#------------------------------------------------------------------------------
#$Date: 2016-02-16 03:10:39 +0200 (Tue, 16 Feb 2016) $
#$Revision: 176453 $
#$URL: svn://www.crystallography.net/cod/cif/7/20/77/7207753.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_7207753
loop_
_publ_author_name
'Shi, Dong-Ying'
'Zhao, Jun-Wei'
'Chen, Li-Juan'
'Ma, Peng-Tao'
'Wang, Jing-Ping'
'Niu, Jing-Yang'
_publ_section_title
;
 Four types of 1D or 2D organic--inorganic hybrids assembled by
 arsenotungstates and CuII--LnIII/IV heterometals
;
_journal_issue                   9
_journal_name_full               CrystEngComm
_journal_page_first              3108
_journal_paper_doi               10.1039/c2ce06354a
_journal_volume                  14
_journal_year                    2012
_chemical_formula_sum            'C33 H120 As2 Cu5.5 Dy N22 O83 W22'
_chemical_formula_weight         6860.02
_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                102.355(5)
_cell_angle_beta                 104.331(5)
_cell_angle_gamma                98.656(5)
_cell_formula_units_Z            2
_cell_length_a                   13.623(5)
_cell_length_b                   20.217(7)
_cell_length_c                   24.846(8)
_cell_measurement_reflns_used    22023
_cell_measurement_temperature    296(2)
_cell_measurement_theta_max      25.00
_cell_measurement_theta_min      1.58
_cell_volume                     6325(4)
_computing_cell_refinement       'Bruker XSCANS'
_computing_data_collection       'Bruker XSCANS'
_computing_data_reduction        'Bruker SHELXTL'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      296(2)
_diffrn_detector_area_resol_mean none
_diffrn_measured_fraction_theta_full 0.989
_diffrn_measured_fraction_theta_max 0.989
_diffrn_measurement_device_type  'Bruker P4'
_diffrn_measurement_method       '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  0.0320
_diffrn_reflns_av_sigmaI/netI    0.0624
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       24
_diffrn_reflns_limit_k_min       -23
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_limit_l_min       -29
_diffrn_reflns_number            32332
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.00
_diffrn_reflns_theta_min         1.58
_diffrn_standards_decay_%        none
_diffrn_standards_interval_count none
_diffrn_standards_interval_time  none
_diffrn_standards_number         none
_exptl_absorpt_coefficient_mu    22.012
_exptl_absorpt_correction_T_max  0.1369
_exptl_absorpt_correction_T_min  0.0808
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            purple
_exptl_crystal_density_diffrn    3.602
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             6111
_exptl_crystal_size_max          0.23
_exptl_crystal_size_mid          0.17
_exptl_crystal_size_min          0.15
_refine_diff_density_max         4.704
_refine_diff_density_min         -3.362
_refine_diff_density_rms         0.323
_refine_ls_extinction_coef       0.000053(7)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.043
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1293
_refine_ls_number_reflns         22023
_refine_ls_number_restraints     12
_refine_ls_restrained_S_all      1.043
_refine_ls_R_factor_all          0.0642
_refine_ls_R_factor_gt           0.0441
_refine_ls_shift/su_max          0.008
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0558P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1084
_refine_ls_wR_factor_ref         0.1159
_reflns_number_gt                16567
_reflns_number_total             22023
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c2ce06354a.txt
_cod_data_source_block           10
_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 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_values 1715 2011-07-08 13:25:40Z adriana 
;
_cod_original_sg_symbol_H-M      P-1
_cod_original_formula_sum        'C33 H120 As2 Cu5.50 Dy N22 O83 W22'
_cod_database_code               7207753
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
W1 W 1.47485(5) 1.47722(3) 0.12604(3) 0.02985(15) Uani 1 1 d .
W2 W 1.45772(5) 1.58270(3) 0.24958(3) 0.02832(15) Uani 1 1 d .
W3 W 1.28356(5) 1.57189(3) 0.11851(3) 0.02539(14) Uani 1 1 d .
W4 W 1.08288(5) 1.40708(3) 0.03938(3) 0.02854(15) Uani 1 1 d .
W5 W 1.27523(5) 1.31497(3) 0.04828(3) 0.03132(16) Uani 1 1 d .
W6 W 1.45884(5) 1.32493(3) 0.19333(3) 0.02720(15) Uani 1 1 d .
W7 W 1.43953(4) 1.42876(3) 0.31533(2) 0.02501(14) Uani 1 1 d .
W8 W 1.23240(5) 1.53527(3) 0.30442(3) 0.02746(14) Uani 1 1 d .
W9 W 1.05956(5) 1.52139(3) 0.17414(3) 0.02684(14) Uani 1 1 d .
W10 W 1.05451(4) 1.38047(3) 0.23581(3) 0.02512(14) Uani 1 1 d .
W11 W 1.07679(5) 1.26870(3) 0.10444(2) 0.02740(14) Uani 1 1 d .
W12 W 1.39446(4) 1.14202(3) 0.35702(2) 0.02246(13) Uani 1 1 d .
W13 W 1.21320(5) 1.21399(3) 0.40397(2) 0.02456(14) Uani 1 1 d .
W14 W 0.93077(5) 1.12474(3) 0.34425(3) 0.02969(15) Uani 1 1 d .
W15 W 0.95468(5) 1.12630(3) 0.20974(3) 0.02607(14) Uani 1 1 d .
W16 W 1.15333(5) 1.04733(3) 0.16018(2) 0.02505(14) Uani 1 1 d .
W17 W 1.31190(5) 0.96868(3) 0.24551(3) 0.02812(15) Uani 1 1 d .
W18 W 1.29420(5) 0.97442(3) 0.39362(3) 0.02933(15) Uani 1 1 d .
W19 W 1.11150(5) 1.04852(3) 0.44023(3) 0.03029(15) Uani 1 1 d .
W20 W 1.03504(5) 0.89427(3) 0.33488(3) 0.03488(16) Uani 1 1 d .
W21 W 0.85299(5) 0.97160(4) 0.23818(3) 0.03357(16) Uani 1 1 d .
W22 W 1.05364(5) 0.89095(3) 0.18655(3) 0.03278(16) Uani 1 1 d .
Dy1 Dy 1.24673(5) 1.24776(3) 0.25815(3) 0.02254(15) Uani 1 1 d .
As1 As 1.26683(10) 1.42469(7) 0.18041(6) 0.0198(3) Uani 1 1 d .
As2 As 1.13065(11) 1.05258(7) 0.30062(6) 0.0215(3) Uani 1 1 d .
O1W O 0.4923(12) 0.3916(9) 0.9689(7) 0.086(5) Uiso 1 1 d .
O2W O 0.2897(16) 0.5107(11) 0.7207(8) 0.123(7) Uiso 1 1 d .
O3W O 0.2583(18) 0.3732(12) 0.6404(9) 0.142(8) Uiso 1 1 d .
O4W O 0.437(2) 1.1459(16) 0.5235(12) 0.200(12) Uiso 1 1 d .
O5W O 0.509(3) 0.7447(19) 1.0518(15) 0.101(11) Uiso 0.50 1 d P
O6W O 1.454(4) 1.203(2) 0.8251(19) 0.142(16) Uiso 0.50 1 d P
O1 O 1.5720(8) 1.4846(6) 0.0935(5) 0.038(3) Uani 1 1 d .
O2 O 1.3709(8) 1.4039(5) 0.0684(4) 0.032(2) Uani 1 1 d .
O3 O 1.5037(8) 1.4155(5) 0.1687(4) 0.033(2) Uani 1 1 d .
O4 O 1.3992(8) 1.5430(5) 0.0938(4) 0.034(3) Uani 1 1 d .
O5 O 1.3432(7) 1.4917(5) 0.1707(4) 0.026(2) Uani 1 1 d .
O6 O 1.5343(7) 1.5544(5) 0.1956(4) 0.032(2) Uani 1 1 d .
O7 O 1.5448(8) 1.6550(6) 0.2963(5) 0.041(3) Uani 1 1 d .
O8 O 1.4844(8) 1.5117(5) 0.2829(4) 0.033(2) Uani 1 1 d .
O9 O 1.3380(7) 1.5807(5) 0.2774(4) 0.030(2) Uani 1 1 d .
O10 O 1.3828(7) 1.6255(5) 0.1905(5) 0.035(3) Uani 1 1 d .
O11 O 1.2650(8) 1.6380(5) 0.0859(5) 0.037(3) Uani 1 1 d .
O12 O 1.1794(7) 1.5699(5) 0.1577(4) 0.026(2) Uani 1 1 d .
O13 O 1.1947(8) 1.4910(5) 0.0633(4) 0.030(2) Uani 1 1 d .
O14 O 1.0007(9) 1.4174(6) -0.0213(5) 0.046(3) Uani 1 1 d .
O15 O 1.1994(7) 1.3724(5) 0.1154(4) 0.023(2) Uani 1 1 d .
O16 O 1.0393(8) 1.4586(5) 0.1015(4) 0.035(2) Uiso 1 1 d .
O17 O 1.0151(7) 1.3239(5) 0.0473(4) 0.034(2) Uani 1 1 d .
O18 O 1.1743(9) 1.3581(5) 0.0059(4) 0.037(3) Uani 1 1 d .
O19 O 1.3127(10) 1.2683(6) -0.0066(5) 0.052(3) Uani 1 1 d .
O20 O 1.1634(9) 1.2509(5) 0.0519(4) 0.034(3) Uani 1 1 d .
O21 O 1.3654(8) 1.3010(5) 0.1161(4) 0.029(2) Uani 1 1 d .
O22 O 1.5634(9) 1.2880(6) 0.1847(5) 0.046(3) Uani 1 1 d .
O23 O 1.3858(8) 1.2611(5) 0.2158(4) 0.030(2) Uani 1 1 d .
O24 O 1.3384(7) 1.3834(5) 0.2210(4) 0.024(2) Uani 1 1 d .
O25 O 1.5234(7) 1.3842(5) 0.2716(4) 0.032(2) Uani 1 1 d .
O26 O 1.5285(8) 1.4596(5) 0.3830(5) 0.040(3) Uani 1 1 d .
O27 O 1.3722(8) 1.3497(5) 0.3208(4) 0.031(2) Uani 1 1 d .
O28 O 1.3297(8) 1.4778(5) 0.3245(4) 0.029(2) Uani 1 1 d .
O29 O 1.2461(9) 1.5909(6) 0.3698(5) 0.047(3) Uani 1 1 d .
O30 O 1.1819(7) 1.4560(4) 0.2121(4) 0.021(2) Uani 1 1 d .
