1 1 d .
H23 H 0.8109 0.6550 0.4788 0.050 Uiso 1 1 calc R
C24 C 0.908(2) 0.5999(15) 0.5579(15) 0.076(10) Uani 1 1 d .
H24 H 0.9397 0.6539 0.5970 0.091 Uiso 1 1 calc R
C25 C 0.9347(18) 0.5209(14) 0.5708(12) 0.048(7) Uani 1 1 d .
H25 H 0.9821 0.5210 0.6198 0.057 Uiso 1 1 calc R
C26 C 0.8922(16) 0.4413(14) 0.5118(12) 0.040(5) Uani 1 1 d .
C27 C 0.7114(16) 0.5093(14) 0.3481(12) 0.037(5) Uani 1 1 d U
C28 C 0.9118(18) 0.3518(14) 0.5143(12) 0.044(6) Uani 1 1 d .
C29 C 0.8902(15) 0.2380(13) 0.2398(11) 0.034(5) Uani 1 1 d U
C30 C 0.944(2) 0.1865(15) 0.1991(14) 0.060(8) Uani 1 1 d .
H30 H 0.9891 0.2135 0.1845 0.071 Uiso 1 1 calc R
C31 C 0.9223(18) 0.0932(16) 0.1840(14) 0.050(6) Uani 1 1 d .
H31 H 0.9499 0.0552 0.1546 0.060 Uiso 1 1 calc R
C32 C 0.861(2) 0.0565(16) 0.2120(14) 0.067(9) Uani 1 1 d .
H32 H 0.8459 -0.0058 0.2017 0.081 Uiso 1 1 calc R
C33 C 0.8217(15) 0.1124(13) 0.2546(11) 0.034(5) Uani 1 1 d .
C34 C 0.9042(15) 0.3392(13) 0.2548(12) 0.033(5) Uani 1 1 d .
C35 C 0.7498(17) 0.0796(15) 0.2854(13) 0.041(5) Uani 1 1 d U
C36 C 0.6030(15) 0.3340(14) 0.0959(11) 0.034(5) Uani 1 1 d .
C37 C 0.6936(17) 0.3899(16) 0.1239(15) 0.057(7) Uani 1 1 d .
H37 H 0.7411 0.3910 0.1731 0.069 Uiso 1 1 calc R
C38 C 0.709(2) 0.443(2) 0.0749(15) 0.091(12) Uani 1 1 d .
H38 H 0.7677 0.4751 0.0875 0.109 Uiso 1 1 calc R
C39 C 0.6298(16) 0.4447(14) 0.0058(13) 0.043(5) Uani 1 1 d U
H39 H 0.6349 0.4839 -0.0248 0.052 Uiso 1 1 calc R
C40 C 0.5467(16) 0.3894(14) -0.0162(12) 0.039(5) Uani 1 1 d U
C41 C 0.5809(17) 0.2719(12) 0.1395(10) 0.032(5) Uani 1 1 d .
C42 C 0.4538(16) 0.3889(14) -0.0881(11) 0.044(6) Uani 1 1 d .
C43 C 0.2345(15) 0.3887(13) 0.0178(11) 0.031(5) Uani 1 1 d U
C44 C 0.1500(19) 0.4300(16) 0.0197(13) 0.056(7) Uani 1 1 d .
H44 H 0.1504 0.4730 0.0649 0.067 Uiso 1 1 calc R
C45 C 0.065(2) 0.3957(19) -0.0581(15) 0.085(11) Uani 1 1 d .
H45 H 0.0098 0.4203 -0.0667 0.103 Uiso 1 1 calc R
C46 C 0.073(2) 0.3257(16) -0.1158(16) 0.066(8) Uani 1 1 d .
H46 H 0.0244 0.3061 -0.1672 0.079 Uiso 1 1 calc R
C47 C 0.1486(17) 0.2852(15) -0.0999(13) 0.041(6) Uani 1 1 d .
C48 C 0.3148(16) 0.4246(13) 0.1022(12) 0.032(5) Uani 1 1 d U
C49 C 0.1631(17) 0.2081(14) -0.1582(14) 0.040(6) Uani 1 1 d .
C50 C 0.3079(15) 0.0580(13) 0.0330(11) 0.034(5) Uani 1 1 d .
C51 C 0.2897(19) -0.0317(14) 0.0292(13) 0.053(7) Uani 1 1 d .
H51 H 0.2578 -0.0514 0.0587 0.063 Uiso 1 1 calc R
C52 C 0.3206(18) -0.0892(16) -0.0196(13) 0.054(7) Uani 1 1 d .
H52 H 0.3101 -0.1506 -0.0238 0.065 Uiso 1 1 calc R
C53 C 0.3667(17) -0.0604(13) -0.0629(11) 0.040(6) Uani 1 1 d .
H53 H 0.3884 -0.1003 -0.0964 0.048 Uiso 1 1 calc R
C54 C 0.3803(16) 0.0355(13) -0.0542(11) 0.038(6) Uani 1 1 d .
C55 C 0.281(2) 0.1350(18) 0.0873(13) 0.057(7) Uani 1 1 d .
C56 C 0.4341(14) 0.0758(14) -0.0982(11) 0.028(5) 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'
Sr Sr -1.5307 3.2498 '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
O9 Dy1 O11 128.7(5) . .
O9 Dy1 O1 74.8(5) . .
O11 Dy1 O1 90.0(5) . .
O9 Dy1 O7 84.9(5) . .
O11 Dy1 O7 141.0(5) . .
O1 Dy1 O7 79.9(4) . .
O9 Dy1 O5 88.0(5) . .
O11 Dy1 O5 78.4(5) . .
O1 Dy1 O5 146.3(5) . .
O7 Dy1 O5 128.0(4) . .
O9 Dy1 O3 150.3(5) . .
O11 Dy1 O3 74.3(5) . .
O1 Dy1 O3 129.2(5) . .
O7 Dy1 O3 83.3(5) . .
O5 Dy1 O3 78.1(5) . .
O9 Dy1 N2 78.0(6) . .
O11 Dy1 N2 132.6(5) . .
O1 Dy1 N2 137.4(5) . .
O7 Dy1 N2 65.5(5) . .
O5 Dy1 N2 62.6(5) . .
O3 Dy1 N2 72.4(6) . .
O9 Dy1 N1 135.4(5) . .
O11 Dy1 N1 71.2(5) . .
O1 Dy1 N1 64.9(5) . .
O7 Dy1 N1 70.4(5) . .
O5 Dy1 N1 136.5(5) . .
O3 Dy1 N1 64.3(5) . .
N2 Dy1 N1 120.3(6) . .
O9 Dy1 N3 65.8(5) . .
O11 Dy1 N3 62.8(5) . .
O1 Dy1 N3 73.1(4) . .
O7 Dy1 N3 144.3(4) . .
O5 Dy1 N3 73.4(4) . .
O3 Dy1 N3 132.1(4) . .
N2 Dy1 N3 123.1(6) . .
N1 Dy1 N3 116.3(5) . .
O4 Dy2 O22 101.0(5) . .
O4 Dy2 O17 154.7(5) . .
O22 Dy2 O17 87.6(5) . .
O4 Dy2 O15 87.3(5) . .
O22 Dy2 O15 155.7(4) . .
O17 Dy2 O15 94.5(5) . .
O4 Dy2 O13 79.4(5) . .
O22 Dy2 O13 74.2(4) . .
O17 Dy2 O13 80.2(5) . .
O15 Dy2 O13 130.0(4) . .
O4 Dy2 O19 77.7(5) . .
O22 Dy2 O19 81.9(4) . .
O17 Dy2 O19 127.4(5) . .
O15 Dy2 O19 77.6(4) . .
O13 Dy2 O19 142.8(5) . .
O4 Dy2 N5 141.2(5) . .
O22 Dy2 N5 77.9(5) . .
O17 Dy2 N5 63.8(4) . .
O15 Dy2 N5 81.4(5) . .
O13 Dy2 N5 134.9(4) . .
O19 Dy2 N5 63.7(4) . .
O4 Dy2 N4 82.7(5) . .
O22 Dy2 N4 137.7(5) . .
O17 Dy2 N4 75.1(5) . .
O15 Dy2 N4 65.7(5) . .
O13 Dy2 N4 65.0(5) . .
O19 Dy2 N4 138.9(4) . .
N5 Dy2 N4 124.4(5) . .
O31 Dy3 O25 148.5(5) . .
O31 Dy3 O23 79.1(4) . .
O25 Dy3 O23 89.2(4) . .
O31 Dy3 O21 84.8(5) . .
O25 Dy3 O21 79.3(5) . .
O23 Dy3 O21 127.2(5) . .
