#------------------------------------------------------------------------------
#$Date: 2016-03-23 22:51:08 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179493 $
#$URL: svn://www.crystallography.net/cod/cif/4/33/90/4339070.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_4339070
loop_
_publ_author_name
'Wei, Meilin'
'He, Cheng'
'Sun, Qiaozhen'
'Meng, Qingjin'
'Duan, Chunying'
_publ_section_title
;
 Zeolite ionic crystals assembled through direct incorporation of
 polyoxometalate clusters within 3D metal-organic frameworks.
;
_journal_issue                   15
_journal_name_full               'Inorganic chemistry'
_journal_page_first              5957
_journal_page_last               5966
_journal_paper_doi               10.1021/ic070274o
_journal_volume                  46
_journal_year                    2007
_chemical_formula_sum            'C42 H45 Dy Mo12 N9 O53 P'
_chemical_formula_weight         2868.62
_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                92.071(2)
_cell_angle_beta                 97.642(2)
_cell_angle_gamma                98.840(2)
_cell_formula_units_Z            2
_cell_length_a                   11.6989(11)
_cell_length_b                   17.4755(17)
_cell_length_c                   18.8466(18)
_cell_measurement_reflns_used    1035
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      26.32
_cell_measurement_theta_min      2.84
_cell_volume                     3767.2(6)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'Bruker SHELXTL'
_computing_structure_solution    'Bruker SHELXTL'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.933
_diffrn_measured_fraction_theta_max 0.933
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega 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  0.0507
_diffrn_reflns_av_sigmaI/netI    0.0583
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       22
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_l_max       24
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            21667
_diffrn_reflns_theta_full        27.50
_diffrn_reflns_theta_max         27.50
_diffrn_reflns_theta_min         1.95
_exptl_absorpt_coefficient_mu    3.038
_exptl_absorpt_correction_T_max  0.5370
_exptl_absorpt_correction_T_min  0.4361
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            orange
_exptl_crystal_density_diffrn    2.529
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             2738
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.20
_refine_diff_density_max         2.916
_refine_diff_density_min         -1.157
_refine_diff_density_rms         0.213
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.057
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1061
_refine_ls_number_reflns         16141
_refine_ls_number_restraints     24
_refine_ls_restrained_S_all      1.062
_refine_ls_R_factor_all          0.0828
_refine_ls_R_factor_gt           0.0555
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0852P)²+6.9810P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1446
_refine_ls_wR_factor_ref         0.1561
_reflns_number_gt                11825
_reflns_number_total             16141
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic070274o-file002.cif
_cod_data_source_block           sad
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to
/usr/data/users/saulius/automatic-downloads/retrospective/ACS/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 2281 2013-09-26 08:29:07Z andrius 
;
_cod_original_sg_symbol_H-M      'P-1   '
_cod_database_code               4339070
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
P1 P 0.08517(15) 0.67911(10) 0.75896(9) 0.0187(3) Uani 1 1 d .
Mo1 Mo 0.03738(7) 0.52782(4) 0.62107(4) 0.03750(18) Uani 1 1 d .
Mo2 Mo 0.27526(6) 0.53992(4) 0.77181(4) 0.03560(18) Uani 1 1 d .
Mo3 Mo -0.03091(7) 0.48997(4) 0.80361(4) 0.03752(18) Uani 1 1 d .
Mo4 Mo -0.13435(6) 0.66826(5) 0.60903(3) 0.03305(17) Uani 1 1 d .
Mo5 Mo 0.15100(6) 0.70973(5) 0.58368(4) 0.03506(18) Uani 1 1 d .
Mo6 Mo 0.38692(6) 0.72359(5) 0.73765(4) 0.03729(18) Uani 1 1 d .
Mo7 Mo 0.31506(6) 0.68443(5) 0.90196(3) 0.03289(17) Uani 1 1 d .
Mo8 Mo 0.00746(6) 0.63820(4) 0.93057(3) 0.03134(17) Uani 1 1 d .
Mo9 Mo -0.20751(6) 0.62813(4) 0.78991(4) 0.03005(16) Uani 1 1 d .
Mo10 Mo -0.09260(6) 0.82717(4) 0.74935(4) 0.03849(18) Uani 1 1 d .
Mo11 Mo 0.19016(7) 0.87101(4) 0.72026(4) 0.03627(18) Uani 1 1 d .
Mo12 Mo 0.12779(8) 0.83649(4) 0.88813(4) 0.03952(19) Uani 1 1 d .
O1 O 0.0273(7) 0.4456(4) 0.5710(3) 0.0529(18) Uani 1 1 d .
O2 O 0.3400(5) 0.4615(4) 0.7715(3) 0.0422(14) Uani 1 1 d .
O3 O -0.0649(6) 0.3954(3) 0.8139(4) 0.0498(17) Uani 1 1 d .
O4 O -0.2562(5) 0.6697(4) 0.5513(3) 0.0426(15) Uani 1 1 d .
O5 O 0.1993(5) 0.7407(4) 0.5087(3) 0.0433(15) Uani 1 1 d .
O6 O 0.5157(5) 0.7567(4) 0.7122(4) 0.0535(18) Uani 1 1 d .
O7 O 0.4032(5) 0.6959(4) 0.9805(3) 0.0406(14) Uani 1 1 d .
O8 O 0.0007(5) 0.6334(4) 1.0186(3) 0.0419(15) Uani 1 1 d .
O9 O -0.3508(5) 0.6166(4) 0.7924(3) 0.0388(14) Uani 1 1 d .
O10 O -0.1972(6) 0.8817(4) 0.7358(4) 0.0498(16) Uani 1 1 d .
O11 O 0.2582(6) 0.9533(4) 0.6930(4) 0.0499(17) Uani 1 1 d .
O12 O 0.1556(7) 0.8970(4) 0.9622(3) 0.0544(18) Uani 1 1 d .
O13 O 0.1199(5) 0.6009(3) 0.5649(3) 0.0316(12) Uani 1 1 d .
O14 O 0.1836(5) 0.5296(3) 0.6816(3) 0.0335(12) Uani 1 1 d .
