#------------------------------------------------------------------------------
#$Date: 2016-02-16 03:10:39 +0200 (Tue, 16 Feb 2016) $
#$Revision: 176453 $
#$URL: svn://www.crystallography.net/cod/cif/7/10/72/7107297.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_7107297
loop_
_publ_author_name
'Wendy L. Queen'
'J. Palmer West'
'Shiou-Jyh Hwu'
'Thanh Thao Tran'
'P. Shiv Halasyamani'
'Don VanDerveer'
_publ_section_title
;
 Symmetry preservation in a new noncentrosymmetric lattice comprised of
 acentric POM clusters residing in bowls of Cs+ -based half SOD B-cage
;
_journal_name_full               Chem.Commun.
_journal_page_first              1665
_journal_paper_doi               10.1039/c1cc16264k
_journal_volume                  48
_journal_year                    2012
_chemical_formula_sum            'As2 Cl Cs5 O42.6 V14'
_chemical_formula_weight         2244.60
_chemical_name_systematic
;
?
;
_space_group_IT_number           152
_symmetry_cell_setting           trigonal
_symmetry_space_group_name_Hall  'P 31 2"'
_symmetry_space_group_name_H-M   'P 31 2 1'
_atom_sites_solution_hydrogens   notdet
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            3
_cell_length_a                   13.1150(19)
_cell_length_b                   13.1150(19)
_cell_length_c                   25.527(5)
_cell_measurement_reflns_used    4488
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      26.3714
_cell_measurement_theta_min      2.1258
_cell_volume                     3802.5(11)
_computing_cell_refinement       'CrystalClear (Rigaku/MSC, 1999)'
_computing_data_collection       'CrystalClear (Rigaku/MSC, 1999)'
_computing_data_reduction        'CrystalClear (Rigaku/MSC, 1999)'
_computing_molecular_graphics    'SHELXL-97 (Sheldrick, 1997)'
_computing_publication_material  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_detector_area_resol_mean 14.6199
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_details
;
scan:
Number of images: 360
Slice: -90.0000 - 90.0000
Image width: 0.5000
Exp time: 10
Rotation axis: Omega
Omega: 0.0000
Chi: 45.0000
Phi: 0.0000
XTD: 27.1383
2theta: 0
scan:
Number of images: 120
Slice: -30.0000 - 30.0000
Image width: 0.5000
Exp time: 10
Rotation axis: Omega
Omega: 0.0000
Chi: 45.0000
Phi: 90.0000
XTD: 27.1383
2theta: 0
;
_diffrn_measurement_device_type  'Rigaku AFC8S'
_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  0.0872
_diffrn_reflns_av_sigmaI/netI    0.0644
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       30
_diffrn_reflns_limit_l_min       -30
_diffrn_reflns_number            32402
_diffrn_reflns_theta_full        25.04
_diffrn_reflns_theta_max         25.04
_diffrn_reflns_theta_min         2.39
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    7.432
_exptl_absorpt_correction_T_max  0.8078
_exptl_absorpt_correction_T_min  0.5236
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'REQAB, CrystalClear'
_exptl_crystal_colour            green
_exptl_crystal_density_diffrn    2.941
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       plate
_exptl_crystal_F_000             3062
_exptl_crystal_size_max          0.10
_exptl_crystal_size_mid          0.05
_exptl_crystal_size_min          0.03
_refine_diff_density_max         1.515
_refine_diff_density_min         -1.117
_refine_diff_density_rms         0.207
_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   -0.02(3)
_refine_ls_extinction_coef       0
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.017
_refine_ls_hydrogen_treatment    notdet
_refine_ls_matrix_type           full
_refine_ls_number_parameters     326
_refine_ls_number_reflns         4488
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.017
_refine_ls_R_factor_all          0.0773
_refine_ls_R_factor_gt           0.0652
_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)+(0.1123P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1699
_refine_ls_wR_factor_ref         0.1838
_reflns_number_gt                3711
_reflns_number_total             4488
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c1cc16264k.txt
_cod_data_source_block           Cs5V14As2O40Cl*2.6H2O
_cod_depositor_comments
;
The following automatic conversions were performed:

'_exptl_absorpt_correction_type' value 'multi scan' changed to
'multi-scan' according to the built-in table from CIF Core 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_cell_volume        3802.4(11)
_cod_original_sg_symbol_H-M      P3121
_cod_original_formula_sum        'As2 Cl Cs5 O42.60 V14'
_cod_database_code               7107297
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-y, x-y, z+1/3'
'-x+y, -x, z+2/3'
'y, x, -z'
'x-y, -y, -z+2/3'
'-x, -x+y, -z+1/3'
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
As As 0.24355(12) 0.79698(12) 0.03581(5) 0.0401(3) Uani 1 1 d .
Cs1 Cs 0.48766(12) 1.16585(12) 0.07155(5) 0.0801(5) Uani 0.92 1 d P
V1 V 0.30506(19) 0.83903(19) -0.10882(8) 0.0386(5) Uani 1 1 d .
V2 V -0.01556(19) 0.56278(19) 0.02575(8) 0.0361(5) Uani 1 1 d .
V3 V 0.13955(19) 0.4542(2) 0.09085(8) 0.0381(5) Uani 1 1 d .
V4 V 0.7592(2) 1.4813(2) 0.07851(8) 0.0391(5) Uani 1 1 d .
V5 V 0.2133(2) 0.9011(2) 0.15746(9) 0.0432(5) Uani 1 1 d .