O31 Dy3 O27 76.7(5) . .
O25 Dy3 O27 128.8(5) . .
O23 Dy3 O27 76.0(5) . .
O21 Dy3 O27 147.0(5) . .
O31 Dy3 N7 139.5(5) . .
O25 Dy3 N7 63.1(5) . .
O23 Dy3 N7 77.4(5) . .
O21 Dy3 N7 135.6(5) . .
O27 Dy3 N7 65.9(6) . .
O31 Dy3 N8 65.3(5) . .
O25 Dy3 N8 132.6(4) . .
O23 Dy3 N8 138.2(5) . .
O21 Dy3 N8 72.3(5) . .
O27 Dy3 N8 75.2(5) . .
N7 Dy3 N8 116.3(6) . .
O31 Dy3 N6 74.1(5) . .
O25 Dy3 N6 74.5(5) . .
O23 Dy3 N6 62.5(5) . .
O21 Dy3 N6 64.8(5) . .
O27 Dy3 N6 132.6(5) . .
N7 Dy3 N6 121.1(5) . .
N8 Dy3 N6 122.4(6) . .
O31 Dy3 O29 128.4(4) . .
O25 Dy3 O29 71.7(4) . .
O23 Dy3 O29 150.6(5) . .
O21 Dy3 O29 72.1(5) . .
O27 Dy3 O29 98.4(5) . .
N7 Dy3 O29 74.1(5) . .
N8 Dy3 O29 63.8(5) . .
N6 Dy3 O29 128.9(5) . .
O24 Sr1 O33 136.9(5) 2_665 .
O24 Sr1 O8 144.8(4) 2_665 2_666
O33 Sr1 O8 77.2(4) . 2_666
O24 Sr1 O14 84.4(5) 2_665 .
O33 Sr1 O14 116.1(5) . .
O8 Sr1 O14 68.8(5) 2_666 .
O24 Sr1 O34 79.5(5) 2_665 .
O33 Sr1 O34 137.6(6) . .
O8 Sr1 O34 74.6(5) 2_666 .
O14 Sr1 O34 81.8(5) . .
O24 Sr1 O26 90.3(5) 2_665 .
O33 Sr1 O26 78.1(5) . .
O8 Sr1 O26 108.8(5) 2_666 .
O14 Sr1 O26 163.5(4) . .
O34 Sr1 O26 81.9(5) . .
O24 Sr1 O25 76.3(4) 2_665 .
O33 Sr1 O25 64.9(4) . .
O8 Sr1 O25 138.3(4) 2_666 .
O14 Sr1 O25 143.4(5) . .
O34 Sr1 O25 123.6(5) . .
O26 Sr1 O25 48.6(4) . .
O24 Sr1 O13 102.1(5) 2_665 .
O33 Sr1 O13 73.4(5) . .
O8 Sr1 O13 76.8(5) 2_666 .
O14 Sr1 O13 47.5(4) . .
O34 Sr1 O13 128.1(5) . .
O26 Sr1 O13 148.9(4) . .
O25 Sr1 O13 106.5(4) . .
O35 Sr2 O20 134.4(5) . 2_655
O35 Sr2 O36 78.8(5) . .
O20 Sr2 O36 146.2(5) 2_655 .
O35 Sr2 O37 70.3(5) . .
O20 Sr2 O37 119.3(5) 2_655 .
O36 Sr2 O37 72.4(5) . .
O35 Sr2 O39 137.5(5) . .
O20 Sr2 O39 68.4(6) 2_655 .
O36 Sr2 O39 91.2(6) . .
O37 Sr2 O39 67.3(5) . .
O35 Sr2 O38 139.0(6) . .
O20 Sr2 O38 75.1(5) 2_655 .
O36 Sr2 O38 73.2(6) . .
O37 Sr2 O38 126.0(5) . .
O39 Sr2 O38 73.1(6) . .
O35 Sr2 O28 70.8(4) . .
O20 Sr2 O28 97.6(5) 2_655 .
O36 Sr2 O28 87.4(5) . .
O37 Sr2 O28 138.8(5) . .
O39 Sr2 O28 150.7(5) . .
O38 Sr2 O28 78.5(5) . .
O35 Sr2 O40 82.7(4) . .
O20 Sr2 O40 66.0(4) 2_655 .
O36 Sr2 O40 137.6(5) . .
O37 Sr2 O40 65.5(4) . .
O39 Sr2 O40 77.4(5) . .
O38 Sr2 O40 137.6(5) . .
O28 Sr2 O40 121.6(4) . .
O35 Sr2 O27 66.3(4) . .
O20 Sr2 O27 75.1(4) 2_655 .
O36 Sr2 O27 126.2(5) . .
O37 Sr2 O27 125.9(4) . .
O39 Sr2 O27 141.9(5) . .
O38 Sr2 O27 108.0(4) . .
O28 Sr2 O27 43.7(4) . .
O40 Sr2 O27 78.2(4) . .
O32 Sr3 O2 147.9(5) . 1_554
O32 Sr3 O41 69.6(5) . .
O2 Sr3 O41 131.2(5) 1_554 .
O32 Sr3 O12 84.4(5) . 2_655
O2 Sr3 O12 78.0(5) 1_554 2_655
O41 Sr3 O12 78.9(5) . 2_655
O32 Sr3 O40 73.9(4) . .
O2 Sr3 O40 79.8(4) 1_554 .
O41 Sr3 O40 142.9(4) . .
O12 Sr3 O40 91.4(4) 2_655 .
O32 Sr3 O20 71.0(5) . 2_655
O2 Sr3 O20 114.3(5) 1_554 2_655
O41 Sr3 O20 107.2(5) . 2_655
O12 Sr3 O20 150.0(4) 2_655 2_655
O40 Sr3 O20 65.8(4) . 2_655
O32 Sr3 O19 85.9(5) . 2_655
O2 Sr3 O19 121.6(5) 1_554 2_655
O41 Sr3 O19 71.7(5) . 2_655
O12 Sr3 O19 150.6(4) 2_655 2_655
O40 Sr3 O19 112.4(4) . 2_655
O20 Sr3 O19 46.7(4) 2_655 2_655
O32 Sr3 O11 114.5(5) . 2_655
O2 Sr3 O11 71.8(5) 1_554 2_655
O41 Sr3 O11 60.9(4) . 2_655
O12 Sr3 O11 47.6(4) 2_655 2_655
O40 Sr3 O11 133.5(4) . 2_655
O20 Sr3 O11 160.3(4) 2_655 2_655
O19 Sr3 O11 113.8(4) 2_655 2_655
O32 Sr3 C35 73.5(6) . 2_655
O2 Sr3 C35 124.8(6) 1_554 2_655
O41 Sr3 C35 86.7(6) . 2_655
O12 Sr3 C35 156.9(5) 2_655 2_655
O40 Sr3 C35 89.3(5) . 2_655
O20 Sr3 C35 23.7(5) 2_655 2_655
O19 Sr3 C35 23.7(4) 2_655 2_655
O11 Sr3 C35 137.2(5) 2_655 2_655
O32 Sr3 C21 101.0(5) . 2_655
O2 Sr3 C21 71.7(5) 1_554 2_655
O41 Sr3 C21 70.3(5) . 2_655
O12 Sr3 C21 23.1(4) 2_655 2_655
O40 Sr3 C21 111.3(4) . 2_655
O20 Sr3 C21 171.9(4) 2_655 2_655
O19 Sr3 C21 135.9(4) 2_655 2_655
O11 Sr3 C21 24.7(4) 2_655 2_655
C35 Sr3 C21 156.7(5) 2_655 2_655
C6 O1 Dy1 125.1(12) . .
C6 O2 Sr3 162.6(15) . 1_556
C7 O3 Dy1 122.8(11) . .
C7 O4 Dy2 161.1(12) . .
C13 O5 Dy1 123.3(13) . .
C14 O7 Dy1 124.9(11) . .
C14 O8 Sr1 139.3(12) . 2_666
C20 O9 Dy1 123.8(13) . .
C21 O11 Dy1 122.6(13) . .
C21 O11 Sr3 89.9(11) . 2_655
Dy1 O11 Sr3 146.9(6) . 2_655
C21 O12 Sr3 102.9(12) . 2_655
C27 O13 Dy2 121.8(13) . .
C27 O13 Sr1 84.8(12) . .
Dy2 O13 Sr1 151.5(6) . .
C27 O14 Sr1 98.7(12) . .
C28 O15 Dy2 123.6(12) . .
C34 O17 Dy2 129.4(12) . .
C35 O19 Dy2 125.3(13) . .