O15 O -0.0310(5) 0.4938(3) 0.7028(3) 0.0319(12) Uani 1 1 d .
O16 O -0.1024(4) 0.5663(3) 0.5855(3) 0.0312(12) Uani 1 1 d .
O17 O 0.3878(5) 0.6154(3) 0.7363(3) 0.0343(13) Uani 1 1 d .
O18 O 0.3396(5) 0.5864(3) 0.8667(3) 0.0359(13) Uani 1 1 d .
O19 O 0.2860(5) 0.7041(3) 0.6452(3) 0.0343(13) Uani 1 1 d .
O20 O -0.0117(5) 0.5301(3) 0.9004(3) 0.0334(12) Uani 1 1 d .
O21 O -0.1809(5) 0.5217(3) 0.7918(3) 0.0324(12) Uani 1 1 d .
O22 O 0.1347(5) 0.5030(3) 0.8087(3) 0.0316(12) Uani 1 1 d .
O23 O 0.4223(5) 0.7283(3) 0.8380(3) 0.0347(13) Uani 1 1 d .
O24 O 0.3147(5) 0.8144(3) 0.7426(3) 0.0334(12) Uani 1 1 d .
O25 O 0.1723(5) 0.6415(3) 0.9285(3) 0.0308(12) Uani 1 1 d .
O26 O 0.1484(5) 0.8078(3) 0.6352(3) 0.0327(12) Uani 1 1 d .
O27 O 0.2557(5) 0.7807(3) 0.8992(3) 0.0315(12) Uani 1 1 d .
O28 O -0.1988(4) 0.6258(3) 0.6907(3) 0.0305(12) Uani 1 1 d .
O29 O -0.1484(5) 0.6365(3) 0.8917(3) 0.0305(12) Uani 1 1 d .
O30 O -0.1666(5) 0.7379(3) 0.7891(3) 0.0316(12) Uani 1 1 d .
O31 O -0.1175(5) 0.7655(3) 0.6615(3) 0.0315(12) Uani 1 1 d .
O32 O 0.0407(5) 0.7467(3) 0.9204(3) 0.0299(12) Uani 1 1 d .
O33 O 0.2021(5) 0.8996(3) 0.8223(3) 0.0392(14) Uani 1 1 d .
O34 O 0.0324(5) 0.8920(3) 0.7131(3) 0.0330(12) Uani 1 1 d .
O35 O -0.0167(5) 0.8631(3) 0.8437(3) 0.0387(14) Uani 1 1 d .
O36 O -0.0166(4) 0.7083(3) 0.5556(3) 0.0302(12) Uani 1 1 d .
O37 O 0.0500(4) 0.6575(3) 0.6790(2) 0.0255(11) Uani 1 1 d .
O38 O 0.0012(4) 0.6308(3) 0.8020(3) 0.0232(10) Uani 1 1 d .
O39 O 0.0799(4) 0.7660(3) 0.7730(3) 0.0238(10) Uani 1 1 d .
O40 O 0.2097(4) 0.6640(3) 0.7823(2) 0.0233(10) Uani 1 1 d .
Dy1 Dy 0.50300(3) 0.22421(2) 0.717045(19) 0.03033(11) Uani 1 1 d .
O1W O 0.3388(6) 0.2564(4) 0.7696(3) 0.0538(17) Uani 1 1 d .
H1WB H 0.3289 0.2509 0.8130 0.065 Uiso 1 1 d R
H1WA H 0.2920 0.2735 0.7379 0.065 Uiso 1 1 d R
O2W O 0.4786(6) 0.0995(3) 0.6532(3) 0.0453(16) Uani 1 1 d .
H2WB H 0.4869 0.0569 0.6721 0.054 Uiso 1 1 d R
H2WA H 0.4613 0.1048 0.6086 0.054 Uiso 1 1 d R
O3W O 0.6813(6) 0.1737(5) 0.7484(4) 0.0592(19) Uani 1 1 d .
H3WB H 0.7467 0.2011 0.7643 0.071 Uiso 1 1 d R
H3WA H 0.6691 0.1246 0.7412 0.071 Uiso 1 1 d R
N1 N 0.2416(7) 0.1754(4) 0.6093(4) 0.0452(19) Uani 1 1 d .
N2 N -0.3186(8) -0.0423(5) 0.5154(4) 0.060(3) Uani 1 1 d .
C1 C 0.2046(9) 0.1187(6) 0.6500(5) 0.050(2) Uani 1 1 d .
H1A H 0.2541 0.1076 0.6898 0.060 Uiso 1 1 calc R
C2 C 0.0956(9) 0.0766(6) 0.6342(6) 0.056(3) Uani 1 1 d .
H2A H 0.0719 0.0372 0.6634 0.067 Uiso 1 1 calc R
C3 C 0.0194(10) 0.0914(7) 0.5755(6) 0.066(4) Uani 1 1 d .
C4 C 0.0617(12) 0.1502(8) 0.5367(7) 0.079(4) Uani 1 1 d U
H4A H 0.0126 0.1638 0.4978 0.095 Uiso 1 1 calc R
C5 C 0.1708(11) 0.1902(7) 0.5512(7) 0.072(3) Uani 1 1 d U
H5A H 0.1971 0.2279 0.5209 0.087 Uiso 1 1 calc R
C6 C -0.2541(14) -0.0547(10) 0.5752(9) 0.103(5) Uani 1 1 d U
H6A H -0.2840 -0.0917 0.6050 0.123 Uiso 1 1 calc R
C7 C -0.1382(15) -0.0123(10) 0.5954(9) 0.106(5) Uani 1 1 d U
H7A H -0.0906 -0.0251 0.6352 0.127 Uiso 1 1 calc R
C8 C -0.1004(10) 0.0452(7) 0.5565(6) 0.071(4) Uani 1 1 d .
C9 C -0.1769(10) 0.0602(7) 0.4984(6) 0.074(4) Uani 1 1 d .
H9A H -0.1548 0.1026 0.4719 0.089 Uiso 1 1 calc R
C10 C -0.2809(11) 0.0168(6) 0.4785(6) 0.066(3) Uani 1 1 d .