O31 O 1.1199(8) 1.4640(5) 0.3012(4) 0.032(2) Uani 1 1 d .
O32 O 1.1316(8) 1.5707(5) 0.2544(4) 0.037(3) Uani 1 1 d .
O33 O 0.9674(8) 1.5711(6) 0.1575(5) 0.038(3) Uani 1 1 d .
O34 O 0.9905(8) 1.4541(5) 0.1999(4) 0.032(2) Uani 1 1 d .
O35 O 0.9482(8) 1.3485(6) 0.2548(5) 0.038(3) Uani 1 1 d .
O36 O 1.1514(8) 1.3352(5) 0.2612(4) 0.030(2) Uani 1 1 d .
O37 O 1.0252(7) 1.3302(5) 0.1572(4) 0.025(2) Uani 1 1 d .
O38 O 1.1659(9) 1.2515(6) 0.1624(4) 0.040(3) Uani 1 1 d .
O39 O 0.9804(8) 1.1941(6) 0.0750(5) 0.044(3) Uani 1 1 d .
O40 O 1.3842(7) 1.2012(5) 0.3126(4) 0.023(2) Uani 1 1 d .
O41 O 1.5269(8) 1.1585(5) 0.3874(4) 0.033(2) Uani 1 1 d .
O42 O 1.3577(8) 1.0630(5) 0.3960(4) 0.031(2) Uani 1 1 d .
O43 O 1.3721(7) 1.0607(5) 0.2933(4) 0.029(2) Uani 1 1 d .
O44 O 1.2165(7) 1.1279(5) 0.3274(4) 0.027(2) Uani 1 1 d .
O45 O 1.3548(7) 1.1992(5) 0.4181(4) 0.031(2) Uani 1 1 d .
O46 O 1.2314(9) 1.2783(6) 0.4665(4) 0.042(3) Uani 1 1 d .
O47 O 1.2246(7) 1.2622(5) 0.3525(4) 0.025(2) Uani 1 1 d .
O48 O 1.1871(7) 1.1313(5) 0.4384(4) 0.025(2) Uani 1 1 d .
O49 O 1.0620(7) 1.1871(5) 0.3732(4) 0.028(2) Uani 1 1 d .
O50 O 0.8558(9) 1.1654(7) 0.3812(5) 0.051(3) Uani 1 1 d .
O51 O 0.9876(7) 1.0709(6) 0.3962(4) 0.034(3) Uani 1 1 d .
O52 O 0.8309(7) 1.0379(5) 0.3013(4) 0.032(2) Uani 1 1 d .
O53 O 1.0086(7) 1.0644(5) 0.2810(4) 0.023(2) Uani 1 1 d .
O54 O 0.9001(7) 1.1562(5) 0.2762(4) 0.031(2) Uani 1 1 d .
O55 O 1.0717(7) 1.1884(6) 0.2419(4) 0.035(3) Uani 1 1 d .
O56 O 0.8776(8) 1.1601(6) 0.1602(5) 0.043(3) Uani 1 1 d .
O57 O 0.8433(7) 1.0359(5) 0.1948(4) 0.033(2) Uani 1 1 d .
O58 O 1.0199(7) 1.0661(5) 0.1660(4) 0.029(2) Uani 1 1 d .
O59 O 1.1518(8) 1.0536(6) 0.0911(4) 0.038(3) Uani 1 1 d .
O60 O 1.2227(8) 1.1290(5) 0.2050(4) 0.029(2) Uani 1 1 d .
O61 O 1.1535(7) 1.0053(5) 0.2433(4) 0.022(2) Uani 1 1 d .
O62 O 1.2752(8) 1.0035(5) 0.1793(4) 0.028(2) Uani 1 1 d .
O63 O 1.4184(9) 0.9367(6) 0.2356(5) 0.042(3) Uani 1 1 d .
O64 O 1.2023(8) 0.8874(5) 0.2032(4) 0.036(3) Uani 1 1 d .
O65 O 1.3031(7) 0.9461(5) 0.3159(4) 0.028(2) Uani 1 1 d .
O66 O 1.3942(8) 0.9434(6) 0.4321(5) 0.043(3) Uani 1 1 d .
O67 O 1.1790(8) 0.8935(6) 0.3711(4) 0.038(3) Uani 1 1 d .
O68 O 1.1380(7) 1.0067(5) 0.3494(4) 0.027(2) Uani 1 1 d .
O69 O 1.2356(8) 1.0098(6) 0.4553(4) 0.034(3) Uani 1 1 d .
O70 O 1.0949(9) 1.0677(6) 0.5076(4) 0.046(3) Uani 1 1 d .
O71 O 1.0373(8) 0.9513(5) 0.4087(4) 0.037(3) Uani 1 1 d .
O72 O 0.9741(9) 0.8147(6) 0.3365(5) 0.055(3) Uani 1 1 d .
O73 O 1.0625(8) 0.8761(5) 0.2625(5) 0.035(3) Uani 1 1 d .
O74 O 0.9255(8) 0.9314(6) 0.2978(5) 0.042(3) Uani 1 1 d .
O75 O 0.7327(8) 0.9166(6) 0.2106(5) 0.052(3) Uani 1 1 d .
O76 O 0.9353(8) 0.9263(5) 0.1945(4) 0.035(3) Uani 1 1 d .
O77 O 0.9979(9) 0.8092(5) 0.1408(5) 0.048(3) Uani 1 1 d .
O78 O 1.0746(8) 0.9428(5) 0.1355(4) 0.038(3) Uani 1 1 d .
Cu1 Cu 1.0000 1.0000 0.0000 0.0349(6) Uani 1 2 d S
Cu2 Cu 1.76587(16) 1.52536(11) 0.12425(9) 0.0418(5) Uani 1 1 d .
Cu3 Cu 1.24140(19) 0.76412(12) 0.15682(11) 0.0587(6) Uani 1 1 d .
Cu4 Cu 1.61782(17) 1.19643(13) 0.23211(11) 0.0540(6) Uani 1 1 d .
Cu5 Cu 1.3232(2) 1.39335(12) 0.48676(10) 0.0665(7) Uani 1 1 d .
Cu6 Cu 1.2597(2) 0.9433(2) 0.54714(14) 0.0929(11) Uani 1 1 d .
N1 N 1.0668(12) 1.0857(7) -0.0186(5) 0.048(4) Uani 1 1 d .
H1C H 1.0195 1.0993 -0.0437 0.058 Uiso 1 1 calc R
H1D H 1.0941 1.1207 0.0136 0.058 Uiso 1 1 calc R
N2 N 1.1077(13) 0.9593(9) -0.0294(7) 0.072(5) Uani 1 1 d .
H2B H 1.1327 0.9330 -0.0066 0.086 Uiso 1 1 calc R
H2C H 1.0761 0.9308 -0.0648 0.086 Uiso 1 1 calc R
N3 N 1.7527(14) 1.6088(9) 0.0921(8) 0.069(5) Uani 1 1 d .
H3D H 1.7965 1.6133 0.0707 0.083 Uiso 1 1 calc R
H3E H 1.6876 1.6034 0.0696 0.083 Uiso 1 1 calc R
N4 N 1.7655(12) 1.5898(8) 0.1986(6) 0.057(4) Uani 1 1 d D
H4C H 1.7164 1.5704 0.2123 0.069 Uiso 1 1 calc R
H4D H 1.8274 1.5975 0.2251 0.069 Uiso 1 1 calc R
N5 N 1.7769(13) 1.4652(8) 0.0506(7) 0.059(4) Uani 1 1 d .
H5B H 1.7227 1.4645 0.0210 0.070 Uiso 1 1 calc R
H5C H 1.8355 1.4829 0.0434 0.070 Uiso 1 1 calc R
N6 N 1.7630(10) 1.4373(7) 0.1518(6) 0.042(4) Uani 1 1 d .
H6D H 1.8266 1.4376 0.1737 0.051 Uiso 1 1 calc R
H6E H 1.7187 1.4350 0.1731 0.051 Uiso 1 1 calc R
N7 N 1.1459(17) 0.7185(9) 0.1922(10) 0.098(7) Uani 1 1 d .
H7C H 1.0850 0.7317 0.1832 0.117 Uiso 1 1 calc R
H7D H 1.1339 0.6722 0.1779 0.117 Uiso 1 1 calc R
N8 N 1.3507(16) 0.7737(10) 0.2306(8) 0.086(6) Uani 1 1 d .
H8B H 1.4032 0.7547 0.2234 0.103 Uiso 1 1 calc R
H8C H 1.3761 0.8188 0.2494 0.103 Uiso 1 1 calc R
N9 N 1.1391(13) 0.7500(8) 0.0809(8) 0.083(6) Uani 1 1 d .
H9D H 1.1307 0.7066 0.0591 0.100 Uiso 1 1 calc R
H9E H 1.0773 0.7561 0.0855 0.100 Uiso 1 1 calc R
N10 N 1.3366(14) 0.8150(10) 0.1229(6) 0.070(5) Uani 1 1 d .
H10C H 1.3546 0.8601 0.1421 0.084 Uiso 1 1 calc R
H10D H 1.3948 0.7982 0.1267 0.084 Uiso 1 1 calc R
N11 N 1.7605(10) 1.2527(8) 0.2633(8) 0.066(5) Uani 1 1 d .
H11B H 1.8053 1.2247 0.2692 0.080 Uiso 1 1 calc R
H11C H 1.7752 1.2747 0.2374 0.080 Uiso 1 1 calc R
N12 N 1.5977(11) 1.2473(9) 0.3059(7) 0.064(5) Uani 1 1 d .
H12D H 1.5585 1.2785 0.2995 0.077 Uiso 1 1 calc R
H12E H 1.5660 1.2175 0.3216 0.077 Uiso 1 1 calc R
N13 N 1.4736(12) 1.1346(9) 0.2016(7) 0.063(5) Uani 1 1 d .
H13C H 1.4670 1.1053 0.2238 0.076 Uiso 1 1 calc R
H13D H 1.4261 1.1609 0.2035 0.076 Uiso 1 1 calc R
N14 N 1.6359(12) 1.1406(8) 0.1586(6) 0.051 Uiso 1 1 d .
H14B H 1.6282 1.1643 0.1315 0.061 Uiso 1 1 calc R
H14C H 1.6992 1.1304 0.1650 0.061 Uiso 1 1 calc R
N15 N 1.4134(17) 1.3830(9) 0.5611(7) 0.107(9) Uani 1 1 d D
H15D H 1.4501 1.4251 0.5832 0.129 Uiso 1 1 calc R
H15E H 1.3728 1.3653 0.5804 0.129 Uiso 1 1 calc R
N16 N 1.4382(13) 1.3640(10) 0.4559(7) 0.071(5) Uani 1 1 d .