C35 O19 Sr3 90.1(12) . 2_655
Dy2 O19 Sr3 138.5(6) . 2_655
C35 O20 Sr2 146.2(15) . 2_655
C35 O20 Sr3 93.8(14) . 2_655
Sr2 O20 Sr3 109.0(5) 2_655 2_655
C41 O21 Dy3 122.9(11) . .
C41 O22 Dy2 147.7(12) . .
C42 O23 Dy3 129.9(14) . .
C42 O24 Sr1 169.9(16) . 2_665
C48 O25 Dy3 122.7(12) . .
C48 O25 Sr1 91.0(11) . .
Dy3 O25 Sr1 145.7(7) . .
C48 O26 Sr1 97.3(14) . .
C49 O27 Dy3 126.7(13) . .
C49 O27 Sr2 81.1(12) . .
Dy3 O27 Sr2 136.3(6) . .
C49 O28 Sr2 102.6(14) . .
C55 O29 Dy3 120.8(14) . .
C56 O31 Dy3 125.4(12) . .
C56 O32 Sr3 135.0(13) . .
Sr3 O40 Sr2 103.0(4) . .
C1 N1 C5 121.9(17) . .
C1 N1 Dy1 116.5(13) . .
C5 N1 Dy1 121.2(13) . .
C8 N2 C12 119.0(18) . .
C8 N2 Dy1 123.4(13) . .
C12 N2 Dy1 117.5(14) . .
C19 N3 C15 119.6(15) . .
C19 N3 Dy1 123.0(12) . .
C15 N3 Dy1 115.2(11) . .
C22 N4 C26 121.2(16) . .
C22 N4 Dy2 120.2(12) . .
C26 N4 Dy2 118.2(12) . .
C29 N5 C33 118.7(19) . .
C29 N5 Dy2 118.9(13) . .
C33 N5 Dy2 121.8(14) . .
C36 N6 C40 120(2) . .
C36 N6 Dy3 118.7(12) . .
C40 N6 Dy3 121.5(14) . .
C43 N7 C47 118(2) . .
C43 N7 Dy3 122.9(17) . .
C47 N7 Dy3 118.6(13) . .
C54 N8 C50 118.6(17) . .
C54 N8 Dy3 118.2(12) . .
C50 N8 Dy3 123.2(13) . .
N1 C1 C2 117.2(18) . .
N1 C1 C6 118.3(17) . .
C2 C1 C6 124.2(17) . .
C3 C2 C1 121.8(19) . .
C2 C3 C4 117(2) . .
C5 C4 C3 120(2) . .
C4 C5 N1 122.4(18) . .
C4 C5 C7 125(2) . .
N1 C5 C7 113(2) . .
O2 C6 O1 126(2) . .
O2 C6 C1 120(2) . .
O1 C6 C1 114.4(16) . .
O3 C7 O4 126.1(16) . .
O3 C7 C5 119(2) . .
O4 C7 C5 115(2) . .
N2 C8 C9 124(2) . .
N2 C8 C13 110.5(18) . .
C9 C8 C13 124(2) . .
C8 C9 C10 115(2) . .
C11 C10 C9 120(3) . .
C10 C11 C12 123(2) . .
N2 C12 C11 117(2) . .
N2 C12 C14 117.2(17) . .
C11 C12 C14 126.1(19) . .
O5 C13 O6 126(2) . .
O5 C13 C8 118.4(19) . .
O6 C13 C8 116(2) . .
O8 C14 O7 129.0(18) . .
O8 C14 C12 116.3(18) . .
O7 C14 C12 114.4(16) . .
N3 C15 C16 119.6(18) . .
N3 C15 C20 118.1(16) . .
C16 C15 C20 122.1(19) . .
C17 C16 C15 119(3) . .
C18 C17 C16 120(2) . .
C17 C18 C19 114.4(19) . .
N3 C19 C18 126.3(18) . .
N3 C19 C21 113.6(16) . .
C18 C19 C21 119.5(16) . .
O9 C20 O10 122.9(19) . .
O9 C20 C15 116.4(19) . .
O10 C20 C15 120.5(18) . .
O12 C21 O11 118.8(18) . .
O12 C21 C19 125.0(17) . .
O11 C21 C19 116.2(16) . .
O12 C21 Sr3 54.0(10) . 2_655
O11 C21 Sr3 65.4(10) . 2_655
C19 C21 Sr3 171.4(12) . 2_655
N4 C22 C23 123.2(18) . .
N4 C22 C27 114.4(17) . .
C23 C22 C27 122.4(18) . .
C22 C23 C24 115.4(19) . .
C25 C24 C23 122(2) . .
C24 C25 C26 120(2) . .
C25 C26 N4 118.4(18) . .
C25 C26 C28 127.8(19) . .
N4 C26 C28 113.7(18) . .
O14 C27 O13 125.2(19) . .
O14 C27 C22 118.2(17) . .
O13 C27 C22 116.2(18) . .
O16 C28 O15 123.1(19) . .
O16 C28 C26 118.4(19) . .
O15 C28 C26 118.5(18) . .
N5 C29 C30 123.5(19) . .
N5 C29 C34 117.8(19) . .
C30 C29 C34 118.6(19) . .
C31 C30 C29 114(2) . .
C32 C31 C30 121(2) . .
C33 C32 C31 119(2) . .
C32 C33 N5 124(2) . .
C32 C33 C35 123(2) . .
N5 C33 C35 113(2) . .
O18 C34 O17 126.7(19) . .
O18 C34 C29 123.5(19) . .
O17 C34 C29 109.6(18) . .
O19 C35 O20 125(2) . .
O19 C35 C33 116.3(19) . .
O20 C35 C33 118(2) . .
O19 C35 Sr3 66.2(12) . 2_655
O20 C35 Sr3 62.4(13) . 2_655
C33 C35 Sr3 160.4(14) . 2_655
N6 C36 C37 121.2(18) . .
N6 C36 C41 115.5(19) . .
C37 C36 C41 123.1(18) . .
C38 C37 C36 118(2) . .
C37 C38 C39 117(2) . .
C40 C39 C38 120(2) . .
N6 C40 C39 122(2) . .
N6 C40 C42 111.6(18) . .
C39 C40 C42 125.1(18) . .
O21 C41 O22 122.3(17) . .
O21 C41 C36 118.0(17) . .
O22 C41 C36 119(2) . .
O23 C42 O24 131(2) . .
O23 C42 C40 114.4(17) . .
O24 C42 C40 114.6(19) . .
N7 C43 C44 127(2) . .
N7 C43 C48 120(2) . .
C44 C43 C48 108.7(17) . .
C43 C44 C45 114(2) . .
C46 C45 C44 116(3) . .
C47 C46 C45 121(3) . .
C46 C47 C49 125(2) . .
C46 C47 N7 121(2) . .
C49 C47 N7 113(2) . .
O26 C48 O25 123.1(19) . .
O26 C48 C43 129(2) . .
O25 C48 C43 107.1(16) . .
O28 C49 O27 122(2) . .
O28 C49 C47 123(2) . .
O27 C49 C47 115(2) . .
N8 C50 C51 125.0(19) . .
N8 C50 C55 110.9(18) . .
C51 C50 C55 124.1(18) . .
C52 C51 C50 116(2) . .
C51 C52 C53 122(2) . .
C52 C53 C54 116(2) . .
N8 C54 C53 121.9(19) . .
N8 C54 C56 117.3(17) . .
C53 C54 C56 120.8(19) . .
O29 C55 O30 126(2) . .
O29 C55 C50 121(2) . .
O30 C55 C50 112(2) . .
O32 C56 O31 128.6(19) . .
O32 C56 C54 118.0(19) . .
O31 C56 C54 113.3(16) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Dy1 O9 2.396(17) .
Dy1 O11 2.398(14) .
Dy1 O1 2.402(12) .
Dy1 O7 2.410(12) .
Dy1 O5 2.467(14) .
Dy1 O3 2.468(16) .
Dy1 N2 2.490(17) .
Dy1 N1 2.511(16) .
Dy1 N3 2.514(13) .
Dy2 O4 2.275(15) .
Dy2 O22 2.297(13) .
Dy2 O17 2.319(13) .
Dy2 O15 2.346(13) .
Dy2 O13 2.432(14) .
Dy2 O19 2.442(12) .
Dy2 N5 2.469(18) .
Dy2 N4 2.482(14) .
Dy3 O31 2.361(14) .
Dy3 O25 2.394(12) .
Dy3 O23 2.407(13) .
Dy3 O21 2.420(14) .
Dy3 O27 2.421(15) .
Dy3 N7 2.433(18) .
Dy3 N8 2.484(14) .
Dy3 N6 2.484(19) .
Dy3 O29 2.510(14) .