H10A H -0.3279 0.0284 0.4379 0.080 Uiso 1 1 calc R
O41 O 0.3449(6) 0.2180(4) 0.6246(3) 0.0471(16) Uani 1 1 d .
O42 O -0.4197(7) -0.0869(5) 0.4956(4) 0.070(2) Uani 1 1 d .
N3 N 0.4372(7) 0.1134(4) 0.8579(4) 0.0371(17) Uani 1 1 d .
N4 N 0.3753(8) 0.0141(4) 1.2104(4) 0.0443(18) Uani 1 1 d .
C11 C 0.3384(9) 0.0737(6) 0.8733(5) 0.053(3) Uani 1 1 d .
H11A H 0.2780 0.0557 0.8365 0.064 Uiso 1 1 calc R
C12 C 0.3241(9) 0.0589(6) 0.9431(5) 0.048(2) Uani 1 1 d .
H12A H 0.2527 0.0329 0.9525 0.057 Uiso 1 1 calc R
C13 C 0.4126(8) 0.0815(5) 0.9995(4) 0.0360(19) Uani 1 1 d .
C14 C 0.5134(9) 0.1214(5) 0.9814(5) 0.046(2) Uani 1 1 d .
H14A H 0.5766 0.1372 1.0170 0.055 Uiso 1 1 calc R
C15 C 0.5232(9) 0.1386(5) 0.9120(5) 0.050(2) Uani 1 1 d .
H15A H 0.5914 0.1685 0.9019 0.060 Uiso 1 1 calc R
C16 C 0.2826(11) 0.0017(7) 1.1593(5) 0.063(3) Uani 1 1 d .
H16A H 0.2104 -0.0216 1.1698 0.076 Uiso 1 1 calc R
C17 C 0.2951(10) 0.0238(7) 1.0908(5) 0.063(3) Uani 1 1 d .
H17A H 0.2311 0.0128 1.0550 0.076 Uiso 1 1 calc R
C18 C 0.3993(8) 0.0615(5) 1.0738(4) 0.0370(19) Uani 1 1 d .
C19 C 0.4904(9) 0.0746(6) 1.1291(5) 0.052(3) Uani 1 1 d .
H19A H 0.5626 0.1007 1.1209 0.062 Uiso 1 1 calc R
C20 C 0.4766(10) 0.0498(6) 1.1959(5) 0.057(3) Uani 1 1 d .
H20A H 0.5403 0.0582 1.2321 0.068 Uiso 1 1 calc R
O43 O 0.4479(6) 0.1241(4) 0.7912(3) 0.0513(17) Uani 1 1 d .
O44 O 0.3647(7) -0.0100(4) 1.2754(3) 0.0540(18) Uani 1 1 d .
N5 N 0.6191(6) 0.3499(4) 0.8602(3) 0.0352(16) Uani 1 1 d .
N6 N 0.7246(7) 0.6992(5) 1.0681(4) 0.0456(19) Uani 1 1 d .
C21 C 0.7241(7) 0.3737(5) 0.8985(4) 0.0327(18) Uani 1 1 d .
H21A H 0.7832 0.3437 0.8976 0.039 Uiso 1 1 calc R
C22 C 0.7445(7) 0.4425(5) 0.9390(4) 0.0316(17) Uani 1 1 d .
H22A H 0.8176 0.4587 0.9657 0.038 Uiso 1 1 calc R
C23 C 0.6582(7) 0.4882(5) 0.9410(4) 0.0314(17) Uani 1 1 d .
C24 C 0.5513(7) 0.4637(5) 0.8989(4) 0.0369(19) Uani 1 1 d .
H24A H 0.4921 0.4937 0.8981 0.044 Uiso 1 1 calc R
C25 C 0.5330(7) 0.3935(5) 0.8577(5) 0.0367(19) Uani 1 1 d .
H25A H 0.4619 0.3770 0.8289 0.044 Uiso 1 1 calc R
C26 C 0.7737(9) 0.6391(6) 1.0924(5) 0.046(2) Uani 1 1 d .
H26A H 0.8205 0.6434 1.1368 0.055 Uiso 1 1 calc R
C27 C 0.7534(8) 0.5700(5) 1.0504(5) 0.042(2) Uani 1 1 d .
H27A H 0.7893 0.5286 1.0660 0.051 Uiso 1 1 calc R
C28 C 0.6796(7) 0.5623(5) 0.9851(4) 0.0302(17) Uani 1 1 d .
C29 C 0.6288(7) 0.6260(5) 0.9636(5) 0.039(2) Uani 1 1 d .
H29A H 0.5786 0.6227 0.9205 0.047 Uiso 1 1 calc R
C30 C 0.6526(8) 0.6943(6) 1.0061(5) 0.045(2) Uani 1 1 d .
H30A H 0.6185 0.7368 0.9915 0.054 Uiso 1 1 calc R
O45 O 0.5982(6) 0.2834(4) 0.8234(3) 0.0460(16) Uani 1 1 d .
O46 O 0.7450(7) 0.7656(4) 1.1074(4) 0.0594(19) Uani 1 1 d .
N7 N 0.4789(6) 0.4131(4) 0.6626(3) 0.0310(14) Uani 1 1 d .
N8 N 0.3899(6) 0.7038(4) 0.4260(4) 0.0360(16) Uani 1 1 d .
C31 C 0.5493(8) 0.4820(5) 0.6725(5) 0.0373(19) Uani 1 1 d .
H31A H 0.6149 0.4890 0.7072 0.045 Uiso 1 1 calc R
C32 C 0.5240(8) 0.5429(5) 0.6307(4) 0.0356(19) Uani 1 1 d .
H32A H 0.5733 0.5904 0.6377 0.043 Uiso 1 1 calc R
C33 C 0.4273(6) 0.5338(4) 0.5793(4) 0.0265(15) Uani 1 1 d .
C34 C 0.3796(8) 0.4033(5) 0.6164(5) 0.040(2) Uani 1 1 d .