V6 V 0.31632(19) 0.7288(2) 0.14594(8) 0.0386(5) Uani 1 1 d .
V7 V -0.0172(2) 0.7847(2) 0.07241(8) 0.0412(5) Uani 1 1 d .
Cl Cl 0.0000 0.5740(5) 0.1667 0.0647(14) Uani 1 2 d S
O4 O 0.7227(8) 1.5393(9) 0.1356(3) 0.044(2) Uani 1 1 d .
O5 O 0.2623(8) 0.8365(8) -0.1750(4) 0.045(2) Uani 1 1 d .
O1 O 0.0859(8) 0.7283(8) 0.0393(4) 0.043(2) Uani 1 1 d .
O6 O 0.2779(7) 0.6347(8) 0.2068(3) 0.0383(19) Uani 1 1 d .
O7 O 0.8579(8) 1.4237(8) 0.0562(4) 0.045(2) Uani 1 1 d .
O10 O 0.0900(8) 0.5262(8) 0.0381(3) 0.041(2) Uani 1 1 d .
O9 O -0.0389(10) 0.5471(10) -0.0361(3) 0.053(2) Uani 1 1 d .
O15 O 0.6525(8) 1.4322(10) 0.0386(4) 0.052(2) Uani 1 1 d .
O8 O 0.1830(9) 0.7567(9) -0.0784(4) 0.050(2) Uani 1 1 d .
O11 O 0.8749(8) 1.6166(9) 0.0515(4) 0.044(2) Uani 1 1 d .
O17 O 0.3125(10) 1.0349(9) 0.1561(4) 0.055(3) Uani 1 1 d .
O12 O 0.2030(9) 0.4009(10) 0.0560(4) 0.053(3) Uani 1 1 d .
O16 O 0.4571(8) 0.7932(9) 0.1440(4) 0.052(3) Uani 1 1 d .
O2 O 0.2693(9) 0.9380(8) 0.0201(4) 0.049(2) Uani 1 1 d .
O13 O 0.2651(8) 0.6157(8) 0.1034(4) 0.042(2) Uani 1 1 d .
O3 O 0.2674(8) 0.8239(8) 0.1047(3) 0.041(2) Uani 1 1 d .
O14 O -0.0134(9) 0.3371(8) 0.0920(4) 0.047(2) Uani 1 1 d .
O18 O 0.1099(8) 0.8888(8) 0.1093(4) 0.043(2) Uani 1 1 d .
O19 O -0.1273(9) 0.7651(9) 0.1194(4) 0.050(2) Uani 1 1 d .
O20 O -0.0316(10) 0.8598(11) 0.0278(4) 0.056(3) Uani 1 1 d .
Cs2 Cs -0.1056(3) 0.7297(3) -0.08276(10) 0.1087(10) Uani 0.63 1 d P
Cs5 Cs 0.4939(7) 1.5868(10) 0.0746(3) 0.141(3) Uani 0.32 1 d P
Cs3 Cs 0.1530(16) 1.1180(9) 0.0378(6) 0.223(7) Uani 0.26 1 d P
Cs4 Cs -0.0192(7) 0.7174(7) -0.1450(6) 0.165(5) Uani 0.24 1 d P
O21 O 0.411(3) 1.411(3) 0.0000 0.26(3) Uani 1 2 d S
O22 O 0.4445(18) 1.509(3) 0.1642(16) 0.170(15) Uani 0.80 1 d P
Cs6 Cs -0.268(4) 0.602(4) -0.0630(5) 0.27(2) Uani 0.13 1 d P
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
V V 0.3005 0.5294 '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'
Cs Cs -0.3680 2.1192 '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
O2 As O3 95.4(4) . .
O2 As O1 96.1(5) . .
O3 As O1 95.4(4) . .
O2 As Cs1 39.6(3) . .
O3 As Cs1 67.5(3) . .
O1 As Cs1 124.6(3) . .
O17 Cs1 O10 132.1(3) . 4_565
O17 Cs1 O22 59.1(5) . 6_655
O10 Cs1 O22 116.9(6) 4_565 6_655
O17 Cs1 O6 107.4(3) . 6_665
O10 Cs1 O6 113.9(2) 4_565 6_665
O22 Cs1 O6 67.4(4) 6_655 6_665
O17 Cs1 O15 136.9(3) . .
O10 Cs1 O15 89.0(2) 4_565 .
O22 Cs1 O15 119.6(4) 6_655 .
O6 Cs1 O15 52.2(2) 6_665 .
O17 Cs1 O2 71.9(3) . .
O10 Cs1 O2 62.9(2) 4_565 .
O22 Cs1 O2 103.8(4) 6_655 .
O6 Cs1 O2 168.8(3) 6_665 .
O15 Cs1 O2 135.9(2) . .