Sr1 O24 2.485(12) 2_665
Sr1 O33 2.515(12) .
Sr1 O8 2.533(13) 2_666
Sr1 O14 2.616(14) .
Sr1 O34 2.629(17) .
Sr1 O26 2.666(16) .
Sr1 O25 2.753(12) .
Sr1 O13 2.907(15) .
Sr2 O35 2.555(14) .
Sr2 O20 2.574(14) 2_655
Sr2 O36 2.580(14) .
Sr2 O37 2.591(14) .
Sr2 O39 2.636(7) .
Sr2 O38 2.677(15) .
Sr2 O28 2.686(16) .
Sr2 O40 2.826(9) .
Sr2 O27 3.138(13) .
Sr3 O32 2.473(13) .
Sr3 O2 2.484(12) 1_554
Sr3 O41 2.563(14) .
Sr3 O12 2.616(16) 2_655
Sr3 O40 2.696(9) .
Sr3 O20 2.733(17) 2_655
Sr3 O19 2.815(13) 2_655
Sr3 O11 2.867(15) 2_655
O1 C6 1.27(2) .
O2 C6 1.22(2) .
O2 Sr3 2.484(12) 1_556
O3 C7 1.24(3) .
O4 C7 1.27(2) .
O5 C13 1.25(3) .
O6 C13 1.26(3) .
O7 C14 1.29(2) .
O8 C14 1.19(2) .
O8 Sr1 2.533(13) 2_666
O9 C20 1.24(2) .
O10 C20 1.28(2) .
O11 C21 1.32(2) .
O11 Sr3 2.867(15) 2_655
O12 C21 1.27(2) .
O12 Sr3 2.616(16) 2_655
O13 C27 1.27(2) .
O14 C27 1.25(2) .
O15 C28 1.30(2) .
O16 C28 1.24(2) .
O17 C34 1.28(2) .
O18 C34 1.22(2) .
O19 C35 1.24(2) .
O19 Sr3 2.815(13) 2_655
O20 C35 1.24(2) .
O20 Sr2 2.574(14) 2_655
O20 Sr3 2.733(17) 2_655
O21 C41 1.24(3) .
O22 C41 1.27(2) .
O23 C42 1.17(2) .
O24 C42 1.27(2) .
O24 Sr1 2.485(12) 2_665
O25 C48 1.31(2) .
O26 C48 1.22(2) .
O27 C49 1.28(3) .
O28 C49 1.25(2) .
O29 C55 1.20(3) .
O30 C55 1.34(3) .
O31 C56 1.26(2) .
O32 C56 1.21(2) .
N1 C1 1.32(2) .
N1 C5 1.34(3) .
N2 C8 1.35(3) .
N2 C12 1.37(3) .
N3 C19 1.22(2) .
N3 C15 1.32(2) .
N4 C22 1.31(2) .
N4 C26 1.38(2) .
N5 C29 1.27(2) .
N5 C33 1.35(2) .
N6 C36 1.32(2) .
N6 C40 1.34(2) .
N7 C43 1.10(2) .
N7 C47 1.50(3) .
N8 C54 1.28(3) .
N8 C50 1.31(2) .
C1 C2 1.396(10) .
C1 C6 1.49(3) .
C2 C3 1.386(10) .
C3 C4 1.389(10) .
C4 C5 1.33(3) .
C5 C7 1.53(2) .
C8 C9 1.38(3) .
C8 C13 1.50(3) .
C9 C10 1.45(4) .
C10 C11 1.25(3) .
C11 C12 1.46(3) .
C12 C14 1.49(3) .
C15 C16 1.41(3) .
C15 C20 1.49(2) .
C16 C17 1.36(3) .
C17 C18 1.35(3) .
C18 C19 1.43(2) .
C19 C21 1.49(3) .
C22 C23 1.38(3) .
C22 C27 1.53(3) .
C23 C24 1.40(3) .
C24 C25 1.36(3) .
C25 C26 1.37(3) .
C26 C28 1.44(3) .
C29 C30 1.46(3) .
C29 C34 1.51(3) .
C30 C31 1.39(3) .
C31 C32 1.37(3) .
C32 C33 1.34(3) .
C33 C35 1.51(3) .
C36 C37 1.44(3) .
C36 C41 1.47(3) .
C37 C38 1.40(3) .
C38 C39 1.41(3) .
C39 C40 1.36(3) .
C40 C42 1.56(3) .
C43 C44 1.50(3) .
C43 C48 1.54(3) .
C44 C45 1.50(3) .
C45 C46 1.37(3) .
C46 C47 1.33(3) .
C47 C49 1.49(3) .
C50 C51 1.37(3) .
C50 C55 1.55(3) .
C51 C52 1.34(3) .
C52 C53 1.36(3) .
C53 C54 1.44(3) .
C54 C56 1.53(3) .
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
O41 H41B O21 0.85 2.02 2.855(17) 168.8 2_655
O41 H41A O11 0.85 2.15 2.762(19) 129.1 2_655
O40 H40B O34 0.82 2.46 3.28(2) 175.0 2_665
O40 H40A O31 0.82 2.20 2.835(16) 135.0 .
O39 H39B O2 0.82 2.28 3.03(2) 151.8 1_554
O39 H39A O1 0.82 2.22 2.885(18) 137.8 1_554
O38 H38B O36 0.85 2.47 3.14(2) 135.4 .
O38 H38A O10 0.85 2.19 2.85(2) 134.6 2
O37 H37B O14 0.85 1.96 2.808(19) 175.6 2_665
O37 H37A O1 0.85 2.49 3.16(2) 136.9 1_554
O37 H37A O9 0.85 2.39 3.10(2) 141.7 1_554
O36 H36B O10 0.85 1.99 2.80(2) 158.5 1_554
O36 H36A O16 0.85 2.05 2.88(2) 164.2 1_454
O35 H35B O14 0.85 2.54 3.02(2) 116.8 2_665
O35 H35A O23 0.85 1.97 2.814(19) 174.2 .
O34 H34B O24 0.84 2.50 3.27(2) 154.6 2_665
O34 H34A O7 0.84 2.46 2.94(2) 117.1 2_666
O33 H33B O3 0.85 1.96 2.806(16) 170.0 .
O33 H33A O29 0.85 2.43 3.255(19) 164.7 .
O30 H30A O6 0.82 2.42 3.19(3) 156.7 .
O30 H30A O5 0.82 1.82 2.50(2) 138.8 .
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_4
O9 Dy1 O1 C6 -154.1(16) . .
O11 Dy1 O1 C6 75.5(16) . .
O7 Dy1 O1 C6 -66.7(15) . .
O5 Dy1 O1 C6 144.2(14) . .
O3 Dy1 O1 C6 6.0(18) . .
N2 Dy1 O1 C6 -102.1(17) . .
N1 Dy1 O1 C6 6.3(14) . .
N3 Dy1 O1 C6 137.0(16) . .
O9 Dy1 O3 C7 143.9(13) . .
O11 Dy1 O3 C7 -71.3(13) . .
O1 Dy1 O3 C7 5.4(16) . .
O7 Dy1 O3 C7 76.5(14) . .
O5 Dy1 O3 C7 -152.4(14) . .
N2 Dy1 O3 C7 142.9(14) . .
N1 Dy1 O3 C7 5.1(13) . .
N3 Dy1 O3 C7 -98.0(14) . .
O22 Dy2 O4 C7 51(4) . .
O17 Dy2 O4 C7 159(4) . .
O15 Dy2 O4 C7 -106(4) . .
O13 Dy2 O4 C7 122(4) . .
O19 Dy2 O4 C7 -28(4) . .
N5 Dy2 O4 C7 -33(4) . .
N4 Dy2 O4 C7 -172(4) . .
O9 Dy1 O5 C13 65.3(17) . .
O11 Dy1 O5 C13 -164.5(17) . .
O1 Dy1 O5 C13 123.5(16) . .
O7 Dy1 O5 C13 -16.6(19) . .
O3 Dy1 O5 C13 -88.3(17) . .
N2 Dy1 O5 C13 -12.2(16) . .
N1 Dy1 O5 C13 -118.4(17) . .
N3 Dy1 O5 C13 130.7(17) . .
O9 Dy1 O7 C14 -85.7(16) . .
O11 Dy1 O7 C14 121.7(15) . .
O1 Dy1 O7 C14 -161.1(16) . .
O5 Dy1 O7 C14 -2.3(18) . .
O3 Dy1 O7 C14 67.0(15) . .
N2 Dy1 O7 C14 -6.6(15) . .
N1 Dy1 O7 C14 132.0(16) . .
N3 Dy1 O7 C14 -119.9(15) . .
O11 Dy1 O9 C20 -1.1(18) . .