H34A H 0.3285 0.3565 0.6125 0.048 Uiso 1 1 calc R
C35 C 0.3537(7) 0.4643(5) 0.5742(4) 0.0342(18) Uani 1 1 d .
H35A H 0.2850 0.4574 0.5420 0.041 Uiso 1 1 calc R
C36 C 0.3221(8) 0.6330(5) 0.4165(4) 0.0384(19) Uani 1 1 d .
H36A H 0.2690 0.6211 0.3748 0.046 Uiso 1 1 calc R
C37 C 0.3296(7) 0.5796(5) 0.4656(4) 0.0333(18) Uani 1 1 d .
H37A H 0.2822 0.5315 0.4570 0.040 Uiso 1 1 calc R
C38 C 0.4072(6) 0.5951(4) 0.5292(4) 0.0273(16) Uani 1 1 d .
C39 C 0.4719(7) 0.6692(4) 0.5381(4) 0.0335(18) Uani 1 1 d .
H39A H 0.5232 0.6830 0.5802 0.040 Uiso 1 1 calc R
C40 C 0.4630(7) 0.7222(5) 0.4877(4) 0.0345(18) Uani 1 1 d .
H40A H 0.5075 0.7714 0.4958 0.041 Uiso 1 1 calc R
O47 O 0.5086(6) 0.3558(3) 0.7004(3) 0.0424(15) Uani 1 1 d .
O48 O 0.3826(6) 0.7533(4) 0.3750(3) 0.0476(16) Uani 1 1 d .
N9 N 0.8556(11) 0.6876(8) 0.2984(8) 0.100(4) Uani 1 1 d .
C41 C 0.9482(18) 0.7068(10) 0.3128(9) 0.104(5) Uani 1 1 d .
C42 C 1.0744(16) 0.7168(12) 0.3433(11) 0.146(9) Uani 1 1 d .
H42C H 1.0818 0.7183 0.3947 0.176 Uiso 1 1 calc R
H42A H 1.1145 0.7644 0.3285 0.176 Uiso 1 1 calc R
H42B H 1.1081 0.6740 0.3264 0.176 Uiso 1 1 calc R
O4W O 0.8419(16) 0.1981(10) 0.8812(9) 0.079(5) Uiso 0.50 1 d P
O5W O -0.466(2) 0.1019(13) 0.3858(12) 0.109(7) Uiso 0.50 1 d P
O6W O 0.035(3) 0.0434(19) 0.8084(17) 0.169(12) Uiso 0.50 1 d P
O7W O 0.961(3) 0.8386(17) 1.0754(15) 0.142(9) Uiso 0.50 1 d P
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'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Mo Mo -1.6832 0.6857 '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
O37 P1 O38 110.0(3) . .
O37 P1 O40 109.7(3) . .
O38 P1 O40 109.5(3) . .
O37 P1 O39 109.0(3) . .
O38 P1 O39 109.3(3) . .
O40 P1 O39 109.5(3) . .
O1 Mo1 O15 102.9(3) . .
O1 Mo1 O16 103.0(3) . .
O15 Mo1 O16 89.7(2) . .
O1 Mo1 O13 101.2(3) . .
O15 Mo1 O13 155.7(2) . .
O16 Mo1 O13 88.1(2) . .
O1 Mo1 O14 101.7(3) . .
O15 Mo1 O14 84.9(2) . .
O16 Mo1 O14 155.3(2) . .
O13 Mo1 O14 87.1(2) . .
O1 Mo1 O37 172.1(2) . .
O15 Mo1 O37 84.0(2) . .
O16 Mo1 O37 72.9(2) . .
O13 Mo1 O37 72.2(2) . .
O14 Mo1 O37 82.6(2) . .
O2 Mo2 O14 102.5(3) . .
O2 Mo2 O22 102.2(3) . .
O14 Mo2 O22 86.2(2) . .
O2 Mo2 O17 101.7(3) . .
O14 Mo2 O17 89.7(2) . .
O22 Mo2 O17 156.0(2) . .
O2 Mo2 O18 100.3(3) . .
O14 Mo2 O18 157.2(2) . .
O22 Mo2 O18 88.4(2) . .
O17 Mo2 O18 86.4(2) . .
O2 Mo2 O40 171.1(2) . .
O14 Mo2 O40 84.7(2) . .
O22 Mo2 O40 83.3(2) . .
O17 Mo2 O40 72.8(2) . .
O18 Mo2 O40 72.6(2) . .
O3 Mo3 O20 101.0(3) . .
O3 Mo3 O15 102.6(3) . .
O20 Mo3 O15 156.5(2) . .
O3 Mo3 O22 102.0(3) . .
O20 Mo3 O22 89.0(2) . .
O15 Mo3 O22 85.0(2) . .
O3 Mo3 O21 101.9(3) . .
O20 Mo3 O21 87.5(2) . .
O15 Mo3 O21 88.8(2) . .
O22 Mo3 O21 156.0(2) . .
O3 Mo3 O38 171.7(3) . .
O20 Mo3 O38 72.7(2) . .
O15 Mo3 O38 84.0(2) . .
O22 Mo3 O38 83.4(2) . .
O21 Mo3 O38 72.9(2) . .
O4 Mo4 O36 102.2(3) . .
O4 Mo4 O31 101.9(3) . .
O36 Mo4 O31 90.5(2) . .
O4 Mo4 O28 101.1(3) . .
O36 Mo4 O28 156.6(2) . .
O31 Mo4 O28 84.9(2) . .
O4 Mo4 O16 100.5(3) . .
O36 Mo4 O16 87.9(2) . .
O31 Mo4 O16 157.4(2) . .
O28 Mo4 O16 87.5(2) . .
O4 Mo4 O37 172.3(2) . .
O36 Mo4 O37 72.91(19) . .
O31 Mo4 O37 84.2(2) . .
O28 Mo4 O37 83.8(2) . .
O16 Mo4 O37 73.72(19) . .
O5 Mo5 O19 103.9(3) . .
O5 Mo5 O13 102.2(3) . .
O19 Mo5 O13 92.2(2) . .