O17 Cs1 O9 99.1(3) . 4_565
O10 Cs1 O9 48.9(2) 4_565 4_565
O22 Cs1 O9 68.9(6) 6_655 4_565
O6 Cs1 O9 103.7(3) 6_665 4_565
O15 Cs1 O9 121.3(3) . 4_565
O2 Cs1 O9 65.8(3) . 4_565
O17 Cs1 O8 118.1(3) . 4_565
O10 Cs1 O8 74.9(2) 4_565 4_565
O22 Cs1 O8 59.3(4) 6_655 4_565
O6 Cs1 O8 50.5(2) 6_665 4_565
O15 Cs1 O8 80.1(3) . 4_565
O2 Cs1 O8 119.5(3) . 4_565
O9 Cs1 O8 53.7(3) 4_565 4_565
O17 Cs1 O12 122.1(3) . 4_565
O10 Cs1 O12 48.1(2) 4_565 4_565
O22 Cs1 O12 163.0(5) 6_655 4_565
O6 Cs1 O12 123.2(2) 6_665 4_565
O15 Cs1 O12 72.2(2) . 4_565
O2 Cs1 O12 63.6(3) . 4_565
O9 Cs1 O12 94.7(2) 4_565 4_565
O8 Cs1 O12 115.2(2) 4_565 4_565
O17 Cs1 O16 67.2(3) . 6_665
O10 Cs1 O16 160.2(2) 4_565 6_665
O22 Cs1 O16 65.8(5) 6_655 6_665
O6 Cs1 O16 47.4(2) 6_665 6_665
O15 Cs1 O16 73.9(3) . 6_665
O2 Cs1 O16 136.8(2) . 6_665
O9 Cs1 O16 133.1(2) 4_565 6_665
O8 Cs1 O16 92.0(2) 4_565 6_665
O12 Cs1 O16 131.2(2) 4_565 6_665
O17 Cs1 V4 127.6(2) . .
O10 Cs1 V4 99.99(17) 4_565 .
O22 Cs1 V4 96.4(3) 6_655 .
O6 Cs1 V4 29.03(17) 6_665 .
O15 Cs1 V4 23.23(16) . .
O2 Cs1 V4 157.88(18) . .
O9 Cs1 V4 114.7(2) 4_565 .
O8 Cs1 V4 64.04(18) 4_565 .
O12 Cs1 V4 94.67(18) 4_565 .
O16 Cs1 V4 60.51(17) 6_665 .
O17 Cs1 V2 117.8(2) . 4_565
O10 Cs1 V2 25.10(17) 4_565 4_565
O22 Cs1 V2 92.0(5) 6_655 4_565
O6 Cs1 V2 108.92(16) 6_665 4_565
O15 Cs1 V2 105.2(2) . 4_565
O2 Cs1 V2 63.3(2) . 4_565
O9 Cs1 V2 23.89(16) 4_565 4_565
O8 Cs1 V2 60.35(16) 4_565 4_565
O12 Cs1 V2 72.31(15) 4_565 4_565
O16 Cs1 V2 151.54(16) 6_665 4_565
V4 Cs1 V2 107.62(5) . 4_565
O8 V1 O5 104.3(5) . .
O8 V1 O14 102.9(5) . 4_565
O5 V1 O14 98.5(4) . 4_565
O8 V1 O7 102.3(5) . 4_455
O5 V1 O7 150.6(4) . 4_455
O14 V1 O7 87.6(4) 4_565 4_455
O8 V1 O6 101.4(5) . 3_564
O5 V1 O6 89.8(4) . 3_564
O14 V1 O6 151.5(4) 4_565 3_564
O7 V1 O6 72.8(4) 4_455 3_564
O8 V1 V4 108.3(4) . 4_455
O5 V1 V4 121.1(3) . 4_455
O14 V1 V4 119.4(3) 4_565 4_455
O7 V1 V4 36.2(3) 4_455 4_455
O6 V1 V4 36.9(3) 3_564 4_455
O8 V1 Cs4 46.7(4) . .
O5 V1 Cs4 59.2(4) . .
O14 V1 Cs4 96.8(4) 4_565 .
O7 V1 Cs4 148.9(4) 4_455 .
O6 V1 Cs4 110.8(3) 3_564 .
V4 V1 Cs4 141.73(16) 4_455 .
O8 V1 Cs1 53.5(4) . 4_455
O5 V1 Cs1 103.8(3) . 4_455
O14 V1 Cs1 150.8(3) 4_565 4_455
O7 V1 Cs1 82.2(3) 4_455 4_455
O6 V1 Cs1 48.0(2) 3_564 4_455
V4 V1 Cs1 63.28(6) 4_455 4_455
Cs4 V1 Cs1 79.15(14) . 4_455
O9 V2 O10 106.0(5) . .
O9 V2 O7 105.0(5) . 1_445
O10 V2 O7 95.5(4) . 1_445
O9 V2 O1 107.6(5) . .
O10 V2 O1 94.8(4) . .
O7 V2 O1 141.5(4) 1_445 .
O9 V2 O11 104.1(5) . 1_445
O10 V2 O11 149.9(4) . 1_445
O7 V2 O11 76.7(4) 1_445 1_445
O1 V2 O11 75.9(4) . 1_445
O9 V2 V4 108.3(4) . 1_445
O10 V2 V4 128.8(3) . 1_445
O7 V2 V4 39.4(3) 1_445 1_445
O1 V2 V4 109.4(3) . 1_445
O11 V2 V4 37.3(3) 1_445 1_445
O9 V2 Cs1 56.0(4) . 4_455
O10 V2 Cs1 50.4(3) . 4_455
O7 V2 Cs1 111.5(3) 1_445 4_455
O1 V2 Cs1 103.6(3) . 4_455
O11 V2 Cs1 159.4(3) 1_445 4_455
V4 V2 Cs1 146.76(9) 1_445 4_455
O9 V2 Cs2 46.2(4) . .
O10 V2 Cs2 140.7(3) . .
O7 V2 Cs2 116.4(3) 1_445 .
O1 V2 Cs2 74.8(3) . .
O11 V2 Cs2 65.2(3) 1_445 .
V4 V2 Cs2 89.90(9) 1_445 .
Cs1 V2 Cs2 94.62(7) 4_455 .