O1 Dy1 O9 C20 -78.5(15) . .
O7 Dy1 O9 C20 -159.3(16) . .
O5 Dy1 O9 C20 72.3(15) . .
O3 Dy1 O9 C20 133.7(14) . .
N2 Dy1 O9 C20 134.6(16) . .
N1 Dy1 O9 C20 -104.1(16) . .
N3 Dy1 O9 C20 -0.4(14) . .
O9 Dy1 O11 C21 7.5(14) . .
O1 Dy1 O11 C21 77.8(12) . .
O7 Dy1 O11 C21 151.5(11) . .
O5 Dy1 O11 C21 -70.3(12) . .
O3 Dy1 O11 C21 -151.1(13) . .
N2 Dy1 O11 C21 -104.4(13) . .
N1 Dy1 O11 C21 141.2(13) . .
N3 Dy1 O11 C21 6.8(11) . .
O9 Dy1 O11 Sr3 -160.4(8) . 2_655
O1 Dy1 O11 Sr3 -90.1(9) . 2_655
O7 Dy1 O11 Sr3 -16.3(13) . 2_655
O5 Dy1 O11 Sr3 121.8(10) . 2_655
O3 Dy1 O11 Sr3 41.0(9) . 2_655
N2 Dy1 O11 Sr3 87.7(12) . 2_655
N1 Dy1 O11 Sr3 -26.6(9) . 2_655
N3 Dy1 O11 Sr3 -161.0(11) . 2_655
O4 Dy2 O13 C27 101.4(15) . .
O22 Dy2 O13 C27 -153.9(15) . .
O17 Dy2 O13 C27 -63.6(15) . .
O15 Dy2 O13 C27 24.1(17) . .
O19 Dy2 O13 C27 154.0(13) . .
N5 Dy2 O13 C27 -100.0(15) . .
N4 Dy2 O13 C27 14.5(14) . .
O4 Dy2 O13 Sr1 -55.2(11) . .
O22 Dy2 O13 Sr1 49.5(11) . .
O17 Dy2 O13 Sr1 139.9(12) . .
O15 Dy2 O13 Sr1 -132.5(11) . .
O19 Dy2 O13 Sr1 -2.5(16) . .
N5 Dy2 O13 Sr1 103.4(12) . .
N4 Dy2 O13 Sr1 -142.1(13) . .
O24 Sr1 O13 C27 81.0(11) 2_665 .
O33 Sr1 O13 C27 -143.3(12) . .
O8 Sr1 O13 C27 -62.9(11) 2_666 .
O14 Sr1 O13 C27 10.3(11) . .
O34 Sr1 O13 C27 -5.1(13) . .
O26 Sr1 O13 C27 -167.5(11) . .
O25 Sr1 O13 C27 160.1(11) . .
O24 Sr1 O13 Dy2 -118.8(11) 2_665 .
O33 Sr1 O13 Dy2 16.9(11) . .
O8 Sr1 O13 Dy2 97.2(12) 2_666 .
O14 Sr1 O13 Dy2 170.5(14) . .
O34 Sr1 O13 Dy2 155.1(11) . .
O26 Sr1 O13 Dy2 -7.4(17) . .
O25 Sr1 O13 Dy2 -39.7(12) . .
O24 Sr1 O14 C27 -122.6(13) 2_665 .
O33 Sr1 O14 C27 17.7(14) . .
O8 Sr1 O14 C27 80.7(13) 2_666 .
O34 Sr1 O14 C27 157.2(13) . .
O26 Sr1 O14 C27 165.5(15) . .
O25 Sr1 O14 C27 -64.6(15) . .
O13 Sr1 O14 C27 -10.6(11) . .
O4 Dy2 O15 C28 -86.8(17) . .
O22 Dy2 O15 C28 162.1(16) . .
O17 Dy2 O15 C28 67.8(18) . .
O13 Dy2 O15 C28 -13(2) . .
O19 Dy2 O15 C28 -164.8(18) . .
N5 Dy2 O15 C28 130.4(18) . .
N4 Dy2 O15 C28 -3.6(17) . .
O4 Dy2 O17 C34 176.9(14) . .
O22 Dy2 O17 C34 -72.1(16) . .
O15 Dy2 O17 C34 83.6(16) . .
O13 Dy2 O17 C34 -146.5(16) . .
O19 Dy2 O17 C34 5.8(18) . .
N5 Dy2 O17 C34 5.5(15) . .
N4 Dy2 O17 C34 146.9(17) . .
O4 Dy2 O19 C35 -178.8(17) . .
O22 Dy2 O19 C35 78.0(16) . .
O17 Dy2 O19 C35 -2.7(18) . .
O15 Dy2 O19 C35 -88.9(16) . .
O13 Dy2 O19 C35 128.1(16) . .
N5 Dy2 O19 C35 -2.4(15) . .
N4 Dy2 O19 C35 -115.5(16) . .
O4 Dy2 O19 Sr3 37.6(7) . 2_655
O22 Dy2 O19 Sr3 -65.6(7) . 2_655
O17 Dy2 O19 Sr3 -146.2(7) . 2_655
O15 Dy2 O19 Sr3 127.6(8) . 2_655
O13 Dy2 O19 Sr3 -15.5(12) . 2_655
N5 Dy2 O19 Sr3 -146.0(9) . 2_655
N4 Dy2 O19 Sr3 101.0(9) . 2_655
O31 Dy3 O21 C41 77.7(16) . .
O25 Dy3 O21 C41 -75.0(16) . .
O23 Dy3 O21 C41 5.7(19) . .
O27 Dy3 O21 C41 133.3(15) . .
N7 Dy3 O21 C41 -106.8(17) . .
N8 Dy3 O21 C41 143.4(17) . .
N6 Dy3 O21 C41 2.8(15) . .
O29 Dy3 O21 C41 -149.1(17) . .
O4 Dy2 O22 C41 65(3) . .
O17 Dy2 O22 C41 -91(3) . .
O15 Dy2 O22 C41 173(2) . .
O13 Dy2 O22 C41 -11(3) . .
O19 Dy2 O22 C41 140(3) . .
N5 Dy2 O22 C41 -155(3) . .
N4 Dy2 O22 C41 -27(3) . .
O31 Dy3 O23 C42 -77(2) . .
O25 Dy3 O23 C42 74(2) . .
O21 Dy3 O23 C42 -2(2) . .
O27 Dy3 O23 C42 -156(2) . .
N7 Dy3 O23 C42 136(2) . .
N8 Dy3 O23 C42 -108(2) . .
N6 Dy3 O23 C42 0.8(19) . .
O29 Dy3 O23 C42 122(2) . .
O31 Dy3 O25 C48 156.0(12) . .
O23 Dy3 O25 C48 88.7(13) . .
O21 Dy3 O25 C48 -143.1(14) . .
O27 Dy3 O25 C48 17.6(15) . .
N7 Dy3 O25 C48 12.5(13) . .
N8 Dy3 O25 C48 -89.6(14) . .
N6 Dy3 O25 C48 150.4(13) . .
O29 Dy3 O25 C48 -68.6(13) . .
O31 Dy3 O25 Sr1 -35.4(13) . .
O23 Dy3 O25 Sr1 -102.6(9) . .
O21 Dy3 O25 Sr1 25.6(9) . .
O27 Dy3 O25 Sr1 -173.8(7) . .
N7 Dy3 O25 Sr1 -178.9(11) . .
N8 Dy3 O25 Sr1 79.1(12) . .
N6 Dy3 O25 Sr1 -41.0(9) . .
O29 Dy3 O25 Sr1 100.1(9) . .
O24 Sr1 O25 C48 -101.8(11) 2_665 .
O33 Sr1 O25 C48 97.4(11) . .
O8 Sr1 O25 C48 70.9(12) 2_666 .
O14 Sr1 O25 C48 -162.1(10) . .
O34 Sr1 O25 C48 -34.6(12) . .
O26 Sr1 O25 C48 1.0(10) . .
O13 Sr1 O25 C48 159.4(10) . .
O24 Sr1 O25 Dy3 87.7(10) 2_665 .
O33 Sr1 O25 Dy3 -73.1(9) . .
O8 Sr1 O25 Dy3 -99.6(11) 2_666 .
O14 Sr1 O25 Dy3 27.4(12) . .
O34 Sr1 O25 Dy3 155.0(9) . .
O26 Sr1 O25 Dy3 -169.4(11) . .
O13 Sr1 O25 Dy3 -11.1(10) . .
O24 Sr1 O26 C48 70.2(12) 2_665 .
O33 Sr1 O26 C48 -68.0(12) . .
O8 Sr1 O26 C48 -139.9(11) 2_666 .