O5 Mo5 O26 101.0(3) . .
O19 Mo5 O26 86.4(2) . .
O13 Mo5 O26 156.3(2) . .
O5 Mo5 O36 99.3(3) . .
O19 Mo5 O36 156.4(2) . .
O13 Mo5 O36 86.6(2) . .
O26 Mo5 O36 85.4(2) . .
O5 Mo5 O37 170.2(2) . .
O19 Mo5 O37 85.4(2) . .
O13 Mo5 O37 73.8(2) . .
O26 Mo5 O37 82.6(2) . .
O36 Mo5 O37 71.71(18) . .
O6 Mo6 O23 102.6(3) . .
O6 Mo6 O17 102.0(3) . .
O23 Mo6 O17 89.2(2) . .
O6 Mo6 O24 103.4(3) . .
O23 Mo6 O24 90.5(2) . .
O17 Mo6 O24 154.0(2) . .
O6 Mo6 O19 101.6(3) . .
O23 Mo6 O19 155.9(2) . .
O17 Mo6 O19 86.7(2) . .
O24 Mo6 O19 83.0(2) . .
O6 Mo6 O40 173.3(3) . .
O23 Mo6 O40 73.73(19) . .
O17 Mo6 O40 72.7(2) . .
O24 Mo6 O40 82.4(2) . .
O19 Mo6 O40 82.35(19) . .
O7 Mo7 O25 102.3(3) . .
O7 Mo7 O18 101.6(3) . .
O25 Mo7 O18 91.5(3) . .
O7 Mo7 O27 101.6(3) . .
O25 Mo7 O27 86.3(2) . .
O18 Mo7 O27 156.6(2) . .
O7 Mo7 O23 100.8(3) . .
O25 Mo7 O23 156.8(2) . .
O18 Mo7 O23 86.2(3) . .
O27 Mo7 O23 86.8(2) . .
O7 Mo7 O40 172.6(2) . .
O25 Mo7 O40 83.73(19) . .
O18 Mo7 O40 73.7(2) . .
O27 Mo7 O40 82.91(19) . .
O23 Mo7 O40 73.40(19) . .
O8 Mo8 O29 102.9(3) . .
O8 Mo8 O32 102.3(3) . .
O29 Mo8 O32 90.8(2) . .
O8 Mo8 O20 101.4(3) . .
O29 Mo8 O20 87.8(2) . .
O32 Mo8 O20 155.9(2) . .
O8 Mo8 O25 101.2(3) . .
O29 Mo8 O25 155.9(2) . .
O32 Mo8 O25 84.4(2) . .
O20 Mo8 O25 87.1(2) . .
O8 Mo8 O38 173.2(2) . .
O29 Mo8 O38 73.56(19) . .
O32 Mo8 O38 83.63(19) . .
O20 Mo8 O38 72.86(19) . .
O25 Mo8 O38 82.46(19) . .
O9 Mo9 O28 102.7(2) . .
O9 Mo9 O30 102.6(3) . .
O28 Mo9 O30 86.5(2) . .
O9 Mo9 O21 100.8(3) . .
O28 Mo9 O21 89.6(2) . .
O30 Mo9 O21 156.5(2) . .
O9 Mo9 O29 100.7(2) . .
O28 Mo9 O29 156.6(2) . .
O30 Mo9 O29 88.2(2) . .
O21 Mo9 O29 86.2(2) . .
O9 Mo9 O38 170.7(2) . .
O28 Mo9 O38 84.4(2) . .
O30 Mo9 O38 83.7(2) . .
O21 Mo9 O38 72.9(2) . .
O29 Mo9 O38 72.34(19) . .
O10 Mo10 O30 103.5(3) . .
O10 Mo10 O31 101.7(3) . .
O30 Mo10 O31 86.0(2) . .
O10 Mo10 O35 102.5(3) . .
O30 Mo10 O35 88.7(2) . .
O31 Mo10 O35 155.8(2) . .
O10 Mo10 O34 100.2(3) . .
O30 Mo10 O34 156.3(2) . .
O31 Mo10 O34 88.2(2) . .
O35 Mo10 O34 87.3(2) . .
O10 Mo10 O39 171.4(3) . .
O30 Mo10 O39 83.7(2) . .
O31 Mo10 O39 83.4(2) . .
O35 Mo10 O39 72.5(2) . .
O34 Mo10 O39 72.8(2) . .
O11 Mo11 O26 103.2(3) . .
O11 Mo11 O24 102.2(3) . .
O26 Mo11 O24 87.2(2) . .
O11 Mo11 O34 100.9(3) . .
O26 Mo11 O34 89.3(2) . .
O24 Mo11 O34 156.8(2) . .
O11 Mo11 O33 99.4(3) . .
O26 Mo11 O33 157.4(2) . .
O24 Mo11 O33 88.3(2) . .
O34 Mo11 O33 86.2(2) . .
O11 Mo11 O39 170.5(3) . .
O26 Mo11 O39 84.5(2) . .
O24 Mo11 O39 83.6(2) . .
O34 Mo11 O39 73.32(19) . .
O33 Mo11 O39 73.0(2) . .
O12 Mo12 O33 100.8(3) . .
O12 Mo12 O32 102.2(3) . .
O33 Mo12 O32 157.1(2) . .
O12 Mo12 O27 102.5(3) . .
O33 Mo12 O27 89.8(3) . .
O32 Mo12 O27 85.5(2) . .
O12 Mo12 O35 101.0(3) . .
O33 Mo12 O35 87.2(3) . .
O32 Mo12 O35 88.2(3) . .
O27 Mo12 O35 156.4(2) . .
O12 Mo12 O39 171.6(3) . .
O33 Mo12 O39 73.6(2) . .
O32 Mo12 O39 83.6(2) . .
O27 Mo12 O39 83.89(19) . .
O35 Mo12 O39 72.8(2) . .
Mo5 O13 Mo1 125.7(3) . .
Mo2 O14 Mo1 151.8(3) . .
Mo1 O15 Mo3 152.3(3) . .
Mo1 O16 Mo4 124.7(3) . .