H16C H 1.4163 1.3202 0.4334 0.085 Uiso 1 1 calc R
H16D H 1.4556 1.3918 0.4344 0.085 Uiso 1 1 calc R
N17 N 1.2385(14) 1.4067(9) 0.4148(7) 0.067(5) Uani 1 1 d .
H17B H 1.2751 1.4401 0.4043 0.081 Uiso 1 1 calc R
H17C H 1.2230 1.3672 0.3866 0.081 Uiso 1 1 calc R
N18 N 1.2379(14) 1.4406(10) 0.5248(8) 0.080 Uiso 1 1 d .
H18D H 1.2077 1.4129 0.5427 0.096 Uiso 1 1 calc R
H18E H 1.2776 1.4788 0.5516 0.096 Uiso 1 1 calc R
N19 N 1.1169(12) 0.8882(8) 0.5082(7) 0.061(4) Uiso 1 1 d D
H19C H 1.0829 0.8862 0.5347 0.073 Uiso 1 1 calc R
H19D H 1.0838 0.9101 0.4837 0.073 Uiso 1 1 calc R
N20 N 1.3031(16) 0.8568(10) 0.5105(9) 0.107(7) Uiso 1 1 d D
H20B H 1.3176 0.8607 0.4778 0.128 Uiso 1 1 calc R
H20C H 1.3599 0.8504 0.5347 0.128 Uiso 1 1 calc R
N21 N 1.4049(14) 0.9885(10) 0.5813(8) 0.079 Uiso 1 1 d D
H21D H 1.4403 0.9623 0.6005 0.095 Uiso 1 1 calc R
H21E H 1.4347 0.9977 0.5544 0.095 Uiso 1 1 calc R
N22 N 1.2168(16) 1.0187(11) 0.5972(8) 0.089 Uiso 1 1 d .
H22C H 1.1619 1.0311 0.5765 0.107 Uiso 1 1 calc R
H22D H 1.1992 1.0040 0.6260 0.107 Uiso 1 1 calc R
C1 C 1.151(2) 1.0658(12) -0.0444(11) 0.088 Uiso 1 1 d D
H1A H 1.1259 1.0585 -0.0858 0.106 Uiso 1 1 calc R
H1B H 1.2102 1.1047 -0.0301 0.106 Uiso 1 1 calc R
C2 C 1.188(2) 1.0031(12) -0.0329(11) 0.082 Uiso 1 1 d D
H2A H 1.2237 1.0216 0.0083 0.098 Uiso 1 1 calc R
C3 C 1.2733(18) 1.0109(13) -0.0540(10) 0.080 Uiso 1 1 d .
H3A H 1.3066 0.9727 -0.0512 0.120 Uiso 1 1 calc R
H3B H 1.3214 1.0535 -0.0317 0.120 Uiso 1 1 calc R
H3C H 1.2509 1.0121 -0.0935 0.120 Uiso 1 1 calc R
C4 C 1.778(2) 1.6714(13) 0.1407(10) 0.083 Uiso 1 1 d .
H4A H 1.8525 1.6894 0.1536 0.100 Uiso 1 1 calc R
H4B H 1.7450 1.7068 0.1279 0.100 Uiso 1 1 calc R
C5 C 1.744(2) 1.6562(10) 0.1873(11) 0.085 Uiso 1 1 d D
H5A H 1.6687 1.6458 0.1717 0.103 Uiso 1 1 calc R
C6 C 1.763(2) 1.7103(13) 0.2370(10) 0.088 Uiso 1 1 d .
H6A H 1.7464 1.7511 0.2262 0.131 Uiso 1 1 calc R
H6B H 1.8345 1.7200 0.2588 0.131 Uiso 1 1 calc R
H6C H 1.7200 1.6969 0.2599 0.131 Uiso 1 1 calc R
C7 C 1.7780(15) 1.3949(10) 0.0558(9) 0.061(6) Uani 1 1 d .
H7A H 1.8492 1.3894 0.0654 0.073 Uiso 1 1 calc R
H7B H 1.7410 1.3625 0.0189 0.073 Uiso 1 1 calc R
C8 C 1.730(2) 1.3765(12) 0.1009(9) 0.078(7) Uani 1 1 d .
H8A H 1.6547 1.3716 0.0849 0.094 Uiso 1 1 calc R
C9 C 1.7440(14) 1.3064(9) 0.1140(8) 0.050(5) Uani 1 1 d .
H9A H 1.7119 1.2992 0.1432 0.075 Uiso 1 1 calc R
H9B H 1.8167 1.3071 0.1273 0.075 Uiso 1 1 calc R
H9C H 1.7124 1.2695 0.0796 0.075 Uiso 1 1 calc R
C10 C 1.1878(18) 0.7357(15) 0.2534(12) 0.097 Uiso 1 1 d D
H10A H 1.1552 0.7012 0.2689 0.117 Uiso 1 1 calc R
H10B H 1.1763 0.7806 0.2707 0.117 Uiso 1 1 calc R
C11 C 1.3010(19) 0.7376(17) 0.2654(13) 0.114(10) Uiso 1 1 d D
H11A H 1.3075 0.6892 0.2544 0.136 Uiso 1 1 calc R
C12 C 1.352(3) 0.7628(18) 0.3263(14) 0.144(13) Uiso 1 1 d .
H12A H 1.4252 0.7652 0.3333 0.216 Uiso 1 1 calc R
H12B H 1.3246 0.7318 0.3460 0.216 Uiso 1 1 calc R
H12C H 1.3403 0.8081 0.3402 0.216 Uiso 1 1 calc R
C13 C 1.179(2) 0.8018(16) 0.0521(12) 0.109(9) Uiso 1 1 d .
H13A H 1.1455 0.7867 0.0110 0.131 Uiso 1 1 calc R
H13B H 1.1645 0.8464 0.0670 0.131 Uiso 1 1 calc R
C14 C 1.288(2) 0.8080(14) 0.0629(11) 0.091(8) Uiso 1 1 d .
H14A H 1.2999 0.7651 0.0408 0.109 Uiso 1 1 calc R
C15 C 1.330(2) 0.8686(14) 0.0391(11) 0.102(9) Uiso 1 1 d .
H15A H 1.2935 0.8597 -0.0010 0.153 Uiso 1 1 calc R
H15B H 1.4028 0.8718 0.0435 0.153 Uiso 1 1 calc R
H15C H 1.3196 0.9113 0.0600 0.153 Uiso 1 1 calc R
C16 C 1.774(2) 1.3030(16) 0.3165(12) 0.103(9) Uiso 1 1 d .
H16A H 1.8438 1.3099 0.3410 0.124 Uiso 1 1 calc R
H16B H 1.7643 1.3469 0.3086 0.124 Uiso 1 1 calc R
C17 C 1.705(2) 1.2834(16) 0.3455(12) 0.107(9) Uiso 1 1 d .
H17A H 1.7313 1.2469 0.3611 0.129 Uiso 1 1 calc R
C18 C 1.696(3) 1.3362(19) 0.3989(15) 0.160(14) Uiso 1 1 d .
H18A H 1.7648 1.3584 0.4239 0.240 Uiso 1 1 calc R
H18B H 1.6581 1.3123 0.4193 0.240 Uiso 1 1 calc R
H18C H 1.6614 1.3705 0.3866 0.240 Uiso 1 1 calc R
C19 C 1.453(2) 1.0931(14) 0.1394(10) 0.088 Uiso 1 1 d .
H19A H 1.3989 1.0519 0.1294 0.105 Uiso 1 1 calc R
H19B H 1.4346 1.1210 0.1127 0.105 Uiso 1 1 calc R
C20 C 1.5523(17) 1.0755(12) 0.1398(8) 0.072 Uiso 1 1 d D
H20A H 1.5687 1.0419 0.1620 0.087 Uiso 1 1 calc R
C21 C 1.5349(18) 1.0472(12) 0.0768(8) 0.080 Uiso 1 1 d D
H21A H 1.4808 1.0060 0.0627 0.121 Uiso 1 1 calc R
H21B H 1.5978 1.0361 0.0701 0.121 Uiso 1 1 calc R
H21C H 1.5150 1.0811 0.0570 0.121 Uiso 1 1 calc R
C22 C 1.486(2) 1.3369(15) 0.5503(12) 0.110(10) Uiso 1 1 d D
H22A H 1.4501 1.2886 0.5346 0.132 Uiso 1 1 calc R
H22B H 1.5415 1.3416 0.5848 0.132 Uiso 1 1 calc R
C23 C 1.5280(17) 1.3679(13) 0.5031(9) 0.072(6) Uiso 1 1 d .
H23A H 1.5584 1.4172 0.5212 0.086 Uiso 1 1 calc R
C24 C 1.6071(18) 1.3376(13) 0.4897(10) 0.081 Uiso 1 1 d .
H24A H 1.6302 1.3570 0.4617 0.122 Uiso 1 1 calc R
H24B H 1.5816 1.2885 0.4741 0.122 Uiso 1 1 calc R
H24C H 1.6640 1.3464 0.5238 0.122 Uiso 1 1 calc R
C25 C 1.1370(17) 1.4275(12) 0.4226(7) 0.071 Uiso 1 1 d D
H25A H 1.1181 1.4604 0.4007 0.085 Uiso 1 1 calc R
H25B H 1.0804 1.3871 0.4100 0.085 Uiso 1 1 calc R
C26 C 1.1613(15) 1.4597(12) 0.4860(7) 0.075 Uiso 1 1 d D
H26A H 1.2019 1.5046 0.4871 0.090 Uiso 1 1 calc R
C27 C 1.0632(15) 1.4828(12) 0.4894(10) 0.080 Uiso 1 1 d D
H27A H 1.0709 1.5074 0.5283 0.120 Uiso 1 1 calc R
H27B H 1.0070 1.4430 0.4775 0.120 Uiso 1 1 calc R
H27C H 1.0488 1.5126 0.4645 0.120 Uiso 1 1 calc R
C28 C 1.1126(16) 0.8160(9) 0.4756(9) 0.082 Uiso 1 1 d D
H28A H 1.0570 0.7838 0.4805 0.098 Uiso 1 1 calc R
H28B H 1.0993 0.8131 0.4349 0.098 Uiso 1 1 calc R
C29 C 1.2145(14) 0.7979(11) 0.4983(10) 0.082 Uiso 1 1 d D
H29A H 1.2155 0.7836 0.5337 0.098 Uiso 1 1 calc R
C30 C 1.268(2) 0.7515(13) 0.4627(10) 0.090 Uiso 1 1 d .