O9 V2 Cs6 51.7(5) . .
O10 V2 Cs6 157.5(4) . .
O7 V2 Cs6 88.5(7) 1_445 .
O1 V2 Cs6 95.8(7) . .
O11 V2 Cs6 52.6(3) 1_445 .
V4 V2 Cs6 65.3(4) 1_445 .
Cs1 V2 Cs6 107.6(2) 4_455 .
Cs2 V2 Cs6 27.9(6) . .
O12 V3 O14 103.6(5) . .
O12 V3 O5 104.8(5) . 2_665
O14 V3 O5 92.4(4) . 2_665
O12 V3 O10 101.7(5) . .
O14 V3 O10 85.7(4) . .
O5 V3 O10 153.1(4) 2_665 .
O12 V3 O13 103.0(5) . .
O14 V3 O13 152.9(4) . .
O5 V3 O13 85.9(4) 2_665 .
O10 V3 O13 83.8(4) . .
O12 V3 Cs5 53.1(4) . 1_545
O14 V3 Cs5 154.3(4) . 1_545
O5 V3 Cs5 84.7(3) 2_665 1_545
O10 V3 Cs5 108.1(3) . 1_545
O13 V3 Cs5 52.6(3) . 1_545
O12 V3 Cs1 57.2(4) . 4_455
O14 V3 Cs1 95.9(3) . 4_455
O5 V3 Cs1 161.6(3) 2_665 4_455
O10 V3 Cs1 44.4(3) . 4_455
O13 V3 Cs1 93.9(3) . 4_455
Cs5 V3 Cs1 80.66(12) 1_545 4_455
O15 V4 O11 107.0(5) . .
O15 V4 O4 108.8(5) . .
O11 V4 O4 99.4(5) . .
O15 V4 O7 106.7(5) . .
O11 V4 O7 82.5(4) . .
O4 V4 O7 142.1(4) . .
O15 V4 O6 105.7(5) . 6_665
O11 V4 O6 145.3(4) . 6_665
O4 V4 O6 80.5(4) . 6_665
O7 V4 O6 77.4(4) . 6_665
O15 V4 V2 112.2(4) . 1_665
O11 V4 V2 42.4(3) . 1_665
O4 V4 V2 130.3(3) . 1_665
O7 V4 V2 40.1(3) . 1_665
O6 V4 V2 112.9(3) 6_665 1_665
O15 V4 V6 113.0(4) . 6_665
O11 V4 V6 130.9(3) . 6_665
O4 V4 V6 41.4(3) . 6_665
O7 V4 V6 110.9(3) . 6_665
O6 V4 V6 39.1(3) 6_665 6_665
V2 V4 V6 132.29(10) 1_665 6_665
O15 V4 V1 114.8(4) . 4_565
O11 V4 V1 113.7(3) . 4_565
O4 V4 V1 111.9(3) . 4_565
O7 V4 V1 38.2(3) . 4_565
O6 V4 V1 39.5(3) 6_665 4_565
V2 V4 V1 74.26(8) 1_665 4_565
V6 V4 V1 73.75(8) 6_665 4_565
O15 V4 Cs1 52.0(4) . .
O11 V4 Cs1 154.8(3) . .
O4 V4 Cs1 100.9(3) . .
O7 V4 Cs1 90.4(3) . .
O6 V4 Cs1 53.8(3) 6_665 .
V2 V4 Cs1 126.13(8) 1_665 .
V6 V4 Cs1 74.18(7) 6_665 .
V1 V4 Cs1 71.73(7) 4_565 .
O15 V4 Cs6 49.4(8) . 1_665
O11 V4 Cs6 57.7(8) . 1_665
O4 V4 Cs6 117.4(4) . 1_665
O7 V4 Cs6 95.8(4) . 1_665
O6 V4 Cs6 151.7(7) 6_665 1_665
V2 V4 Cs6 73.5(5) 1_665 1_665
V6 V4 Cs6 152.4(4) 6_665 1_665
V1 V4 Cs6 130.6(3) 4_565 1_665
Cs1 V4 Cs6 99.4(7) . 1_665
O15 V4 Cs5 55.2(4) . .
O11 V4 Cs5 95.3(3) . .
O4 V4 Cs5 57.5(3) . .
O7 V4 Cs5 160.3(3) . .
O6 V4 Cs5 112.8(3) 6_665 .
V2 V4 Cs5 134.29(16) 1_665 .
V6 V4 Cs5 85.35(14) 6_665 .
V1 V4 Cs5 150.89(17) 4_565 .
Cs1 V4 Cs5 83.36(15) . .
Cs6 V4 Cs5 67.1(3) 1_665 .
O17 V5 O18 104.6(5) . .
O17 V5 O19 103.4(5) . 6
O18 V5 O19 97.1(5) . 6
O17 V5 O4 106.8(5) . 6_655
O18 V5 O4 145.8(4) . 6_655
O19 V5 O4 88.6(4) 6 6_655
O17 V5 O3 104.0(5) . .
O18 V5 O3 86.4(4) . .
O19 V5 O3 150.6(4) 6 .
O4 V5 O3 73.2(4) 6_655 .
O17 V5 Cs2 49.4(4) . 2_675
O18 V5 Cs2 107.3(3) . 2_675
O19 V5 Cs2 53.9(3) 6 2_675
O4 V5 Cs2 103.3(3) 6_655 2_675
O3 V5 Cs2 151.9(3) . 2_675
O17 V5 Cs6 47.7(5) . 2_675
O18 V5 Cs6 135.9(7) . 2_675
O19 V5 Cs6 66.1(7) 6 2_675
O4 V5 Cs6 77.1(6) 6_655 2_675
O3 V5 Cs6 128.8(8) . 2_675
Cs2 V5 Cs6 29.4(7) 2_675 2_675
O17 V5 Cs1 34.1(4) . .