O14 Sr1 O26 C48 141.3(16) . .
O34 Sr1 O26 C48 149.5(12) . .
O25 Sr1 O26 C48 -1.1(11) . .
O13 Sr1 O26 C48 -44.3(15) . .
O31 Dy3 O27 C49 -163.8(16) . .
O25 Dy3 O27 C49 -4.7(17) . .
O23 Dy3 O27 C49 -81.9(15) . .
O21 Dy3 O27 C49 138.6(15) . .
N7 Dy3 O27 C49 0.3(15) . .
N8 Dy3 O27 C49 128.6(16) . .
N6 Dy3 O27 C49 -110.7(16) . .
O29 Dy3 O27 C49 68.6(15) . .
O31 Dy3 O27 Sr2 -43.7(8) . .
O25 Dy3 O27 Sr2 115.4(8) . .
O23 Dy3 O27 Sr2 38.1(8) . .
O21 Dy3 O27 Sr2 -101.3(11) . .
N7 Dy3 O27 Sr2 120.4(9) . .
N8 Dy3 O27 Sr2 -111.3(9) . .
N6 Dy3 O27 Sr2 9.4(12) . .
O29 Dy3 O27 Sr2 -171.3(8) . .
O35 Sr2 O27 C49 69.4(11) . .
O20 Sr2 O27 C49 -135.5(12) 2_655 .
O36 Sr2 O27 C49 15.1(13) . .
O37 Sr2 O27 C49 108.9(12) . .
O39 Sr2 O27 C49 -152.4(11) . .
O38 Sr2 O27 C49 -67.0(12) . .
O28 Sr2 O27 C49 -17.1(11) . .
O40 Sr2 O27 C49 156.5(11) . .
O35 Sr2 O27 Dy3 -66.0(8) . .
O20 Sr2 O27 Dy3 89.1(9) 2_655 .
O36 Sr2 O27 Dy3 -120.3(9) . .
O37 Sr2 O27 Dy3 -26.5(11) . .
O39 Sr2 O27 Dy3 72.3(11) . .
O38 Sr2 O27 Dy3 157.6(8) . .
O28 Sr2 O27 Dy3 -152.4(11) . .
O40 Sr2 O27 Dy3 21.1(8) . .
O35 Sr2 O28 C49 -57.9(13) . .
O20 Sr2 O28 C49 76.7(14) 2_655 .
O36 Sr2 O28 C49 -136.9(14) . .
O37 Sr2 O28 C49 -77.7(15) . .
O39 Sr2 O28 C49 135.2(15) . .
O38 Sr2 O28 C49 149.7(14) . .
O40 Sr2 O28 C49 10.3(15) . .
O27 Sr2 O28 C49 17.7(12) . .
O31 Dy3 O29 C55 -16(2) . .
O25 Dy3 O29 C55 -168(2) . .
O23 Dy3 O29 C55 139.9(18) . .
O21 Dy3 O29 C55 -83.9(19) . .
O27 Dy3 O29 C55 63.5(19) . .
N7 Dy3 O29 C55 125(2) . .
N8 Dy3 O29 C55 -5.3(18) . .
N6 Dy3 O29 C55 -117.1(19) . .
O25 Dy3 O31 C56 139.0(14) . .
O23 Dy3 O31 C56 -151.0(15) . .
O21 Dy3 O31 C56 79.4(15) . .
O27 Dy3 O31 C56 -73.1(15) . .
N7 Dy3 O31 C56 -95.7(16) . .
N8 Dy3 O31 C56 6.6(14) . .
N6 Dy3 O31 C56 144.7(16) . .
O29 Dy3 O31 C56 17.2(17) . .
O2 Sr3 O32 C56 60(3) 1_554 .
O41 Sr3 O32 C56 -163(2) . .
O12 Sr3 O32 C56 117(2) 2_655 .
O40 Sr3 O32 C56 24(2) . .
O20 Sr3 O32 C56 -46(2) 2_655 .
O19 Sr3 O32 C56 -91(2) 2_655 .
O11 Sr3 O32 C56 155(2) 2_655 .
C35 Sr3 O32 C56 -70(2) 2_655 .
C21 Sr3 O32 C56 133(2) 2_655 .
O32 Sr3 O40 Sr2 -104.6(5) . .
O2 Sr3 O40 Sr2 94.0(5) 1_554 .
O41 Sr3 O40 Sr2 -115.2(8) . .
O12 Sr3 O40 Sr2 171.6(4) 2_655 .
O20 Sr3 O40 Sr2 -28.6(4) 2_655 .
O19 Sr3 O40 Sr2 -26.1(5) 2_655 .
O11 Sr3 O40 Sr2 146.7(4) 2_655 .
C35 Sr3 O40 Sr2 -31.5(5) 2_655 .
C21 Sr3 O40 Sr2 159.6(4) 2_655 .
O35 Sr2 O40 Sr3 176.5(4) . .
O20 Sr2 O40 Sr3 30.5(4) 2_655 .
O36 Sr2 O40 Sr3 -119.0(6) . .
O37 Sr2 O40 Sr3 -111.9(5) . .
O39 Sr2 O40 Sr3 -41.3(5) . .
O38 Sr2 O40 Sr3 5.4(8) . .
O28 Sr2 O40 Sr3 114.4(4) . .
O27 Sr2 O40 Sr3 109.2(4) . .
O9 Dy1 N1 C1 19.5(15) . .
O11 Dy1 N1 C1 -107.1(13) . .
O1 Dy1 N1 C1 -7.9(12) . .
O7 Dy1 N1 C1 79.8(13) . .
O5 Dy1 N1 C1 -155.3(12) . .
O3 Dy1 N1 C1 171.8(14) . .
N2 Dy1 N1 C1 123.9(13) . .
N3 Dy1 N1 C1 -61.9(13) . .
O9 Dy1 N1 C5 -152.9(13) . .
O11 Dy1 N1 C5 80.5(14) . .
O1 Dy1 N1 C5 179.6(16) . .
O7 Dy1 N1 C5 -92.6(15) . .
O5 Dy1 N1 C5 32.3(17) . .
O3 Dy1 N1 C5 -0.6(14) . .
N2 Dy1 N1 C5 -48.5(16) . .
N3 Dy1 N1 C5 125.6(14) . .
O9 Dy1 N2 C8 -85.0(18) . .
O11 Dy1 N2 C8 47(2) . .
O1 Dy1 N2 C8 -136.0(16) . .
O7 Dy1 N2 C8 -175(2) . .
O5 Dy1 N2 C8 9.0(17) . .
O3 Dy1 N2 C8 94.6(18) . .
N1 Dy1 N2 C8 139.1(17) . .
N3 Dy1 N2 C8 -35(2) . .
O9 Dy1 N2 C12 93.5(17) . .
O11 Dy1 N2 C12 -134.3(16) . .
O1 Dy1 N2 C12 42(2) . .
O7 Dy1 N2 C12 3.7(16) . .
O5 Dy1 N2 C12 -172.5(19) . .
O3 Dy1 N2 C12 -87.0(18) . .
N1 Dy1 N2 C12 -42.4(19) . .
N3 Dy1 N2 C12 143.8(16) . .
O9 Dy1 N3 C19 168.2(15) . .
O11 Dy1 N3 C19 -12.4(13) . .
O1 Dy1 N3 C19 -111.3(14) . .
O7 Dy1 N3 C19 -153.9(13) . .
O5 Dy1 N3 C19 72.9(14) . .
O3 Dy1 N3 C19 16.8(16) . .
N2 Dy1 N3 C19 112.6(14) . .
N1 Dy1 N3 C19 -61.3(14) . .
O9 Dy1 N3 C15 5.0(11) . .
O11 Dy1 N3 C15 -175.6(12) . .
O1 Dy1 N3 C15 85.4(12) . .
O7 Dy1 N3 C15 42.8(15) . .
O5 Dy1 N3 C15 -90.4(12) . .
O3 Dy1 N3 C15 -146.5(11) . .
N2 Dy1 N3 C15 -50.6(13) . .
N1 Dy1 N3 C15 135.4(11) . .
O4 Dy2 N4 C22 -91.5(15) . .
O22 Dy2 N4 C22 6.9(18) . .
O17 Dy2 N4 C22 76.1(15) . .
O15 Dy2 N4 C22 178.2(16) . .
O13 Dy2 N4 C22 -9.9(14) . .
O19 Dy2 N4 C22 -153.2(13) . .
N5 Dy2 N4 C22 118.7(15) . .
O4 Dy2 N4 C26 95.2(15) . .
O22 Dy2 N4 C26 -166.4(13) . .
O17 Dy2 N4 C26 -97.2(15) . .