H30A H 1.3311 0.7465 0.4875 0.135 Uiso 1 1 calc R
H30B H 1.2832 0.7723 0.4336 0.135 Uiso 1 1 calc R
H30C H 1.2226 0.7067 0.4448 0.135 Uiso 1 1 calc R
C31 C 1.400(3) 1.0525(13) 0.6206(13) 0.142(12) Uiso 1 1 d D
H31A H 1.4275 1.0476 0.6591 0.170 Uiso 1 1 calc R
H31B H 1.4495 1.0891 0.6161 0.170 Uiso 1 1 calc R
C32 C 1.310(3) 1.0797(19) 0.6214(16) 0.159(14) Uiso 1 1 d D
H32A H 1.3029 1.0985 0.5877 0.191 Uiso 1 1 calc R
C33 C 1.299(3) 1.1414(18) 0.6638(15) 0.158(14) Uiso 1 1 d D
H33A H 1.3614 1.1767 0.6755 0.237 Uiso 1 1 calc R
H33B H 1.2875 1.1278 0.6968 0.237 Uiso 1 1 calc R
H33C H 1.2413 1.1592 0.6461 0.237 Uiso 1 1 calc R
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'
Cu Cu 0.3201 1.2651 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
As As 0.0499 2.0058 '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'
W W -0.8490 6.8722 '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
O1 W1 O3 104.8(4) . .
O1 W1 O2 101.0(5) . .
O3 W1 O2 89.0(4) . .
O1 W1 O6 100.4(5) . .
O3 W1 O6 90.2(4) . .
O2 W1 O6 158.0(4) . .
O1 W1 O4 97.5(4) . .
O3 W1 O4 157.6(4) . .
O2 W1 O4 87.1(4) . .
O6 W1 O4 85.4(4) . .
O1 W1 O5 167.9(4) . .
O3 W1 O5 85.4(4) . .
O2 W1 O5 85.3(4) . .
O6 W1 O5 72.7(4) . .
O4 W1 O5 72.3(4) . .
O7 W2 O8 104.2(5) . .
O7 W2 O9 103.4(5) . .
O8 W2 O9 87.1(4) . .
O7 W2 O6 100.8(5) . .
O8 W2 O6 90.9(4) . .
O9 W2 O6 155.4(4) . .
O7 W2 O10 100.2(5) . .
O8 W2 O10 155.5(4) . .
O9 W2 O10 86.1(4) . .
O6 W2 O10 85.6(4) . .
O7 W2 O5 169.2(4) . .
O8 W2 O5 84.3(4) . .
O9 W2 O5 83.4(4) . .
O6 W2 O5 72.1(4) . .
O10 W2 O5 71.5(4) . .
O11 W3 O13 104.2(5) . .
O11 W3 O12 102.5(4) . .
O13 W3 O12 86.4(4) . .
O11 W3 O10 98.9(5) . .
O13 W3 O10 157.0(4) . .
O12 W3 O10 88.3(4) . .
O11 W3 O4 101.5(4) . .
O13 W3 O4 87.9(4) . .
O12 W3 O4 156.1(4) . .
O10 W3 O4 87.9(4) . .
O11 W3 O5 169.1(4) . .
O13 W3 O5 84.5(4) . .
O12 W3 O5 84.4(3) . .
O10 W3 O5 72.6(4) . .
O4 W3 O5 71.9(3) . .
O14 W4 O17 102.8(5) . .
O14 W4 O18 100.4(5) . .
O17 W4 O18 89.7(4) . .
O14 W4 O16 103.5(5) . .
O17 W4 O16 90.2(4) . .
O18 W4 O16 155.5(4) . .
O14 W4 O13 102.9(5) . .
O17 W4 O13 154.3(4) . .
O18 W4 O13 87.1(4) . .
O16 W4 O13 82.4(4) . .
O14 W4 O15 170.0(4) . .
O17 W4 O15 71.5(4) . .
O18 W4 O15 71.7(4) . .
O16 W4 O15 85.0(4) . .
O13 W4 O15 83.3(3) . .
O19 W5 O20 102.1(5) . .
O19 W5 O21 103.1(5) . .
O20 W5 O21 91.6(4) . .
O19 W5 O2 101.5(5) . .
O20 W5 O2 156.3(4) . .
O21 W5 O2 84.7(4) . .
O19 W5 O18 101.0(5) . .
O20 W5 O18 88.0(4) . .
O21 W5 O18 155.4(4) . .
O2 W5 O18 85.9(4) . .
O19 W5 O15 171.9(5) . .
O20 W5 O15 72.0(4) . .
O21 W5 O15 82.9(3) . .
O2 W5 O15 84.4(4) . .
O18 W5 O15 73.6(4) . .
O22 W6 O23 101.7(5) . .
O22 W6 O21 103.7(5) . .
O23 W6 O21 94.5(4) . .
O22 W6 O25 98.3(5) . .
O23 W6 O25 93.9(4) . .
O21 W6 O25 154.3(4) . .
O22 W6 O3 97.1(4) . .
O23 W6 O3 161.2(4) . .
O21 W6 O3 80.2(4) . .
O25 W6 O3 84.1(4) . .
O22 W6 O24 170.0(5) . .
O23 W6 O24 78.9(4) . .
O21 W6 O24 86.2(4) . .
O25 W6 O24 71.7(4) . .
O3 W6 O24 82.7(3) . .
O26 W7 O27 101.3(5) . .
O26 W7 O28 101.7(5) . .
O27 W7 O28 94.2(4) . .
O26 W7 O25 100.7(5) . .
O27 W7 O25 93.9(4) . .
O28 W7 O25 154.1(4) . .
O26 W7 O8 97.0(4) . .
O27 W7 O8 161.6(4) . .
O28 W7 O8 81.4(4) . .
O25 W7 O8 83.1(4) . .
O26 W7 O24 172.6(4) . .
O27 W7 O24 80.2(4) . .
O28 W7 O24 85.3(4) . .
O25 W7 O24 71.9(4) . .
O8 W7 O24 81.6(4) . .
O29 W8 O31 100.5(5) . .
O29 W8 O9 103.4(5) . .
O31 W8 O9 156.1(4) . .
O29 W8 O28 102.4(5) . .
O31 W8 O28 90.4(4) . .
O9 W8 O28 84.6(4) . .
O29 W8 O32 100.3(5) . .
O31 W8 O32 87.4(4) . .
O9 W8 O32 88.3(4) . .
O28 W8 O32 157.1(4) . .
O29 W8 O30 170.0(4) . .
O31 W8 O30 71.9(3) . .
O9 W8 O30 84.4(4) . .
O28 W8 O30 84.4(4) . .
O32 W8 O30 73.3(4) . .
O33 W9 O34 102.8(4) . .
O33 W9 O16 102.1(5) . .
O34 W9 O16 92.2(4) . .
O33 W9 O12 102.6(4) . .
O34 W9 O12 154.5(4) . .
O16 W9 O12 84.3(4) . .
O33 W9 O32 100.7(5) . .
O34 W9 O32 88.6(5) . .
O16 W9 O32 156.4(4) . .
O12 W9 O32 84.9(4) . .
O33 W9 O30 170.8(4) . .
O34 W9 O30 71.8(4) . .
O16 W9 O30 85.8(4) . .
O12 W9 O30 82.7(3) . .
O32 W9 O30 72.1(3) . .
O35 W10 O36 106.1(5) . .
O35 W10 O37 103.6(5) . .
O36 W10 O37 93.8(4) . .
O35 W10 O31 100.7(4) . .
O36 W10 O31 92.2(4) . .
O37 W10 O31 152.3(4) . .
O35 W10 O34 96.0(5) . .
O36 W10 O34 157.8(4) . .
O37 W10 O34 83.5(4) . .
O31 W10 O34 80.8(4) . .
O35 W10 O30 162.6(4) . .
O36 W10 O30 89.2(4) . .
O37 W10 O30 83.1(3) . .
O31 W10 O30 70.0(3) . .
O34 W10 O30 68.6(3) . .
O39 W11 O38 105.4(5) . .
O39 W11 O37 105.7(5) . .
O38 W11 O37 91.5(4) . .
O39 W11 O20 99.1(5) . .
O38 W11 O20 93.4(4) . .
O37 W11 O20 152.4(4) . .
O39 W11 O17 96.5(5) . .
O38 W11 O17 158.0(5) . .
O37 W11 O17 83.1(4) . .
O20 W11 O17 82.2(4) . .
O39 W11 O15 162.7(4) . .
O38 W11 O15 88.7(4) . .
O37 W11 O15 83.3(3) . .
O20 W11 O15 69.7(4) . .
O17 W11 O15 69.5(3) . .
O41 W12 O40 101.2(4) . .
O41 W12 O45 100.4(4) . .
O40 W12 O45 95.0(4) . .
O41 W12 O43 101.8(4) . .
O40 W12 O43 94.5(4) . .
O45 W12 O43 153.6(4) . .
O41 W12 O42 96.3(4) . .
O40 W12 O42 162.4(4) . .
O45 W12 O42 83.7(4) . .
O43 W12 O42 79.8(4) . .
O41 W12 O44 172.8(4) . .
O40 W12 O44 80.6(4) . .
O45 W12 O44 72.5(4) . .
O43 W12 O44 84.9(4) . .
O42 W12 O44 82.2(4) . .
O46 W13 O47 103.0(5) . .
O46 W13 O45 98.3(5) . .
O47 W13 O45 94.5(4) . .
O46 W13 O49 102.7(5) . .
O47 W13 O49 92.8(4) . .
O45 W13 O49 155.5(4) . .
O46 W13 O48 96.4(4) . .
O47 W13 O48 160.5(4) . .
O45 W13 O48 84.5(4) . .
O49 W13 O48 80.9(4) . .
O46 W13 O44 170.7(5) . .
O47 W13 O44 79.0(4) . .
O45 W13 O44 72.4(4) . .
O49 W13 O44 86.1(4) . .
O48 W13 O44 82.1(3) . .
O50 W14 O49 103.4(5) . .
O50 W14 O54 100.8(5) . .
O49 W14 O54 91.2(4) . .
O50 W14 O51 100.8(5) . .
O49 W14 O51 86.9(4) . .
O54 W14 O51 158.2(4) . .
O50 W14 O52 99.7(5) . .
O49 W14 O52 156.6(4) . .
O54 W14 O52 88.3(4) . .
O51 W14 O52 84.9(4) . .
O50 W14 O53 170.6(5) . .
O49 W14 O53 83.9(4) . .
O54 W14 O53 72.9(4) . .