O18 V5 Cs1 90.7(3) . .
O19 V5 Cs1 136.8(3) 6 .
O4 V5 Cs1 108.0(3) 6_655 .
O3 V5 Cs1 72.1(3) . .
Cs2 V5 Cs1 83.13(6) 2_675 .
Cs6 V5 Cs1 78.8(4) 2_675 .
O17 V5 Cs5 50.0(5) . 6_655
O18 V5 Cs5 153.7(3) . 6_655
O19 V5 Cs5 84.4(4) 6 6_655
O4 V5 Cs5 60.3(3) 6_655 6_655
O3 V5 Cs5 105.2(3) . 6_655
Cs2 V5 Cs5 52.88(17) 2_675 6_655
Cs6 V5 Cs5 24.0(7) 2_675 6_655
Cs1 V5 Cs5 71.25(11) . 6_655
O17 V5 Cs4 36.9(4) . 2_675
O18 V5 Cs4 87.6(4) . 2_675
O19 V5 Cs4 73.3(4) 6 2_675
O4 V5 Cs4 126.1(3) 6_655 2_675
O3 V5 Cs4 136.2(3) . 2_675
Cs2 V5 Cs4 26.8(2) 2_675 2_675
Cs6 V5 Cs4 49.1(5) 2_675 2_675
Cs1 V5 Cs4 64.63(16) . 2_675
Cs5 V5 Cs4 67.6(2) 6_655 2_675
O16 V6 O13 107.0(5) . .
O16 V6 O6 103.3(5) . .
O13 V6 O6 95.5(5) . .
O16 V6 O3 107.7(5) . .
O13 V6 O3 95.8(4) . .
O6 V6 O3 142.1(4) . .
O16 V6 O4 106.2(5) . 6_655
O13 V6 O4 146.9(4) . 6_655
O6 V6 O4 76.6(4) . 6_655
O3 V6 O4 74.2(4) . 6_655
O16 V6 V4 109.1(4) . 6_655
O13 V6 V4 127.2(3) . 6_655
O6 V6 V4 39.3(3) . 6_655
O3 V6 V4 108.3(3) . 6_655
O4 V6 V4 37.3(3) 6_655 6_655
O16 V6 Cs5 57.0(4) . 1_545
O13 V6 Cs5 51.4(3) . 1_545
O6 V6 Cs5 95.5(3) . 1_545
O3 V6 Cs5 119.6(3) . 1_545
O4 V6 Cs5 159.7(3) 6_655 1_545
V4 V6 Cs5 132.18(16) 6_655 1_545
O16 V6 Cs1 57.9(4) . 6_655
O13 V6 Cs1 108.8(3) . 6_655
O6 V6 Cs1 45.5(3) . 6_655
O3 V6 Cs1 154.1(3) . 6_655
O4 V6 Cs1 88.7(3) 6_655 6_655
V4 V6 Cs1 63.32(6) 6_655 6_655
Cs5 V6 Cs1 72.89(12) 1_545 6_655
O16 V6 Cs6 37.6(7) . 4_565
O13 V6 Cs6 69.6(7) . 4_565
O6 V6 Cs6 111.0(4) . 4_565
O3 V6 Cs6 106.9(4) . 4_565
O4 V6 Cs6 143.4(7) 6_655 4_565
V4 V6 Cs6 138.4(2) 6_655 4_565
Cs5 V6 Cs6 23.8(6) 1_545 4_565
Cs1 V6 Cs6 75.33(18) 6_655 4_565
O20 V7 O19 103.5(5) . .
O20 V7 O18 104.9(6) . .
O19 V7 O18 97.6(5) . .
O20 V7 O11 104.8(5) . 1_445
O19 V7 O11 86.9(4) . 1_445
O18 V7 O11 148.0(4) . 1_445
O20 V7 O1 103.7(5) . .
O19 V7 O1 149.8(4) . .
O18 V7 O1 87.8(4) . .
O11 V7 O1 73.7(4) 1_445 .
O20 V7 Cs3 46.7(5) . .
O19 V7 Cs3 106.4(4) . .
O18 V7 Cs3 58.2(4) . .
O11 V7 Cs3 150.2(4) 1_445 .
O1 V7 Cs3 101.7(3) . .
O20 V7 Cs2 45.5(4) . .
O19 V7 Cs2 119.1(3) . .
O18 V7 Cs2 135.4(3) . .
O11 V7 Cs2 64.3(3) 1_445 .
O1 V7 Cs2 73.3(3) . .
Cs3 V7 Cs2 86.0(3) . .
O20 V7 Cs2 58.3(4) . 4_465
O19 V7 Cs2 45.2(3) . 4_465
O18 V7 Cs2 107.2(3) . 4_465
O11 V7 Cs2 98.5(3) 1_445 4_465
O1 V7 Cs2 158.6(3) . 4_465
Cs3 V7 Cs2 74.9(3) . 4_465
Cs2 V7 Cs2 85.36(8) . 4_465
V4 O4 V5 139.3(6) . 6_665
V4 O4 V6 101.3(5) . 6_665
V5 O4 V6 106.5(4) 6_665 6_665
V4 O4 Cs5 98.0(3) . .
V5 O4 Cs5 91.9(4) 6_665 .