O15 Dy2 N4 C26 4.9(14) . .
O13 Dy2 N4 C26 176.8(16) . .
O19 Dy2 N4 C26 33.5(18) . .
N5 Dy2 N4 C26 -54.6(16) . .
O4 Dy2 N5 C29 179.5(13) . .
O22 Dy2 N5 C29 87.1(14) . .
O17 Dy2 N5 C29 -6.3(13) . .
O15 Dy2 N5 C29 -105.7(15) . .
O13 Dy2 N5 C29 34.4(17) . .
O19 Dy2 N5 C29 173.9(16) . .
N4 Dy2 N5 C29 -53.2(16) . .
O4 Dy2 N5 C33 8.6(17) . .
O22 Dy2 N5 C33 -83.9(13) . .
O17 Dy2 N5 C33 -177.3(15) . .
O15 Dy2 N5 C33 83.3(13) . .
O13 Dy2 N5 C33 -136.6(12) . .
O19 Dy2 N5 C33 3.0(12) . .
N4 Dy2 N5 C33 135.9(13) . .
O31 Dy3 N6 C36 -94.4(15) . .
O25 Dy3 N6 C36 82.6(15) . .
O23 Dy3 N6 C36 179.9(17) . .
O21 Dy3 N6 C36 -2.7(14) . .
O27 Dy3 N6 C36 -148.4(14) . .
N7 Dy3 N6 C36 126.9(15) . .
N8 Dy3 N6 C36 -48.4(16) . .
O29 Dy3 N6 C36 32.4(18) . .
O31 Dy3 N6 C40 83.3(15) . .
O25 Dy3 N6 C40 -99.8(16) . .
O23 Dy3 N6 C40 -2.5(14) . .
O21 Dy3 N6 C40 175.0(17) . .
O27 Dy3 N6 C40 29.3(19) . .
N7 Dy3 N6 C40 -55.4(17) . .
N8 Dy3 N6 C40 129.2(15) . .
O29 Dy3 N6 C40 -149.9(14) . .
O31 Dy3 N7 C43 -150.5(16) . .
O25 Dy3 N7 C43 1.0(16) . .
O23 Dy3 N7 C43 -94.6(18) . .
O21 Dy3 N7 C43 36(2) . .
O27 Dy3 N7 C43 -174.7(19) . .
N8 Dy3 N7 C43 127.5(17) . .
N6 Dy3 N7 C43 -48.1(19) . .
O29 Dy3 N7 C43 78.2(18) . .
O31 Dy3 N7 C47 27.7(17) . .
O25 Dy3 N7 C47 179.2(15) . .
O23 Dy3 N7 C47 83.6(13) . .
O21 Dy3 N7 C47 -145.3(12) . .
O27 Dy3 N7 C47 3.5(12) . .
N8 Dy3 N7 C47 -54.2(14) . .
N6 Dy3 N7 C47 130.2(13) . .
O29 Dy3 N7 C47 -103.6(13) . .
O31 Dy3 N8 C54 -4.3(15) . .
O25 Dy3 N8 C54 -152.8(14) . .
O23 Dy3 N8 C54 29.8(19) . .
O21 Dy3 N8 C54 -96.7(16) . .
O27 Dy3 N8 C54 77.6(15) . .
N7 Dy3 N8 C54 130.6(15) . .
N6 Dy3 N8 C54 -53.9(16) . .
O29 Dy3 N8 C54 -175.0(17) . .
O31 Dy3 N8 C50 174.2(17) . .
O25 Dy3 N8 C50 25.8(19) . .
O23 Dy3 N8 C50 -151.6(14) . .
O21 Dy3 N8 C50 81.8(16) . .
O27 Dy3 N8 C50 -103.9(17) . .
N7 Dy3 N8 C50 -50.9(17) . .
N6 Dy3 N8 C50 124.7(16) . .
O29 Dy3 N8 C50 3.5(15) . .
C5 N1 C1 C2 -3(3) . .
Dy1 N1 C1 C2 -175.8(16) . .
C5 N1 C1 C6 -178.0(18) . .
Dy1 N1 C1 C6 10(2) . .
N1 C1 C2 C3 4(4) . .
C6 C1 C2 C3 179(2) . .
C1 C2 C3 C4 -5(5) . .
C2 C3 C4 C5 4(4) . .
C3 C4 C5 N1 -3(4) . .
C3 C4 C5 C7 174(2) . .
C1 N1 C5 C4 3(3) . .
Dy1 N1 C5 C4 175.0(19) . .
C1 N1 C5 C7 -174.7(16) . .
Dy1 N1 C5 C7 -3(2) . .
Sr3 O2 C6 O1 -51(6) 1_556 .
Sr3 O2 C6 C1 130(5) 1_556 .
Dy1 O1 C6 O2 177.0(15) . .
Dy1 O1 C6 C1 -4(2) . .
N1 C1 C6 O2 174.9(18) . .
C2 C1 C6 O2 1(3) . .
N1 C1 C6 O1 -4(3) . .
C2 C1 C6 O1 -179(2) . .
Dy1 O3 C7 O4 172.3(13) . .
Dy1 O3 C7 C5 -9(2) . .
Dy2 O4 C7 O3 -91(4) . .
Dy2 O4 C7 C5 89(4) . .
C4 C5 C7 O3 -170(2) . .
N1 C5 C7 O3 7(3) . .
C4 C5 C7 O4 9(3) . .
N1 C5 C7 O4 -173.6(16) . .
C12 N2 C8 C9 5(4) . .
Dy1 N2 C8 C9 -176(2) . .
C12 N2 C8 C13 175(2) . .
Dy1 N2 C8 C13 -6(3) . .
N2 C8 C9 C10 -4(5) . .
C13 C8 C9 C10 -173(3) . .
C8 C9 C10 C11 -5(5) . .
C9 C10 C11 C12 13(5) . .
C8 N2 C12 C11 2(3) . .
Dy1 N2 C12 C11 -176.4(16) . .
C8 N2 C12 C14 177(2) . .
Dy1 N2 C12 C14 -1(3) . .
C10 C11 C12 N2 -12(4) . .
C10 C11 C12 C14 174(3) . .
Dy1 O5 C13 O6 -160.7(19) . .
Dy1 O5 C13 C8 14(3) . .
N2 C8 C13 O5 -5(3) . .
C9 C8 C13 O5 165(3) . .
N2 C8 C13 O6 170(2) . .
C9 C8 C13 O6 -20(4) . .
Sr1 O8 C14 O7 -33(4) 2_666 .
Sr1 O8 C14 C12 140.3(19) 2_666 .
Dy1 O7 C14 O8 -178.0(17) . .
Dy1 O7 C14 C12 8(2) . .
N2 C12 C14 O8 -179(2) . .
C11 C12 C14 O8 -4(3) . .
N2 C12 C14 O7 -4(3) . .
C11 C12 C14 O7 170(2) . .
C19 N3 C15 C16 12(2) . .
Dy1 N3 C15 C16 175.7(13) . .
C19 N3 C15 C20 -172.5(15) . .
Dy1 N3 C15 C20 -8.7(19) . .
N3 C15 C16 C17 -7(3) . .
C20 C15 C16 C17 177.2(19) . .
C15 C16 C17 C18 2(3) . .
C16 C17 C18 C19 0(3) . .
C15 N3 C19 C18 -11(3) . .
Dy1 N3 C19 C18 -173.4(14) . .
C15 N3 C19 C21 177.7(14) . .
Dy1 N3 C19 C21 15(2) . .
C17 C18 C19 N3 5(3) . .
C17 C18 C19 C21 175.8(18) . .
Dy1 O9 C20 O10 172.1(15) . .
Dy1 O9 C20 C15 -4(2) . .
N3 C15 C20 O9 8(3) . .
C16 C15 C20 O9 -176.0(18) . .
N3 C15 C20 O10 -167.4(17) . .
C16 C15 C20 O10 8(3) . .
Sr3 O12 C21 O11 9.3(17) 2_655 .
Sr3 O12 C21 C19 -169.5(14) 2_655 .
Dy1 O11 C21 O12 178.3(11) . .
Sr3 O11 C21 O12 -8.3(15) 2_655 .
Dy1 O11 C21 C19 -2.8(19) . .
Sr3 O11 C21 C19 170.6(13) 2_655 .
Dy1 O11 C21 Sr3 -173.4(10) . 2_655
N3 C19 C21 O12 170.8(16) . .
C18 C19 C21 O12 -1(3) . .
N3 C19 C21 O11 -8(2) . .
C18 C19 C21 O11 179.8(16) . .
N3 C19 C21 Sr3 90(8) . 2_655
C18 C19 C21 Sr3 -82(8) . 2_655
C26 N4 C22 C23 -4(3) . .