O51 W14 O53 85.3(4) . .
O52 W14 O53 73.6(4) . .
O56 W15 O55 106.3(5) . .
O56 W15 O58 105.3(5) . .
O55 W15 O58 91.7(4) . .
O56 W15 O54 99.1(4) . .
O55 W15 O54 92.7(4) . .
O58 W15 O54 152.8(4) . .
O56 W15 O57 95.0(5) . .
O55 W15 O57 158.6(4) . .
O58 W15 O57 84.3(4) . .
O54 W15 O57 81.8(4) . .
O56 W15 O53 161.8(4) . .
O55 W15 O53 89.1(4) . .
O58 W15 O53 83.4(3) . .
O54 W15 O53 69.8(3) . .
O57 W15 O53 69.6(3) . .
O59 W16 O60 104.2(5) . .
O59 W16 O58 103.0(4) . .
O60 W16 O58 93.5(4) . .
O59 W16 O62 100.3(4) . .
O60 W16 O62 92.9(4) . .
O58 W16 O62 153.5(4) . .
O59 W16 O78 96.2(5) . .
O60 W16 O78 159.4(4) . .
O58 W16 O78 84.1(4) . .
O62 W16 O78 80.9(4) . .
O59 W16 O61 163.9(4) . .
O60 W16 O61 89.9(4) . .
O58 W16 O61 83.5(3) . .
O62 W16 O61 70.8(3) . .
O78 W16 O61 69.6(3) . .
O63 W17 O62 100.6(5) . .
O63 W17 O43 103.1(5) . .
O62 W17 O43 90.6(4) . .
O63 W17 O65 101.1(4) . .
O62 W17 O65 158.3(4) . .
O43 W17 O65 85.0(4) . .
O63 W17 O64 99.9(5) . .
O62 W17 O64 87.0(4) . .
O43 W17 O64 156.9(4) . .
O65 W17 O64 88.7(4) . .
O63 W17 O61 171.0(4) . .
O62 W17 O61 72.6(3) . .
O43 W17 O61 83.2(4) . .
O65 W17 O61 85.7(3) . .
O64 W17 O61 74.2(4) . .
O66 W18 O42 103.6(5) . .
O66 W18 O65 102.2(4) . .
O42 W18 O65 87.3(4) . .
O66 W18 O69 99.6(5) . .
O42 W18 O69 91.7(4) . .
O65 W18 O69 157.8(4) . .
O66 W18 O67 100.8(5) . .
O42 W18 O67 155.6(4) . .
O65 W18 O67 86.3(4) . .
O69 W18 O67 85.5(4) . .
O66 W18 O68 169.7(4) . .
O42 W18 O68 84.4(4) . .
O65 W18 O68 84.5(3) . .
O69 W18 O68 73.4(4) . .
O67 W18 O68 71.5(4) . .
O70 W19 O48 102.6(5) . .
O70 W19 O51 100.3(5) . .
O48 W19 O51 88.7(4) . .
O70 W19 O69 100.6(5) . .
O48 W19 O69 91.7(4) . .
O51 W19 O69 158.5(4) . .
O70 W19 O71 102.1(5) . .
O48 W19 O71 155.3(4) . .
O51 W19 O71 86.2(4) . .
O69 W19 O71 84.5(4) . .
O70 W19 O68 171.9(5) . .
O48 W19 O68 83.7(4) . .
O51 W19 O68 84.8(4) . .
O69 W19 O68 73.9(4) . .
O71 W19 O68 71.8(4) . .
O72 W20 O74 103.8(5) . .
O72 W20 O73 103.2(5) . .
O74 W20 O73 84.6(5) . .
O72 W20 O71 101.4(5) . .
O74 W20 O71 90.0(4) . .
O73 W20 O71 155.4(4) . .
O72 W20 O67 100.7(5) . .
O74 W20 O67 155.4(4) . .
O73 W20 O67 88.6(4) . .
O71 W20 O67 86.4(4) . .
O72 W20 O68 169.9(5) . .
O74 W20 O68 83.9(4) . .
O73 W20 O68 83.8(4) . .
O71 W20 O68 71.8(4) . .
O67 W20 O68 71.9(4) . .
O75 W21 O57 103.0(5) . .
O75 W21 O76 103.1(5) . .
O57 W21 O76 90.8(4) . .
O75 W21 O52 100.9(5) . .
O57 W21 O52 89.7(4) . .
O76 W21 O52 155.2(4) . .
O75 W21 O74 103.1(5) . .
O57 W21 O74 154.0(4) . .
O76 W21 O74 82.9(4) . .
O52 W21 O74 85.9(4) . .
O75 W21 O53 170.7(4) . .
O57 W21 O53 72.5(4) . .
O76 W21 O53 85.2(4) . .
O52 W21 O53 71.3(3) . .
O74 W21 O53 81.8(4) . .
O77 W22 O78 102.0(5) . .
O77 W22 O76 101.8(5) . .
O78 W22 O76 91.8(4) . .
O77 W22 O73 103.1(5) . .
O78 W22 O73 154.9(4) . .
O76 W22 O73 84.6(4) . .
O77 W22 O64 100.4(5) . .
O78 W22 O64 87.5(5) . .
O76 W22 O64 157.4(4) . .
O73 W22 O64 86.5(4) . .
O77 W22 O61 170.9(4) . .
O78 W22 O61 72.6(4) . .
O76 W22 O61 85.8(4) . .
O73 W22 O61 82.3(4) . .
O64 W22 O61 72.4(4) . .
O36 Dy1 O38 70.8(3) . .
O36 Dy1 O23 116.4(3) . .
O38 Dy1 O23 75.4(3) . .
O36 Dy1 O55 75.2(3) . .
O38 Dy1 O55 77.8(4) . .
O23 Dy1 O55 144.3(3) . .
O36 Dy1 O47 78.8(3) . .
O38 Dy1 O47 143.6(3) . .
O23 Dy1 O47 138.2(3) . .
O55 Dy1 O47 75.4(3) . .
O36 Dy1 O60 137.7(3) . .
O38 Dy1 O60 78.2(3) . .
O23 Dy1 O60 81.1(3) . .
O55 Dy1 O60 70.7(3) . .
O47 Dy1 O60 114.7(3) . .
O36 Dy1 O27 76.4(3) . .
O38 Dy1 O27 117.4(4) . .
O23 Dy1 O27 74.1(3) . .
O55 Dy1 O27 140.4(3) . .
O47 Dy1 O27 72.5(3) . .
O60 Dy1 O27 145.1(3) . .
O36 Dy1 O40 145.8(3) . .
O38 Dy1 O40 141.0(3) . .
O23 Dy1 O40 73.9(3) . .
O55 Dy1 O40 116.5(3) . .
O47 Dy1 O40 74.2(3) . .
O60 Dy1 O40 73.9(3) . .
O27 Dy1 O40 75.8(3) . .
O24 As1 O15 111.9(4) . .
O24 As1 O30 110.9(4) . .
O15 As1 O30 107.8(5) . .
O24 As1 O5 110.2(5) . .
O15 As1 O5 108.0(5) . .
O30 As1 O5 107.9(4) . .
O61 As2 O44 110.8(5) . .
O61 As2 O68 107.7(5) . .
O44 As2 O68 110.6(5) . .
O61 As2 O53 108.3(4) . .
O44 As2 O53 111.5(5) . .
O68 As2 O53 107.8(5) . .
W1 O2 W5 149.0(5) . .
W1 O3 W6 151.0(6) . .
W3 O4 W1 122.6(5) . .
As1 O5 W1 122.4(5) . .
As1 O5 W2 122.3(5) . .
W1 O5 W2 92.3(3) . .
As1 O5 W3 125.2(5) . .
W1 O5 W3 93.2(3) . .
W2 O5 W3 92.6(3) . .
W2 O6 W1 122.7(5) . .
W2 O8 W7 152.5(5) . .
W2 O9 W8 152.2(5) . .
W3 O10 W2 123.3(5) . .
W3 O12 W9 151.6(5) . .
W3 O13 W4 152.7(5) . .
As1 O15 W5 124.3(5) . .
As1 O15 W11 121.9(4) . .
W5 O15 W11 92.4(3) . .
As1 O15 W4 125.1(5) . .
W5 O15 W4 90.8(3) . .
W11 O15 W4 93.1(3) . .
W9 O16 W4 155.3(6) . .
W4 O17 W11 125.9(5) . .
W4 O18 W5 123.7(5) . .
W5 O20 W11 125.8(5) . .
W5 O21 W6 157.8(6) . .
W6 O23 Dy1 139.9(5) . .
As1 O24 W7 126.5(5) . .
As1 O24 W6 124.0(5) . .
W7 O24 W6 94.4(3) . .
W7 O25 W6 120.4(5) . .
W7 O27 Dy1 138.2(5) . .
W8 O28 W7 155.3(5) . .
As1 O30 W8 123.2(5) . .
As1 O30 W10 121.2(4) . .
W8 O30 W10 92.8(3) . .
As1 O30 W9 125.8(4) . .
W8 O30 W9 91.4(3) . .
W10 O30 W9 93.5(3) . .
W8 O31 W10 125.1(5) . .
W8 O32 W9 123.1(5) . .
W9 O34 W10 126.1(5) . .
W10 O36 Dy1 157.4(5) . .
W10 O37 W11 143.4(5) . .
W11 O38 Dy1 159.2(5) . .
W12 O40 Dy1 137.5(4) . .
W18 O42 W12 152.6(6) . .
W17 O43 W12 157.4(6) . .
As2 O44 W13 124.3(5) . .
As2 O44 W12 126.1(5) . .
W13 O44 W12 94.0(3) . .
W12 O45 W13 119.8(5) . .
W13 O46 Cu5 125.2(6) . .
W13 O47 Dy1 140.7(5) . .
W19 O48 W13 153.6(5) . .
W14 O49 W13 155.8(5) . .
W19 O51 W14 146.8(5) . .
W21 O52 W14 123.0(5) . .
As2 O53 W14 124.0(5) . .
As2 O53 W15 121.6(4) . .
W14 O53 W15 92.8(3) . .
As2 O53 W21 125.2(5) . .
W14 O53 W21 91.7(3) . .
W15 O53 W21 92.5(3) . .
W14 O54 W15 124.3(5) . .
W15 O55 Dy1 159.4(5) . .
W21 O57 W15 125.4(5) . .
W15 O58 W16 143.8(5) . .
W16 O60 Dy1 156.6(5) . .
As2 O61 W17 123.7(4) . .
As2 O61 W16 121.5(5) . .
W17 O61 W16 92.6(3) . .