V6 O4 Cs5 122.1(4) 6_665 .
V1 O5 V3 143.9(6) . 3_564
V1 O5 Cs4 93.2(4) . .
V3 O5 Cs4 122.4(5) 3_564 .
As O1 V2 121.9(5) . .
As O1 V7 130.5(5) . .
V2 O1 V7 106.0(4) . .
V6 O6 V4 101.6(4) . 6_655
V6 O6 V1 135.2(5) . 2_665
V4 O6 V1 103.5(4) 6_655 2_665
V6 O6 Cs1 109.2(3) . 6_655
V4 O6 Cs1 97.1(3) 6_655 6_655
V1 O6 Cs1 103.7(3) 2_665 6_655
V4 O7 V2 100.6(5) . 1_665
V4 O7 V1 105.6(5) . 4_565
V2 O7 V1 137.3(5) 1_665 4_565
V2 O10 V3 141.6(5) . .
V2 O10 Cs1 104.5(4) . 4_455
V3 O10 Cs1 109.6(4) . 4_455
V2 O9 Cs2 112.4(5) . .
V2 O9 Cs1 100.2(5) . 4_455
Cs2 O9 Cs1 130.2(3) . 4_455
V2 O9 Cs6 107.2(5) . .
Cs2 O9 Cs6 34.7(8) . .
Cs1 O9 Cs6 152.5(4) 4_455 .
V2 O9 Cs4 138.9(6) . .
Cs2 O9 Cs4 34.6(3) . .
Cs1 O9 Cs4 97.2(3) 4_455 .
Cs6 O9 Cs4 60.5(6) . .
V4 O15 Cs1 104.7(5) . .
V4 O15 Cs6 108.8(10) . 1_665
Cs1 O15 Cs6 141.2(8) . 1_665
V4 O15 Cs5 139.9(6) . 4_465
Cs1 O15 Cs5 113.2(3) . 4_465
Cs6 O15 Cs5 31.1(8) 1_665 4_465
V4 O15 Cs5 104.1(5) . .
Cs1 O15 Cs5 106.2(3) . .
Cs6 O15 Cs5 84.0(4) 1_665 .
Cs5 O15 Cs5 77.9(3) 4_465 .
V1 O8 Cs4 110.0(5) . .
V1 O8 Cs1 104.2(5) . 4_455
Cs4 O8 Cs1 104.9(4) . 4_455
V1 O8 Cs2 133.6(5) . .
Cs4 O8 Cs2 33.6(3) . .
Cs1 O8 Cs2 111.9(3) 4_455 .
V4 O11 V2 100.3(5) . 1_665
V4 O11 V7 139.9(5) . 1_665
V2 O11 V7 103.8(4) 1_665 1_665
V4 O11 Cs6 95.9(9) . 1_665
V2 O11 Cs6 99.8(5) 1_665 1_665
V7 O11 Cs6 110.7(8) 1_665 1_665
V4 O11 Cs2 127.4(4) . 1_665
V2 O11 Cs2 85.4(3) 1_665 1_665
V7 O11 Cs2 86.4(3) 1_665 1_665
Cs6 O11 Cs2 32.5(8) 1_665 1_665
V5 O17 Cs1 128.6(5) . .
V5 O17 Cs6 110.6(7) . 2_675
Cs1 O17 Cs6 115.0(7) . 2_675
V5 O17 Cs2 108.3(5) . 2_675
Cs1 O17 Cs2 122.2(3) . 2_675
Cs6 O17 Cs2 37.2(9) 2_675 2_675
V5 O17 Cs4 126.5(6) . 2_675
Cs1 O17 Cs4 93.7(4) . 2_675
Cs6 O17 Cs4 66.0(8) 2_675 2_675
Cs2 O17 Cs4 36.0(3) 2_675 2_675
V5 O17 Cs5 109.5(5) . 6_655
Cs1 O17 Cs5 98.7(3) . 6_655
Cs6 O17 Cs5 30.0(9) 2_675 6_655
Cs2 O17 Cs5 67.0(3) 2_675 6_655
Cs4 O17 Cs5 91.1(4) 2_675 6_655
V3 O12 Cs5 104.7(5) . 1_545
V3 O12 Cs3 133.1(6) . 1_545
Cs5 O12 Cs3 109.4(4) 1_545 1_545
V3 O12 Cs1 100.6(5) . 4_455
Cs5 O12 Cs1 100.6(3) 1_545 4_455
Cs3 O12 Cs1 103.7(4) 1_545 4_455
V3 O12 Cs3 138.1(5) . 4_455
Cs5 O12 Cs3 117.2(3) 1_545 4_455
Cs3 O12 Cs3 33.5(6) 1_545 4_455
Cs1 O12 Cs3 70.3(4) 4_455 4_455
V6 O16 Cs4 162.8(7) . 4_565
V6 O16 Cs6 124.4(10) . 4_565
Cs4 O16 Cs6 68.9(10) 4_565 4_565
V6 O16 Cs5 100.3(5) . 1_545
Cs4 O16 Cs5 95.6(4) 4_565 1_545
Cs6 O16 Cs5 29.9(9) 4_565 1_545
V6 O16 Cs2 154.7(5) . 4_565
Cs4 O16 Cs2 34.8(3) 4_565 4_565
Cs6 O16 Cs2 34.6(9) 4_565 4_565
Cs5 O16 Cs2 63.4(3) 1_545 4_565
V6 O16 Cs1 100.0(4) . 6_655
Cs4 O16 Cs1 87.2(3) 4_565 6_655
Cs6 O16 Cs1 99.5(4) 4_565 6_655
Cs5 O16 Cs1 87.9(3) 1_545 6_655
Cs2 O16 Cs1 98.7(3) 4_565 6_655
As O2 Cs1 120.1(5) . .