Mo6 O17 Mo2 125.7(3) . .
Mo7 O18 Mo2 124.4(3) . .
Mo5 O19 Mo6 153.2(3) . .
Mo3 O20 Mo8 125.3(3) . .
Mo3 O21 Mo9 124.9(3) . .
Mo2 O22 Mo3 151.3(3) . .
Mo6 O23 Mo7 124.3(3) . .
Mo11 O24 Mo6 153.2(3) . .
Mo7 O25 Mo8 152.7(3) . .
Mo11 O26 Mo5 148.6(3) . .
Mo12 O27 Mo7 150.4(3) . .
Mo9 O28 Mo4 150.9(3) . .
Mo8 O29 Mo9 125.1(3) . .
Mo10 O30 Mo9 150.8(3) . .
Mo4 O31 Mo10 151.7(3) . .
Mo8 O32 Mo12 152.7(3) . .
Mo12 O33 Mo11 123.7(3) . .
Mo10 O34 Mo11 124.2(3) . .
Mo12 O35 Mo10 125.1(3) . .
Mo4 O36 Mo5 125.3(3) . .
P1 O37 Mo5 126.1(3) . .
P1 O37 Mo4 126.3(3) . .
Mo5 O37 Mo4 89.95(16) . .
P1 O37 Mo1 125.6(3) . .
Mo5 O37 Mo1 88.32(16) . .
Mo4 O37 Mo1 88.59(16) . .
P1 O38 Mo8 126.4(3) . .
P1 O38 Mo9 125.7(3) . .
Mo8 O38 Mo9 88.95(16) . .
P1 O38 Mo3 125.6(3) . .
Mo8 O38 Mo3 89.02(16) . .
Mo9 O38 Mo3 89.24(16) . .
P1 O39 Mo11 125.3(3) . .
P1 O39 Mo12 125.5(3) . .
Mo11 O39 Mo12 89.73(16) . .
P1 O39 Mo10 125.9(3) . .
Mo11 O39 Mo10 89.64(16) . .
Mo12 O39 Mo10 89.42(16) . .
P1 O40 Mo7 126.1(3) . .
P1 O40 Mo2 125.5(3) . .
Mo7 O40 Mo2 89.28(16) . .
P1 O40 Mo6 126.9(3) . .
Mo7 O40 Mo6 88.44(15) . .
Mo2 O40 Mo6 88.58(16) . .
O45 Dy1 O47 75.9(2) . .
O45 Dy1 O48 111.1(3) . 2_666
O47 Dy1 O48 76.4(2) . 2_666
O45 Dy1 O43 82.4(2) . .
O47 Dy1 O43 144.4(2) . .
O48 Dy1 O43 138.5(2) 2_666 .
O45 Dy1 O41 147.3(2) . .
O47 Dy1 O41 80.4(2) . .
O48 Dy1 O41 84.4(2) 2_666 .
O43 Dy1 O41 105.5(2) . .
O45 Dy1 O3W 70.7(2) . .
O47 Dy1 O3W 120.0(2) . .
O48 Dy1 O3W 71.4(2) 2_666 .
O43 Dy1 O3W 77.2(3) . .
O41 Dy1 O3W 141.7(3) . .
O45 Dy1 O1W 80.3(2) . .
O47 Dy1 O1W 75.9(2) . .
O48 Dy1 O1W 146.1(2) 2_666 .
O43 Dy1 O1W 72.9(3) . .
O41 Dy1 O1W 72.2(2) . .
O3W Dy1 O1W 140.7(2) . .
O45 Dy1 O2W 138.2(2) . .
O47 Dy1 O2W 142.7(2) . .
O48 Dy1 O2W 76.2(2) 2_666 .
O43 Dy1 O2W 69.2(2) . .
O41 Dy1 O2W 72.2(2) . .
O3W Dy1 O2W 73.5(2) . .
O1W Dy1 O2W 117.2(2) . .
Dy1 O1W H1WB 125.0 . .
Dy1 O1W H1WA 109.6 . .
H1WB O1W H1WA 125.4 . .
Dy1 O2W H2WB 125.6 . .
Dy1 O2W H2WA 109.3 . .
H2WB O2W H2WA 125.2 . .
Dy1 O3W H3WB 124.6 . .
Dy1 O3W H3WA 110.0 . .
H3WB O3W H3WA 125.4 . .
O41 N1 C1 122.1(7) . .
O41 N1 C5 118.7(8) . .
C1 N1 C5 119.3(9) . .
O42 N2 C6 119.5(10) . .
O42 N2 C10 122.1(8) . .
C6 N2 C10 118.4(10) . .
N1 C1 C2 121.0(8) . .
N1 C1 H1A 119.5 . .
C2 C1 H1A 119.5 . .
C1 C2 C3 121.3(9) . .
C1 C2 H2A 119.4 . .
C3 C2 H2A 119.4 . .
C4 C3 C2 114.8(10) . .
C4 C3 C8 122.8(9) . .
C2 C3 C8 122.3(9) . .
C5 C4 C3 123.7(12) . .
C5 C4 H4A 118.1 . .
C3 C4 H4A 118.1 . .
N1 C5 C4 119.7(11) . .
N1 C5 H5A 120.1 . .
C4 C5 H5A 120.1 . .
N2 C6 C7 121.3(14) . .
N2 C6 H6A 119.3 . .
C7 C6 H6A 119.3 . .
C8 C7 C6 119.0(14) . .
C8 C7 H7A 120.5 . .
C6 C7 H7A 120.5 . .
C7 C8 C9 116.6(11) . .
C7 C8 C3 121.0(11) . .
C9 C8 C3 122.4(9) . .
C10 C9 C8 122.9(10) . .
C10 C9 H9A 118.6 . .
C8 C9 H9A 118.6 . .
N2 C10 C9 121.3(9) . .
N2 C10 H10A 119.4 . .
C9 C10 H10A 119.4 . .
N1 O41 Dy1 135.2(5) . .
O43 N3 C11 118.7(8) . .
O43 N3 C15 122.9(8) . .
C11 N3 C15 118.4(8) . .