Dy2 N4 C22 C23 -177.2(16) . .
C26 N4 C22 C27 178.8(19) . .
Dy2 N4 C22 C27 6(2) . .
N4 C22 C23 C24 4(3) . .
C27 C22 C23 C24 -179(2) . .
C22 C23 C24 C25 -4(4) . .
C23 C24 C25 C26 4(4) . .
C24 C25 C26 N4 -4(4) . .
C24 C25 C26 C28 179(3) . .
C22 N4 C26 C25 4(3) . .
Dy2 N4 C26 C25 176.9(17) . .
C22 N4 C26 C28 -179.0(19) . .
Dy2 N4 C26 C28 -6(2) . .
Sr1 O14 C27 O13 22(2) . .
Sr1 O14 C27 C22 -149.2(16) . .
Dy2 O13 C27 O14 171.2(16) . .
Sr1 O13 C27 O14 -20(2) . .
Dy2 O13 C27 C22 -17(2) . .
Sr1 O13 C27 C22 151.8(17) . .
N4 C22 C27 O14 179.3(19) . .
C23 C22 C27 O14 2(3) . .
N4 C22 C27 O13 7(3) . .
C23 C22 C27 O13 -170(2) . .
Dy2 O15 C28 O16 -177.9(18) . .
Dy2 O15 C28 C26 2(3) . .
C25 C26 C28 O16 0(4) . .
N4 C26 C28 O16 -177(2) . .
C25 C26 C28 O15 180(2) . .
N4 C26 C28 O15 3(3) . .
C33 N5 C29 C30 -7(3) . .
Dy2 N5 C29 C30 -178.1(17) . .
C33 N5 C29 C34 178.4(17) . .
Dy2 N5 C29 C34 7(2) . .
N5 C29 C30 C31 9(3) . .
C34 C29 C30 C31 -177(2) . .
C29 C30 C31 C32 -5(4) . .
C30 C31 C32 C33 0(4) . .
C31 C32 C33 N5 3(4) . .
C31 C32 C33 C35 177(2) . .
C29 N5 C33 C32 1(3) . .
Dy2 N5 C33 C32 171.9(17) . .
C29 N5 C33 C35 -174.3(17) . .
Dy2 N5 C33 C35 -3(2) . .
Dy2 O17 C34 O18 171.9(16) . .
Dy2 O17 C34 C29 -4(2) . .
N5 C29 C34 O18 -179(2) . .
C30 C29 C34 O18 6(3) . .
N5 C29 C34 O17 -3(3) . .
C30 C29 C34 O17 -177.7(19) . .
Dy2 O19 C35 O20 -177.8(16) . .
Sr3 O19 C35 O20 -21(2) 2_655 .
Dy2 O19 C35 C33 2(3) . .
Sr3 O19 C35 C33 158.5(16) 2_655 .
Dy2 O19 C35 Sr3 -156.8(13) . 2_655
Sr2 O20 C35 O19 -112(3) 2_655 .
Sr3 O20 C35 O19 22(2) 2_655 .
Sr2 O20 C35 C33 69(3) 2_655 .
Sr3 O20 C35 C33 -157.8(16) 2_655 .
Sr2 O20 C35 Sr3 -133(3) 2_655 2_655
C32 C33 C35 O19 -174(2) . .
N5 C33 C35 O19 1(3) . .
C32 C33 C35 O20 5(3) . .
N5 C33 C35 O20 -179.3(18) . .
C32 C33 C35 Sr3 -81(5) . 2_655
N5 C33 C35 Sr3 94(4) . 2_655
C40 N6 C36 C37 9(3) . .
Dy3 N6 C36 C37 -173.5(17) . .
C40 N6 C36 C41 -175.1(18) . .
Dy3 N6 C36 C41 3(2) . .
N6 C36 C37 C38 -8(4) . .
C41 C36 C37 C38 176(2) . .
C36 C37 C38 C39 7(4) . .
C37 C38 C39 C40 -7(4) . .
C36 N6 C40 C39 -9(3) . .
Dy3 N6 C40 C39 173.1(17) . .
C36 N6 C40 C42 -178.8(19) . .
Dy3 N6 C40 C42 4(2) . .
C38 C39 C40 N6 8(4) . .
C38 C39 C40 C42 177(2) . .
Dy3 O21 C41 O22 -174.8(13) . .
Dy3 O21 C41 C36 -3(3) . .
Dy2 O22 C41 O21 -106(2) . .
Dy2 O22 C41 C36 82(3) . .
N6 C36 C41 O21 0(3) . .
C37 C36 C41 O21 176(2) . .
N6 C36 C41 O22 172.3(18) . .
C37 C36 C41 O22 -12(3) . .
Dy3 O23 C42 O24 173.7(19) . .
Dy3 O23 C42 C40 1(3) . .
Sr1 O24 C42 O23 -95(9) 2_665 .
Sr1 O24 C42 C40 78(8) 2_665 .
N6 C40 C42 O23 -3(3) . .
C39 C40 C42 O23 -172(2) . .
N6 C40 C42 O24 -176.9(19) . .
C39 C40 C42 O24 14(3) . .
C47 N7 C43 C44 14(3) . .
Dy3 N7 C43 C44 -167.8(15) . .
C47 N7 C43 C48 169.7(17) . .
Dy3 N7 C43 C48 -12(3) . .
N7 C43 C44 C45 -18(3) . .
C48 C43 C44 C45 -176(2) . .
C43 C44 C45 C46 7(4) . .
C44 C45 C46 C47 7(4) . .
C45 C46 C47 C49 179(2) . .
C45 C46 C47 N7 -12(4) . .
C43 N7 C47 C46 2(3) . .
Dy3 N7 C47 C46 -176.5(18) . .
C43 N7 C47 C49 171.7(19) . .
Dy3 N7 C47 C49 -7(2) . .
Sr1 O26 C48 O25 2(2) . .
Sr1 O26 C48 C43 -163.2(18) . .
Dy3 O25 C48 O26 171.6(13) . .
Sr1 O25 C48 O26 -2.0(19) . .
Dy3 O25 C48 C43 -20.3(19) . .
Sr1 O25 C48 C43 166.0(12) . .
N7 C43 C48 O26 -172(2) . .
C44 C43 C48 O26 -12(3) . .
N7 C43 C48 O25 21(3) . .
C44 C43 C48 O25 -179.5(16) . .
Sr2 O28 C49 O27 -37(2) . .
Sr2 O28 C49 C47 140.1(16) . .
Dy3 O27 C49 O28 173.8(13) . .
Sr2 O27 C49 O28 31.0(18) . .
Dy3 O27 C49 C47 -4(2) . .
Sr2 O27 C49 C47 -146.7(16) . .
C46 C47 C49 O28 -2(3) . .
N7 C47 C49 O28 -171.1(18) . .
C46 C47 C49 O27 176(2) . .
N7 C47 C49 O27 7(2) . .
C54 N8 C50 C51 -4(3) . .
Dy3 N8 C50 C51 177.2(18) . .
C54 N8 C50 C55 176.6(19) . .
Dy3 N8 C50 C55 -2(2) . .
N8 C50 C51 C52 3(4) . .
C55 C50 C51 C52 -178(2) . .
C50 C51 C52 C53 0(4) . .
C51 C52 C53 C54 0(3) . .
C50 N8 C54 C53 3(3) . .
Dy3 N8 C54 C53 -178.1(15) . .
C50 N8 C54 C56 -176.0(18) . .
Dy3 N8 C54 C56 3(2) . .
C52 C53 C54 N8 -1(3) . .
C52 C53 C54 C56 178.1(19) . .
Dy3 O29 C55 O30 173(2) . .
Dy3 O29 C55 C50 7(3) . .
N8 C50 C55 O29 -3(3) . .
C51 C50 C55 O29 178(2) . .
N8 C50 C55 O30 -171(2) . .
C51 C50 C55 O30 10(4) . .
Sr3 O32 C56 O31 -58(3) . .
Sr3 O32 C56 C54 123.6(18) . .
Dy3 O31 C56 O32 173.7(16) . .
Dy3 O31 C56 C54 -7(2) . .
N8 C54 C56 O32 -178.4(19) . .
C53 C54 C56 O32 2(3) . .
N8 C54 C56 O31 3(3) . .
C53 C54 C56 O31 -176.6(18) . .
loop_
_platon_squeeze_void_nr
_platon_squeeze_void_average_x
_platon_squeeze_void_average_y
_platon_squeeze_void_average_z
_platon_squeeze_void_volume
_platon_squeeze_void_count_electrons
1 0.000 0.000 0.000 632.5 113.5