As O2 Cs3 141.3(5) . .
Cs1 O2 Cs3 78.6(4) . .
V6 O13 V3 144.1(6) . .
V6 O13 Cs5 105.1(4) . 1_545
V3 O13 Cs5 99.3(4) . 1_545
As O3 V6 118.8(5) . .
As O3 V5 133.2(5) . .
V6 O3 V5 105.6(4) . .
V1 O14 V3 143.0(6) 4_455 .
V5 O18 V7 143.5(6) . .
V5 O18 Cs3 121.5(5) . .
V7 O18 Cs3 94.2(5) . .
V7 O19 V5 148.2(6) . 6
V7 O19 Cs2 111.6(4) . 4_465
V5 O19 Cs2 99.3(4) 6 4_465
V7 O19 Cs6 114.8(5) . 4_465
V5 O19 Cs6 87.1(6) 6 4_465
Cs2 O19 Cs6 33.3(7) 4_465 4_465
V7 O20 Cs3 111.0(7) . .
V7 O20 Cs2 113.9(6) . .
Cs3 O20 Cs2 122.2(4) . .
V7 O20 Cs2 100.2(4) . 4_465
Cs3 O20 Cs2 94.8(4) . 4_465
Cs2 O20 Cs2 110.8(3) . 4_465
V7 O20 Cs3 143.4(6) . 4_465
Cs3 O20 Cs3 34.0(5) . 4_465
Cs2 O20 Cs3 91.0(3) . 4_465
Cs2 O20 Cs3 94.9(3) 4_465 4_465
Cs4 Cs2 Cs6 122.6(7) . .
Cs4 Cs2 O17 76.3(3) . 3_464
Cs6 Cs2 O17 71.2(5) . 3_464
Cs4 Cs2 O9 81.8(3) . .
Cs6 Cs2 O9 81.7(5) . .
O17 Cs2 O9 126.8(3) 3_464 .
Cs4 Cs2 O20 135.4(3) . .
Cs6 Cs2 O20 97.8(7) . .
O17 Cs2 O20 140.3(3) 3_464 .
O9 Cs2 O20 86.9(3) . .
Cs4 Cs2 O19 107.4(3) . 4_465
Cs6 Cs2 O19 84.8(6) . 4_465
O17 Cs2 O19 49.0(3) 3_464 4_465
O9 Cs2 O19 166.3(3) . 4_465
O20 Cs2 O19 93.0(3) . 4_465
Cs4 Cs2 O16 60.3(3) . 4_455
Cs6 Cs2 O16 63.8(7) . 4_455
O17 Cs2 O16 66.9(3) 3_464 4_455
O9 Cs2 O16 60.1(3) . 4_455
O20 Cs2 O16 143.2(3) . 4_455
O19 Cs2 O16 115.0(3) 4_465 4_455
Cs4 Cs2 O8 55.1(3) . .
Cs6 Cs2 O8 134.1(6) . .
O17 Cs2 O8 131.4(3) 3_464 .
O9 Cs2 O8 52.6(3) . .
O20 Cs2 O8 84.1(3) . .
O19 Cs2 O8 141.1(3) 4_465 .
O16 Cs2 O8 87.6(3) 4_455 .
Cs4 Cs2 O20 133.6(3) . 4_465
Cs6 Cs2 O20 94.7(7) . 4_465
O17 Cs2 O20 93.4(2) 3_464 4_465
O9 Cs2 O20 134.6(2) . 4_465
O20 Cs2 O20 48.5(3) . 4_465
O19 Cs2 O20 44.7(2) 4_465 4_465
O16 Cs2 O20 154.1(3) 4_455 4_465
O8 Cs2 O20 118.3(3) . 4_465
Cs4 Cs2 Cs5 113.9(3) . 4_355
Cs6 Cs2 Cs5 11.3(5) . 4_355
O17 Cs2 Cs5 60.4(3) 3_464 4_355
O9 Cs2 Cs5 86.8(2) . 4_355
O20 Cs2 Cs5 108.3(3) . 4_355
O19 Cs2 Cs5 80.2(2) 4_465 4_355
O16 Cs2 Cs5 57.8(2) 4_455 4_355
O8 Cs2 Cs5 137.5(2) . 4_355
O20 Cs2 Cs5 98.3(2) 4_465 4_355
Cs4 Cs2 O11 129.2(3) . 1_445
Cs6 Cs2 O11 66.5(5) . 1_445
O17 Cs2 O11 137.6(3) 3_464 1_445
O9 Cs2 O11 48.4(2) . 1_445
O20 Cs2 O11 48.3(2) . 1_445
O19 Cs2 O11 123.4(3) 4_465 1_445
O16 Cs2 O11 95.1(2) 4_455 1_445
O8 Cs2 O11 82.5(2) . 1_445
O20 Cs2 O11 88.5(2) 4_465 1_445
Cs5 Cs2 O11 77.4(2) 4_355 1_445
Cs4 Cs2 V5 90.4(3) . 3_464
Cs6 Cs2 V5 76.4(4) . 3_464
O17 Cs2 V5 22.32(19) 3_464 3_464
O9 Cs2 V5 147.8(2) . 3_464
O20 Cs2 V5 119.1(2) . 3_464
O19 Cs2 V5 26.72(18) 4_465 3_464
O16 Cs2 V5 88.8(2) 4_455 3_464
O8 Cs2 V5 141.51(19) . 3_464
O20 Cs2 V5 71.24(16) 4_465 3_464
Cs5 Cs2 V5 67.86(14) 4_355 3_464
O11 Cs2 V5 135.97(18) 1_445 3_464
Cs6 Cs5 O22 121.0(10) 4_575 .