As2 O61 W22 125.5(5) . .
W17 O61 W22 91.2(3) . .
W16 O61 W22 93.3(3) . .
W17 O62 W16 123.8(4) . .
W17 O64 W22 122.1(5) . .
W17 O65 W18 149.8(5) . .
W20 O67 W18 124.1(5) . .
As2 O68 W19 122.6(5) . .
As2 O68 W20 125.6(5) . .
W19 O68 W20 92.6(3) . .
As2 O68 W18 123.0(5) . .
W19 O68 W18 91.2(3) . .
W20 O68 W18 92.5(3) . .
W18 O69 W19 121.3(5) . .
W20 O71 W19 123.9(5) . .
W20 O73 W22 153.1(6) . .
W20 O74 W21 154.8(6) . .
W22 O76 W21 154.0(6) . .
W22 O78 W16 124.5(5) . .
N2 Cu1 N2 180 2_775 .
N2 Cu1 N1 82.9(7) 2_775 2_775
N2 Cu1 N1 97.1(7) . 2_775
N2 Cu1 N1 97.1(7) 2_775 .
N2 Cu1 N1 82.9(7) . .
N1 Cu1 N1 180 2_775 .
N4 Cu2 N5 175.7(7) . .
N4 Cu2 N3 84.4(7) . .
N5 Cu2 N3 94.0(7) . .
N4 Cu2 N6 97.2(6) . .
N5 Cu2 N6 84.7(6) . .
N3 Cu2 N6 173.9(7) . .
N7 Cu3 N9 96.7(9) . .
N7 Cu3 N10 177.1(8) . .
N9 Cu3 N10 83.6(7) . .
N7 Cu3 N8 85.2(9) . .
N9 Cu3 N8 175.7(7) . .
N10 Cu3 N8 94.7(8) . .
N11 Cu4 N12 84.8(7) . .
N11 Cu4 N14 96.7(7) . .
N12 Cu4 N14 177.2(6) . .
N11 Cu4 N13 177.1(7) . .
N12 Cu4 N13 95.4(6) . .
N14 Cu4 N13 82.9(6) . .
N18 Cu5 N17 87.1(7) . .
N18 Cu5 N15 92.8(8) . .
N17 Cu5 N15 177.9(8) . .
N18 Cu5 N16 166.7(8) . .
N17 Cu5 N16 96.8(6) . .
N15 Cu5 N16 82.8(7) . .
N18 Cu5 O46 99.6(7) . .
N17 Cu5 O46 92.5(6) . .
N15 Cu5 O46 89.6(6) . .
N16 Cu5 O46 92.9(6) . .
N21 Cu6 N19 173.6(7) . .
N21 Cu6 N22 91.3(8) . .
N19 Cu6 N22 95.0(8) . .
N21 Cu6 N20 89.2(8) . .
N19 Cu6 N20 84.5(7) . .
N22 Cu6 N20 167.5(9) . .
C1 N1 Cu1 106.6(11) . .
C1 N1 H1C 110.4 . .
Cu1 N1 H1C 110.4 . .
C1 N1 H1D 110.4 . .
Cu1 N1 H1D 110.4 . .
H1C N1 H1D 108.6 . .
C2 N2 Cu1 117.4(14) . .
C2 N2 H2B 108.0 . .
Cu1 N2 H2B 108.0 . .
C2 N2 H2C 107.9 . .
Cu1 N2 H2C 108.0 . .
H2B N2 H2C 107.2 . .
C4 N3 Cu2 108.6(13) . .
C4 N3 H3D 110.0 . .
Cu2 N3 H3D 110.0 . .
C4 N3 H3E 110.0 . .
Cu2 N3 H3E 110.0 . .
H3D N3 H3E 108.3 . .
C5 N4 Cu2 108.8(12) . .
C5 N4 H4C 109.9 . .
Cu2 N4 H4C 109.9 . .
C5 N4 H4D 109.9 . .
Cu2 N4 H4D 109.9 . .
H4C N4 H4D 108.3 . .
C7 N5 Cu2 110.0(12) . .
C7 N5 H5B 109.7 . .
Cu2 N5 H5B 109.7 . .
C7 N5 H5C 109.7 . .
Cu2 N5 H5C 109.7 . .
H5B N5 H5C 108.2 . .
C8 N6 Cu2 108.9(12) . .
C8 N6 H6D 109.9 . .
Cu2 N6 H6D 109.9 . .
C8 N6 H6E 109.9 . .
Cu2 N6 H6E 109.9 . .
H6D N6 H6E 108.3 . .
C10 N7 Cu3 111.3(17) . .
C10 N7 H7C 109.4 . .
Cu3 N7 H7C 109.4 . .
C10 N7 H7D 109.4 . .
Cu3 N7 H7D 109.4 . .
H7C N7 H7D 108.0 . .
C11 N8 Cu3 106.9(16) . .
C11 N8 H8B 110.3 . .
Cu3 N8 H8B 110.3 . .
C11 N8 H8C 110.3 . .
Cu3 N8 H8C 110.3 . .
H8B N8 H8C 108.6 . .
C13 N9 Cu3 107.9(15) . .
C13 N9 H9D 110.1 . .
Cu3 N9 H9D 110.1 . .
C13 N9 H9E 110.1 . .
Cu3 N9 H9E 110.1 . .
H9D N9 H9E 108.4 . .
C14 N10 Cu3 111.1(15) . .
C14 N10 H10C 109.4 . .
Cu3 N10 H10C 109.4 . .
C14 N10 H10D 109.4 . .
Cu3 N10 H10D 109.4 . .
H10C N10 H10D 108.0 . .
C16 N11 Cu4 111.5(15) . .
C16 N11 H11B 109.3 . .
Cu4 N11 H11B 109.3 . .
C16 N11 H11C 109.3 . .
Cu4 N11 H11C 109.3 . .
H11B N11 H11C 108.0 . .
C17 N12 Cu4 106.4(14) . .
C17 N12 H12D 110.4 . .
Cu4 N12 H12D 110.4 . .
C17 N12 H12E 110.4 . .
Cu4 N12 H12E 110.4 . .
H12D N12 H12E 108.6 . .
C19 N13 Cu4 110.9(13) . .
C19 N13 H13C 109.5 . .
Cu4 N13 H13C 109.5 . .
C19 N13 H13D 109.5 . .
Cu4 N13 H13D 109.5 . .
H13C N13 H13D 108.0 . .
C20 N14 Cu4 105.2(10) . .
C20 N14 H14B 110.7 . .
Cu4 N14 H14B 110.7 . .
C20 N14 H14C 110.7 . .
Cu4 N14 H14C 110.7 . .
H14B N14 H14C 108.8 . .
C22 N15 Cu5 111.5(15) . .
C22 N15 H15D 109.3 . .
Cu5 N15 H15D 109.3 . .
C22 N15 H15E 109.3 . .
Cu5 N15 H15E 109.3 . .
H15D N15 H15E 108.0 . .
C23 N16 Cu5 109.9(13) . .
C23 N16 H16C 109.7 . .
Cu5 N16 H16C 109.7 . .
C23 N16 H16D 109.7 . .
Cu5 N16 H16D 109.7 . .
H16C N16 H16D 108.2 . .
C25 N17 Cu5 110.9(11) . .
C25 N17 H17B 109.5 . .
Cu5 N17 H17B 109.5 . .
C25 N17 H17C 109.5 . .
Cu5 N17 H17C 109.5 . .
H17B N17 H17C 108.1 . .
C26 N18 Cu5 111.5(13) . .
C26 N18 H18D 109.3 . .
Cu5 N18 H18D 109.3 . .
C26 N18 H18E 109.3 . .
Cu5 N18 H18E 109.3 . .
H18D N18 H18E 108.0 . .
C28 N19 Cu6 113.7(12) . .
C28 N19 H19C 108.8 . .
Cu6 N19 H19C 108.8 . .
C28 N19 H19D 108.8 . .
Cu6 N19 H19D 108.8 . .
H19C N19 H19D 107.7 . .
C29 N20 Cu6 106.5(14) . .
C29 N20 H20B 110.4 . .
Cu6 N20 H20B 110.4 . .
C29 N20 H20C 110.4 . .
Cu6 N20 H20C 110.4 . .
H20B N20 H20C 108.6 . .
C31 N21 Cu6 102.3(18) . .
C31 N21 H21D 111.3 . .
Cu6 N21 H21D 111.3 . .
C31 N21 H21E 111.3 . .
Cu6 N21 H21E 111.3 . .
H21D N21 H21E 109.2 . .
C32 N22 Cu6 106.7(17) . .
C32 N22 H22C 110.4 . .
Cu6 N22 H22C 110.4 . .
C32 N22 H22D 110.4 . .
Cu6 N22 H22D 110.4 . .
H22C N22 H22D 108.6 . .
C2 C1 N1 116.2(19) . .
C2 C1 H1A 108.2 . .
N1 C1 H1A 108.2 . .
C2 C1 H1B 108.2 . .
N1 C1 H1B 108.2 . .
H1A C1 H1B 107.4 . .
N2 C2 C3 146(2) . .
N2 C2 C1 108(2) . .
C3 C2 C1 97.5(19) . .
N2 C2 H2A 98.8 . .
C3 C2 H2A 98.8 . .
C1 C2 H2A 98.8 . .
C2 C3 H3A 109.5 . .
C2 C3 H3B 109.5 . .
H3A C3 H3B 109.5 . .
C2 C3 H3C 109.5 . .
H3A C3 H3C 109.5 . .
H3B C3 H3C 109.5 . .
C5 C4 N3 111(2) . .
C5 C4 H4A 109.4 . .
N3 C4 H4A 109.4 . .
C5 C4 H4B 109.4 . .
N3 C4 H4B 109.4 . .
H4A C4 H4B 108.0 . .
C6 C5 C4 118(2) . .
C6 C5 N4 114.4(19) . .
C4 C5 N4 113.1(19) . .
C6 C5 H5A 102.7 . .
C4 C5 H5A 102.7 . .
N4 C5 H5A 102.7 . .
C5 C6 H6A 109.5 . .
C5 C6 H6B 109.5 . .
H6A C6 H6B 109.5 . .
C5 C6 H6C 109.5 . .
H6A C6 H6C 109.5 . .
H6B C6 H6C 109.5 . .
N5 C7 C8 113.9(16) . .
N5 C7 H7A 108.8 . .
C8 C7 H7A 108.8 . .
N5 C7 H7B 108.8 . .
C8 C7 H7B 108.8 . .
H7A C7 H7B 107.7 . .
N6 C8 C7 107.9(19) . .
N6 C8 C9 115.3(17) . .