C20 N4 O44 120.4(8) . .
C20 N4 C16 120.1(8) . .
O44 N4 C16 119.5(9) . .
N3 C11 C12 120.8(9) . .
N3 C11 H11A 119.6 . .
C12 C11 H11A 119.6 . .
C11 C12 C13 122.1(9) . .
C11 C12 H12A 119.0 . .
C13 C12 H12A 119.0 . .
C14 C13 C12 115.3(8) . .
C14 C13 C18 122.7(8) . .
C12 C13 C18 121.9(8) . .
C13 C14 C15 121.3(9) . .
C13 C14 H14A 119.3 . .
C15 C14 H14A 119.3 . .
N3 C15 C14 121.9(9) . .
N3 C15 H15A 119.1 . .
C14 C15 H15A 119.1 . .
N4 C16 C17 119.4(10) . .
N4 C16 H16A 120.3 . .
C17 C16 H16A 120.3 . .
C18 C17 C16 122.1(10) . .
C18 C17 H17A 119.0 . .
C16 C17 H17A 119.0 . .
C19 C18 C17 115.7(8) . .
C19 C18 C13 122.8(8) . .
C17 C18 C13 121.4(8) . .
C20 C19 C18 120.9(9) . .
C20 C19 H19A 119.5 . .
C18 C19 H19A 119.5 . .
N4 C20 C19 121.7(9) . .
N4 C20 H20A 119.2 . .
C19 C20 H20A 119.2 . .
N3 O43 Dy1 140.1(5) . .
O45 N5 C21 120.0(7) . .
O45 N5 C25 118.4(7) . .
C21 N5 C25 121.7(7) . .
O46 N6 C30 118.4(9) . .
O46 N6 C26 119.2(8) . .
C30 N6 C26 122.3(8) . .
N5 C21 C22 119.7(8) . .
N5 C21 H21A 120.1 . .
C22 C21 H21A 120.1 . .
C21 C22 C23 121.2(7) . .
C21 C22 H22A 119.4 . .
C23 C22 H22A 119.4 . .
C22 C23 C24 118.0(8) . .
C22 C23 C28 121.3(7) . .
C24 C23 C28 120.7(8) . .
C23 C24 C25 119.7(8) . .
C23 C24 H24A 120.1 . .
C25 C24 H24A 120.1 . .
N5 C25 C24 119.6(7) . .
N5 C25 H25A 120.2 . .
C24 C25 H25A 120.2 . .
N6 C26 C27 119.0(8) . .
N6 C26 H26A 120.5 . .
C27 C26 H26A 120.5 . .
C26 C27 C28 120.7(9) . .
C26 C27 H27A 119.6 . .
C28 C27 H27A 119.6 . .
C29 C28 C27 117.7(8) . .
C29 C28 C23 122.1(7) . .
C27 C28 C23 120.2(8) . .
C30 C29 C28 120.1(8) . .
C30 C29 H29A 120.0 . .
C28 C29 H29A 120.0 . .
N6 C30 C29 120.2(9) . .
N6 C30 H30A 119.9 . .
C29 C30 H30A 119.9 . .
N5 O45 Dy1 142.0(5) . .
O47 N7 C34 120.7(7) . .
O47 N7 C31 118.2(7) . .
C34 N7 C31 121.0(7) . .
O48 N8 C40 121.4(7) . .
O48 N8 C36 119.6(7) . .
C40 N8 C36 119.1(7) . .
N7 C31 C32 119.9(8) . .
N7 C31 H31A 120.1 . .
C32 C31 H31A 120.1 . .
C33 C32 C31 121.0(8) . .
C33 C32 H32A 119.5 . .
C31 C32 H32A 119.5 . .
C35 C33 C32 117.2(7) . .
C35 C33 C38 121.5(7) . .
C32 C33 C38 121.2(7) . .
N7 C34 C35 119.2(7) . .
N7 C34 H34A 120.4 . .
C35 C34 H34A 120.4 . .
C33 C35 C34 121.5(8) . .
C33 C35 H35A 119.3 . .
C34 C35 H35A 119.3 . .
C37 C36 N8 121.7(8) . .
C37 C36 H36A 119.1 . .
N8 C36 H36A 119.1 . .
C36 C37 C38 121.2(8) . .
C36 C37 H37A 119.4 . .
C38 C37 H37A 119.4 . .
C39 C38 C37 115.2(7) . .
C39 C38 C33 122.8(7) . .
C37 C38 C33 121.7(7) . .
C40 C39 C38 122.6(8) . .
C40 C39 H39A 118.7 . .
C38 C39 H39A 118.7 . .
N8 C40 C39 120.1(8) . .
N8 C40 H40A 119.9 . .
C39 C40 H40A 119.9 . .
N7 O47 Dy1 151.4(5) . .
N8 O48 Dy1 129.0(5) . 2_666
N9 C41 C42 166(2) . .
C41 C42 H42C 109.5 . .
C41 C42 H42A 109.5 . .
H42C C42 H42A 109.5 . .
C41 C42 H42B 109.5 . .
H42C C42 H42B 109.5 . .
H42A C42 H42B 109.5 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
P1 O37 1.527(5) .
P1 O38 1.530(5) .
P1 O40 1.531(5) .
P1 O39 1.544(5) .
Mo1 O1 1.670(6) .
Mo1 O15 1.901(5) .
Mo1 O16 1.911(5) .
Mo1 O13 1.917(6) .
Mo1 O14 1.921(5) .
Mo1 O37 2.455(5) .
Mo2 O2 1.664(6) .
Mo2 O14 1.872(5) .
Mo2 O22 1.901(6) .
Mo2 O17 1.920(6) .
Mo2 O18 1.942(5) .
Mo2 O40 2.418(5) .
Mo3 O3 1.664(6) .
Mo3 O20 1.903(5) .
Mo3 O15 1.903(5) .
Mo3 O22 1.905(6) .
Mo3 O21 1.907(6) .
Mo3 O38 2.434(5) .
Mo4 O4 1.678(5) .
Mo4 O36 1.877(5) .