C7 C8 C9 115.1(17) . .
N6 C8 H8A 105.9 . .
C7 C8 H8A 105.9 . .
C9 C8 H8A 105.9 . .
C8 C9 H9A 109.5 . .
C8 C9 H9B 109.5 . .
H9A C9 H9B 109.5 . .
C8 C9 H9C 109.5 . .
H9A C9 H9C 109.5 . .
H9B C9 H9C 109.5 . .
N7 C10 C11 106(2) . .
N7 C10 H10A 110.4 . .
C11 C10 H10A 110.4 . .
N7 C10 H10B 110.4 . .
C11 C10 H10B 110.4 . .
H10A C10 H10B 108.6 . .
C12 C11 N8 113(3) . .
C12 C11 C10 110(3) . .
N8 C11 C10 114(2) . .
C12 C11 H11A 106.2 . .
N8 C11 H11A 106.2 . .
C10 C11 H11A 106.2 . .
C11 C12 H12A 109.5 . .
C11 C12 H12B 109.5 . .
H12A C12 H12B 109.5 . .
C11 C12 H12C 109.5 . .
H12A C12 H12C 109.5 . .
H12B C12 H12C 109.5 . .
C14 C13 N9 109(2) . .
C14 C13 H13A 109.9 . .
N9 C13 H13A 109.9 . .
C14 C13 H13B 109.9 . .
N9 C13 H13B 109.9 . .
H13A C13 H13B 108.3 . .
C13 C14 N10 110(2) . .
C13 C14 C15 108(2) . .
N10 C14 C15 115(2) . .
C13 C14 H14A 107.8 . .
N10 C14 H14A 107.8 . .
C15 C14 H14A 107.8 . .
C14 C15 H15A 109.5 . .
C14 C15 H15B 109.5 . .
H15A C15 H15B 109.5 . .
C14 C15 H15C 109.5 . .
H15A C15 H15C 109.5 . .
H15B C15 H15C 109.5 . .
C17 C16 N11 113(3) . .
C17 C16 H16A 109.0 . .
N11 C16 H16A 109.0 . .
C17 C16 H16B 109.0 . .
N11 C16 H16B 109.0 . .
H16A C16 H16B 107.8 . .
C16 C17 N12 113(2) . .
C16 C17 C18 120(3) . .
N12 C17 C18 110(2) . .
C16 C17 H17A 104.0 . .
N12 C17 H17A 104.0 . .
C18 C17 H17A 104.0 . .
C17 C18 H18A 109.5 . .
C17 C18 H18B 109.5 . .
H18A C18 H18B 109.5 . .
C17 C18 H18C 109.5 . .
H18A C18 H18C 109.5 . .
H18B C18 H18C 109.5 . .
C20 C19 N13 102.3(18) . .
C20 C19 H19A 111.3 . .
N13 C19 H19A 111.3 . .
C20 C19 H19B 111.3 . .
N13 C19 H19B 111.3 . .
H19A C19 H19B 109.2 . .
C19 C20 C21 100.1(18) . .
C19 C20 N14 109.8(19) . .
C21 C20 N14 106.6(17) . .
C19 C20 H20A 113.1 . .
C21 C20 H20A 113.1 . .
N14 C20 H20A 113.1 . .
C20 C21 H21A 109.5 . .
C20 C21 H21B 109.5 . .
H21A C21 H21B 109.5 . .
C20 C21 H21C 109.5 . .
H21A C21 H21C 109.5 . .
H21B C21 H21C 109.5 . .
N15 C22 C23 99.8(19) . .
N15 C22 H22A 111.8 . .
C23 C22 H22A 111.8 . .
N15 C22 H22B 111.8 . .
C23 C22 H22B 111.8 . .
H22A C22 H22B 109.5 . .
C24 C23 N16 117(2) . .
C24 C23 C22 111.5(19) . .
N16 C23 C22 107.2(18) . .
C24 C23 H23A 106.8 . .
N16 C23 H23A 106.8 . .
C22 C23 H23A 106.8 . .
C23 C24 H24A 109.5 . .
C23 C24 H24B 109.5 . .
H24A C24 H24B 109.5 . .
C23 C24 H24C 109.5 . .
H24A C24 H24C 109.5 . .
H24B C24 H24C 109.5 . .
C26 C25 N17 104.7(15) . .
C26 C25 H25A 110.8 . .
N17 C25 H25A 110.8 . .
C26 C25 H25B 110.8 . .
N17 C25 H25B 110.8 . .
H25A C25 H25B 108.9 . .
N18 C26 C27 133.5(18) . .
N18 C26 C25 119.7(17) . .
C27 C26 C25 101.5(16) . .
N18 C26 H26A 97.5 . .
C27 C26 H26A 97.5 . .
C25 C26 H26A 97.5 . .
C26 C27 H27A 109.5 . .
C26 C27 H27B 109.5 . .
H27A C27 H27B 109.5 . .
C26 C27 H27C 109.5 . .
H27A C27 H27C 109.5 . .
H27B C27 H27C 109.5 . .
C29 C28 N19 108.1(16) . .
C29 C28 H28A 110.1 . .
N19 C28 H28A 110.1 . .
C29 C28 H28B 110.1 . .
N19 C28 H28B 110.1 . .
H28A C28 H28B 108.4 . .
N20 C29 C28 112.2(19) . .
N20 C29 C30 89.2(17) . .
C28 C29 C30 125.6(19) . .
N20 C29 H29A 109.2 . .
C28 C29 H29A 109.2 . .
C30 C29 H29A 109.2 . .
C29 C30 H30A 109.5 . .
C29 C30 H30B 109.5 . .
H30A C30 H30B 109.5 . .
C29 C30 H30C 109.5 . .
H30A C30 H30C 109.5 . .
H30B C30 H30C 109.5 . .
C32 C31 N21 126(3) . .
C32 C31 H31A 105.7 . .
N21 C31 H31A 105.7 . .
C32 C31 H31B 105.7 . .
N21 C31 H31B 105.7 . .
H31A C31 H31B 106.2 . .
C31 C32 C33 128(3) . .
C31 C32 N22 107(3) . .
C33 C32 N22 117(3) . .
C31 C32 H32A 99.3 . .
C33 C32 H32A 99.3 . .
N22 C32 H32A 99.3 . .
C32 C33 H33A 109.5 . .
C32 C33 H33B 109.5 . .
H33A C33 H33B 109.5 . .
C32 C33 H33C 109.5 . .
H33A C33 H33C 109.5 . .
H33B C33 H33C 109.5 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
W1 O1 1.718(9) .
W1 O3 1.829(9) .
W1 O2 1.926(11) .
W1 O6 1.962(10) .
W1 O4 1.983(9) .
W1 O5 2.353(9) .
W2 O7 1.721(10) .
W2 O8 1.843(10) .
W2 O9 1.921(9) .
W2 O6 1.939(10) .
W2 O10 2.004(10) .
W2 O5 2.396(10) .
W3 O11 1.723(10) .
W3 O13 1.908(10) .
W3 O12 1.908(9) .
W3 O10 1.932(11) .
W3 O4 1.950(10) .
W3 O5 2.397(9) .
W4 O14 1.714(10) .
W4 O17 1.866(10) .
W4 O18 1.938(10) .
W4 O16 1.942(10) .
W4 O13 1.974(10) .
W4 O15 2.449(9) .
W5 O19 1.717(10) .
W5 O20 1.880(11) .
W5 O21 1.927(9) .
W5 O2 1.941(10) .
W5 O18 1.948(10) .
W5 O15 2.363(8) .
W6 O22 1.742(10) .
W6 O23 1.780(9) .
W6 O21 1.935(9) .
W6 O25 1.958(11) .
W6 O3 2.103(10) .
W6 O24 2.314(9) .
W7 O26 1.732(10) .
W7 O27 1.769(10) .
W7 O28 1.947(9) .
W7 O25 1.950(10) .
W7 O8 2.084(10) .
W7 O24 2.309(9) .
W8 O29 1.717(10) .
W8 O31 1.912(10) .
W8 O9 1.925(9) .
W8 O28 1.934(9) .
W8 O32 1.943(10) .
W8 O30 2.371(9) .
W9 O33 1.749(10) .
W9 O34 1.853(10) .
W9 O16 1.901(10) .
W9 O12 1.953(9) .
W9 O32 1.954(10) .
W9 O30 2.415(9) .
W10 O35 1.709(9) .
W10 O36 1.782(9) .
W10 O37 1.911(9) .
W10 O31 1.985(10) .
W10 O34 2.085(9) .
W10 O30 2.406(8) .
W11 O39 1.730(11) .
W11 O38 1.774(11) .
W11 O37 1.944(9) .
W11 O20 1.979(10) .
W11 O17 2.083(10) .
W11 O15 2.395(9) .
W12 O41 1.724(10) .
W12 O40 1.792(8) .
W12 O45 1.943(9) .
W12 O43 1.950(9) .
W12 O42 2.098(10) .
W12 O44 2.307(9) .
W13 O46 1.736(10) .
W13 O47 1.787(9) .
W13 O45 1.953(10) .
W13 O49 1.956(10) .
W13 O48 2.059(9) .
W13 O44 2.302(9) .
W14 O50 1.720(10) .
W14 O49 1.897(10) .
W14 O54 1.904(10) .
W14 O51 1.951(9) .
W14 O52 1.958(10) .
W14 O53 2.340(8) .
W15 O56 1.738(10) .
W15 O55 1.759(10) .
W15 O58 1.921(9) .
W15 O54 1.991(10) .
W15 O57 2.093(11) .
W15 O53 2.414(9) .
W16 O59 1.744(9) .
W16 O60 1.756(10) .
W16 O58 1.945(9) .
W16 O62 2.000(9) .
W16 O78 2.105(10) .
W16 O61 2.396(9) .
W17 O63 1.724(10) .
W17 O62 1.910(9) .
W17 O43 1.912(10) .
W17 O65 1.926(9) .
W17 O64 1.945(11) .
W17 O61 2.376(8) .
W18 O66 1.741(10) .
W18 O42 1.850(10) .
W18 O65 1.932(10) .
W18 O69 1.951(9) .
W18 O67 1.963(11) .
W18 O68 2.394(9) .
W19 O70 1.715(10) .
W19 O48 1.843(9) .
W19 O51 1.944(10) .
W19 O69 1.954(10) .
W19 O71 1.963(11) .
W19 O68 2.370(9) .
W20 O72 1.710(11) .
W20 O74 1.896(11) .
W20 O73 1.898(10) .
W20 O71 1.937(11) .
W20 O67 1.949(11) .
W20 O68 2.389(9) .
W21 O75 1.721(11) .
W21 O57 1.857(10) .
W21 O76 1.939(10) .
W21 O52 1.949(10) .
W21 O74 1.964(10) .
W21 O53 2.445(9) .
W22 O77 1.729(11) .
W22 O78 1.856(10) .
W22 O76 1.895(10) .
W22 O73 1.950(10) .
W22 O64 1.979(10) .
W22 O61 2.428(9) .
Dy1 O36 2.346(9) .
Dy1 O38 2.384(10) .
Dy1 O23 2.391(9) .
Dy1 O55 2.396(10) .
Dy1 O47 2.399(9) .
Dy1 O60 2.410(9) .
Dy1 O27 2.417(10) .
Dy1 O40 2.458(9) .
As1 O24 1.669(9) .
As1 O15 1.676(9) .
As1 O30 1.678(8) .
As1 O5 1.678(9) .
As2 O61 1.662(8) .
As2 O44 1.665(9) .
As2 O68 1.669(9) .
As2 O53 1.681(9) .
O46 Cu5 2.355(12) .
Cu1 N2 2.001(15) 2_775
Cu1 N2 2.001(15) .
Cu1 N1 2.029(13) 2_775
Cu1 N1 2.029(13) .
Cu2 N4 2.021(15) .
Cu2 N5 2.023(14) .
Cu2 N3 2.028(14) .
Cu2 N6 2.037(13) .
Cu3 N7 1.966(19) .
Cu3 N9 1.983(19) .
Cu3 N10 1.990(17) .
Cu3 N8 2.006(18) .
Cu4 N11 1.971(15) .
Cu4 N12 2.005(17) .
Cu4 N14 2.024(14) .
Cu4 N13 2.029(16) .
Cu5 N18 1.910(17) .
Cu5 N17 1.970(16) .
Cu5 N15 2.02(2) .
Cu5 N16 2.019(18) .
Cu6 N21 1.939(19) .
Cu6 N19 1.978(16) .
Cu6 N22 2.008(19) .
Cu6 N20 2.03(2) .
N1 C1 1.51(2) .
N1 H1C 0.9000 .
N1 H1D 0.9000 .
N2 C2 1.33(3) .
N2 H2B 0.9000 .
N2 H2C 0.9000 .
N3 C4 1.48(3) .
N3 H3D 0.9000 .
N3 H3E 0.9000 .
N4 C5 1.485(10) .
N4 H4C 0.9000 .
N4 H4D 0.9000 .
N5 C7 1.46(2) .
N5 H5B 0.9000 .
N5 H5C 0.9000 .
N6 C8 1.48(2) .
N6 H6D 0.9000 .
N6 H6E 0.9000 .
N7 C10 1.43(3) .
N7 H7C 0.9000 .
N7 H7D 0.9000 .
N8 C11 1.47(3) .
N8 H8B 0.9000 .
N8 H8C 0.9000 .
N9 C13 1.50(3) .
N9 H9D 0.9000 .
N9 H9E 0.9000 .
N10 C14 1.44(3) .
N10 H10C 0.9000 .
N10 H10D 0.9000 .
N11 C16 1.44(3) .
N11 H11B 0.9000 .
N11 H11C 0.9000 .
N12 C17 1.51(3) .
N12 H12D 0.9000 .
N12 H12E 0.9000 .
N13 C19 1.53(3) .
N13 H13C 0.9000 .
N13 H13D 0.9000 .
N14 C20 1.51(3) .
N14 H14B 0.9000 .
N14 H14C 0.9000 .
N15 C22 1.490(10) .
N15 H15D 0.9000 .
N15 H15E 0.9000 .
N16 C23 1.45(3) .
N16 H16C 0.9000 .
N16 H16D 0.9000 .
N17 C25 1.55(2) .
N17 H17B 0.9000 .
N17 H17C 0.9000 .
N18 C26 1.40(2) .
N18 H18D 0.9000 .
N18 H18E 0.9000 .
N19 C28 1.496(10) .
N19 H19C 0.9000 .
N19 H19D 0.9000 .
N20 C29 1.483(10) .
N20 H20B 0.9000 .
N20 H20C 0.9000 .
N21 C31 1.469(10) .
N21 H21D 0.9000 .
N21 H21E 0.9000 .
N22 C32 1.52(4) .
N22 H22C 0.9000 .
N22 H22D 0.9000 .
C1 C2 1.489(10) .
C1 H1A 0.9700 .
C1 H1B 0.9700 .
C2 C3 1.39(3) .
C2 H2A 0.9800 .
C3 H3A 0.9600 .
C3 H3B 0.9600 .
C3 H3C 0.9600 .
C4 C5 1.42(3) .
C4 H4A 0.9700 .
C4 H4B 0.9700 .
C5 C6 1.40(3) .
C5 H5A 0.9800 .
C6 H6A 0.9600 .
C6 H6B 0.9600 .
C6 H6C 0.9600 .
C7 C8 1.52(3) .
C7 H7A 0.9700 .
C7 H7B 0.9700 .
C8 C9 1.55(3) .
C8 H8A 0.9800 .
C9 H9A 0.9600 .
C9 H9B 0.9600 .
C9 H9C 0.9600 .
C10 C11 1.490(10) .
C10 H10A 0.9700 .
C10 H10B 0.9700 .
C11 C12 1.44(4) .
C11 H11A 0.9800 .
C12 H12A 0.9600 .
C12 H12B 0.9600 .
C12 H12C 0.9600 .
C13 C14 1.42(3) .
C13 H13A 0.9700 .
C13 H13B 0.9700 .
C14 C15 1.56(3) .
C14 H14A 0.9800 .
C15 H15A 0.9600 .
C15 H15B 0.9600 .
C15 H15C 0.9600 .
C16 C17 1.38(3) .
C16 H16A 0.9700 .
C16 H16B 0.9700 .
C17 C18 1.56(4) .
C17 H17A 0.9800 .
C18 H18A 0.9600 .
C18 H18B 0.9600 .
C18 H18C 0.9600 .
C19 C20 1.44(3) .
C19 H19A 0.9700 .
C19 H19B 0.9700 .
C20 C21 1.492(10) .
C20 H20A 0.9800 .
C21 H21A 0.9600 .
C21 H21B 0.9600 .
C21 H21C 0.9600 .
C22 C23 1.62(3) .
C22 H22A 0.9700 .
C22 H22B 0.9700 .
C23 C24 1.39(3) .
C23 H23A 0.9800 .
C24 H24A 0.9600 .
C24 H24B 0.9600 .
C24 H24C 0.9600 .
C25 C26 1.501(10) .
C25 H25A 0.9700 .
C25 H25B 0.9700 .
C26 C27 1.495(10) .
C26 H26A 0.9800 .
C27 H27A 0.9600 .
C27 H27B 0.9600 .
C27 H27C 0.9600 .
C28 C29 1.494(10) .
C28 H28A 0.9700 .
C28 H28B 0.9700 .
C29 C30 1.54(3) .
C29 H29A 0.9800 .
C30 H30A 0.9600 .
C30 H30B 0.9600 .
C30 H30C 0.9600 .
C31 C32 1.42(4) .
C31 H31A 0.9700 .
C31 H31B 0.9700 .
C32 C33 1.501(10) .
C32 H32A 0.9800 .
C33 H33A 0.9600 .
C33 H33B 0.9600 .
C33 H33C 0.9600 .
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
N15 H15D O26 0.90 2.25 3.08(2) 153.0 2_886
N15 H15E O3W 0.90 2.41 3.24(3) 153.3 1_665
N16 H16C O45 0.90 2.38 3.20(2) 152.3 .
N16 H16D O26 0.90 2.34 3.226(18) 170.3 .
N17 H17B O28 0.90 2.50 3.296(18) 147.0 .
N17 H17C O47 0.90 2.12 2.954(18) 154.3 .
N1 H1C O78 0.90 2.23 2.944(17) 136.2 2_775
N1 H1D O20 0.90 2.54 3.314(17) 144.3 .
N2 H2C O39 0.90 2.46 3.01(2) 119.1 2_775
N2 H2C O58 0.90 2.55 3.30(2) 140.7 2_775
N3 H3D O18 0.90 2.21 3.011(17) 147.7 2_885
N3 H3E O1W 0.90 2.43 3.30(2) 165.1 2_776
N4 H4C O6 0.90 2.37 3.102(18) 138.4 .
N4 H4C O2W 0.90 2.58 3.28(3) 134.8 2_776
N6 H6D O34 0.90 2.12 2.970(17) 157.8 1_655
N7 H7C O77 0.90 2.37 3.15(2) 144.4 .
N7 H7D O12 0.90 2.24 3.08(2) 154.8 1_545
N8 H8B O10 0.90 2.51 3.08(2) 121.5 1_545
N8 H8C O63 0.90 2.48 3.25(2) 143.6 .
N9 H9D O11 0.90 2.50 3.04(2) 119.0 1_545
N9 H9E O77 0.90 2.16 2.950(19) 146.0 .
N10 H10C O63 0.90 2.37 3.13(2) 143.0 .
N10 H10D O6W 0.90 2.12 2.94(5) 151.0 2_876
N11 H11B O54 0.90 2.04 2.935(17) 175.4 1_655
N11 H11C O35 0.90 2.48 3.048(17) 121.8 1_655
N12 H12D O25 0.90 2.46 3.292(18) 153.8 .
N12 H12D O23 0.90 2.64 3.275(17) 127.8 .
N12 H12E O41 0.90 2.33 3.203(17) 162.2 .
N12 H12E O40 0.90 2.40 2.974(17) 122.1 .
N13 H13C O43 0.90 2.62 3.423(18) 148.4 .
N13 H13D O23 0.90 2.16 2.971(19) 150.3 .
N14 H14C O56 0.90 2.45 3.246(18) 147.0 1_655
N19 H19C O51 0.90 2.25 3.090(18) 155.8 2_776
N19 H19C O50 0.90 2.55 3.124(19) 122.5 2_776
N19 H19D O71 0.90 2.19 3.057(19) 161.4 .
N19 H19D O70 0.90 2.59 3.104(19) 116.8 2_776
N20 H20B O66 0.90 2.46 3.23(2) 143.3 .
N20 H20C O41 0.90 2.22 3.09(2) 163.0 2_876
N21 H21D O41 0.90 2.61 3.43(2) 151.0 2_876
N21 H21E O66 0.90 2.36 3.00(2) 128.2 2_876
N22 H22C O70 0.90 2.07 2.88(2) 149.8 .
N22 H22D O52 0.90 2.25 3.15(2) 174.2 2_776