Mo4 O31 1.904(5) .
Mo4 O28 1.925(5) .
Mo4 O16 1.925(6) .
Mo4 O37 2.411(5) .
Mo5 O5 1.668(5) .
Mo5 O19 1.849(5) .
Mo5 O13 1.892(6) .
Mo5 O26 1.946(6) .
Mo5 O36 1.958(5) .
Mo5 O37 2.409(5) .
Mo6 O6 1.667(6) .
Mo6 O23 1.877(5) .
Mo6 O17 1.892(6) .
Mo6 O24 1.914(6) .
Mo6 O19 1.957(5) .
Mo6 O40 2.440(5) .
Mo7 O7 1.675(5) .
Mo7 O25 1.862(5) .
Mo7 O18 1.891(6) .
Mo7 O27 1.915(6) .
Mo7 O23 1.947(5) .
Mo7 O40 2.408(5) .
Mo8 O8 1.675(5) .
Mo8 O29 1.868(5) .
Mo8 O32 1.898(5) .
Mo8 O20 1.923(6) .
Mo8 O25 1.926(5) .
Mo8 O38 2.413(5) .
Mo9 O9 1.664(5) .
Mo9 O28 1.886(5) .
Mo9 O30 1.906(6) .
Mo9 O21 1.934(6) .
Mo9 O29 1.943(5) .
Mo9 O38 2.415(5) .
Mo10 O10 1.663(6) .
Mo10 O30 1.894(5) .
Mo10 O31 1.906(5) .
Mo10 O35 1.916(6) .
Mo10 O34 1.924(6) .
Mo10 O39 2.423(5) .
Mo11 O11 1.666(6) .
Mo11 O26 1.877(6) .
Mo11 O24 1.894(6) .
Mo11 O34 1.924(6) .
Mo11 O33 1.951(6) .
Mo11 O39 2.401(5) .
Mo12 O12 1.685(6) .
Mo12 O33 1.899(6) .
Mo12 O32 1.901(5) .
Mo12 O27 1.901(6) .
Mo12 O35 1.915(6) .
Mo12 O39 2.410(5) .
Dy1 O45 2.287(6) .
Dy1 O47 2.324(6) .
Dy1 O48 2.336(6) 2_666
Dy1 O43 2.345(6) .
Dy1 O41 2.354(6) .
Dy1 O3W 2.399(7) .
Dy1 O1W 2.405(7) .
Dy1 O2W 2.410(6) .
O1W H1WB 0.8490 .
O1W H1WA 0.8494 .
O2W H2WB 0.8494 .
O2W H2WA 0.8499 .
O3W H3WB 0.8496 .
O3W H3WA 0.8507 .
N1 O41 1.309(9) .
N1 C1 1.329(11) .
N1 C5 1.341(13) .
N2 O42 1.313(10) .
N2 C6 1.314(17) .
N2 C10 1.319(12) .
C1 C2 1.360(14) .
C1 H1A 0.9300 .
C2 C3 1.384(13) .
C2 H2A 0.9300 .
C3 C4 1.354(15) .
C3 C8 1.497(14) .
C4 C5 1.346(16) .
C4 H4A 0.9300 .
C5 H5A 0.9300 .
C6 C7 1.44(2) .
C6 H6A 0.9300 .
C7 C8 1.321(17) .
C7 H7A 0.9300 .
C8 C9 1.379(13) .
C9 C10 1.331(15) .
C9 H9A 0.9300 .
C10 H10A 0.9300 .
N3 O43 1.297(9) .
N3 C11 1.326(12) .
N3 C15 1.343(11) .
N4 C20 1.318(13) .
N4 O44 1.325(9) .
N4 C16 1.335(13) .
C11 C12 1.375(12) .
C11 H11A 0.9300 .
C12 C13 1.382(12) .
C12 H12A 0.9300 .
C13 C14 1.366(13) .
C13 C18 1.477(11) .
C14 C15 1.370(12) .
C14 H14A 0.9300 .
C15 H15A 0.9300 .
C16 C17 1.381(14) .
C16 H16A 0.9300 .
C17 C18 1.377(14) .
C17 H17A 0.9300 .
C18 C19 1.373(12) .
C19 C20 1.370(13) .
C19 H19A 0.9300 .
C20 H20A 0.9300 .
N5 O45 1.304(9) .
N5 C21 1.338(10) .
N5 C25 1.351(11) .
N6 O46 1.325(10) .
N6 C30 1.338(12) .
N6 C26 1.340(12) .
C21 C22 1.373(12) .
C21 H21A 0.9300 .
C22 C23 1.384(12) .
C22 H22A 0.9300 .
C23 C24 1.387(11) .
C23 C28 1.481(11) .
C24 C25 1.398(12) .
C24 H24A 0.9300 .
C25 H25A 0.9300 .
C26 C27 1.390(13) .
C26 H26A 0.9300 .
C27 C28 1.395(11) .
C27 H27A 0.9300 .
C28 C29 1.389(12) .
C29 C30 1.383(13) .
C29 H29A 0.9300 .
C30 H30A 0.9300 .
N7 O47 1.313(8) .
N7 C34 1.340(11) .
N7 C31 1.342(10) .
N8 O48 1.319(8) .
N8 C40 1.347(11) .
N8 C36 1.355(11) .
C31 C32 1.391(11) .
C31 H31A 0.9300 .
C32 C33 1.373(11) .
C32 H32A 0.9300 .
C33 C35 1.370(11) .
C33 C38 1.478(10) .
C34 C35 1.398(11) .
C34 H34A 0.9300 .
C35 H35A 0.9300 .
C36 C37 1.341(11) .
C36 H36A 0.9300 .
C37 C38 1.396(11) .
C37 H37A 0.9300 .
C38 C39 1.388(11) .
C39 C40 1.356(11) .
C39 H39A 0.9300 .
C40 H40A 0.9300 .
O48 Dy1 2.336(6) 2_666
N9 C41 1.08(2) .
C41 C42 1.49(2) .
C42 H42C 0.9600 .
C42 H42A 0.9600 .
C42 H42B 0.9600 .