Cs6 Cs5 O21 124.1(9) 4_575 .
O22 Cs5 O21 112.6(11) . .
Cs6 Cs5 O15 74.4(7) 4_575 4_465
O22 Cs5 O15 153.4(6) . 4_465
O21 Cs5 O15 63.8(3) . 4_465
Cs6 Cs5 O13 101.8(9) 4_575 1_565
O22 Cs5 O13 76.9(5) . 1_565
O21 Cs5 O13 104.5(5) . 1_565
O15 Cs5 O13 78.7(3) 4_465 1_565
Cs6 Cs5 O12 140.8(9) 4_575 1_565
O22 Cs5 O12 82.1(7) . 1_565
O21 Cs5 O12 58.0(6) . 1_565
O15 Cs5 O12 74.0(3) 4_465 1_565
O13 Cs5 O12 49.4(2) 1_565 1_565
Cs6 Cs5 O17 65.1(6) 4_575 6_665
O22 Cs5 O17 58.8(8) . 6_665
O21 Cs5 O17 146.5(4) . 6_665
O15 Cs5 O17 139.2(4) 4_465 6_665
O13 Cs5 O17 104.4(3) 1_565 6_665
O12 Cs5 O17 138.7(4) 1_565 6_665
Cs6 Cs5 O16 65.7(8) 4_575 1_565
O22 Cs5 O16 74.8(7) . 1_565
O21 Cs5 O16 148.7(4) . 1_565
O15 Cs5 O16 95.6(4) 4_465 1_565
O13 Cs5 O16 45.9(2) 1_565 1_565
O12 Cs5 O16 95.0(3) 1_565 1_565
O17 Cs5 O16 64.2(3) 6_665 1_565
Cs6 Cs5 Cs2 13.2(5) 4_575 4_575
O22 Cs5 Cs2 107.9(8) . 4_575
O21 Cs5 Cs2 136.2(7) . 4_575
O15 Cs5 Cs2 86.7(3) 4_465 4_575
O13 Cs5 Cs2 100.2(3) 1_565 4_575
O12 Cs5 Cs2 146.0(3) 1_565 4_575
O17 Cs5 Cs2 52.5(2) 6_665 4_575
O16 Cs5 Cs2 58.7(2) 1_565 4_575
Cs6 Cs5 O15 100.6(8) 4_575 .
O22 Cs5 O15 96.3(6) . .
O21 Cs5 O15 57.4(4) . .
O15 Cs5 O15 102.1(3) 4_465 .
O13 Cs5 O15 156.9(4) 1_565 .
O12 Cs5 O15 108.3(4) 1_565 .
O17 Cs5 O15 90.1(3) 6_665 .
O16 Cs5 O15 153.9(3) 1_565 .
Cs2 Cs5 O15 102.9(3) 4_575 .
Cs6 Cs5 O4 88.2(8) 4_575 .
O22 Cs5 O4 66.8(4) . .
O21 Cs5 O4 99.4(3) . .
O15 Cs5 O4 138.9(3) 4_465 .
O13 Cs5 O4 142.1(3) 1_565 .
O12 Cs5 O4 131.0(4) 1_565 .
O17 Cs5 O4 47.1(2) 6_665 .
O16 Cs5 O4 111.0(3) 1_565 .
Cs2 Cs5 O4 81.5(2) 4_575 .
O15 Cs5 O4 44.1(2) . .
Cs6 Cs5 V6 85.2(8) 4_575 1_565
O22 Cs5 V6 71.3(5) . 1_565
O21 Cs5 V6 128.0(5) . 1_565
O15 Cs5 V6 90.1(3) 4_465 1_565
O13 Cs5 V6 23.54(17) 1_565 1_565
O12 Cs5 V6 72.2(2) 1_565 1_565
O17 Cs5 V6 82.3(2) 6_665 1_565
O16 Cs5 V6 22.79(16) 1_565 1_565
Cs2 Cs5 V6 80.3(2) 4_575 1_565
O15 Cs5 V6 167.5(3) . 1_565
O4 Cs5 V6 126.0(2) . 1_565
Cs3 Cs3 O20 91.5(4) 4_465 .
Cs3 Cs3 O18 138.8(5) 4_465 .
O20 Cs3 O18 49.8(3) . .
Cs3 Cs3 O2 104.7(8) 4_465 .
O20 Cs3 O2 66.5(3) . .
O18 Cs3 O2 51.6(3) . .
Cs3 Cs3 O12 80.4(8) 4_465 1_565
O20 Cs3 O12 145.7(7) . 1_565
O18 Cs3 O12 138.9(5) . 1_565
O2 Cs3 O12 147.8(6) . 1_565
Cs3 Cs3 O20 54.4(3) 4_465 4_465
O20 Cs3 O20 48.5(4) . 4_465
O18 Cs3 O20 96.1(4) . 4_465
O2 Cs3 O20 106.0(4) . 4_465
O12 Cs3 O20 102.5(5) 1_565 4_465
Cs3 Cs3 O12 66.1(6) 4_465 4_565
O20 Cs3 O12 111.7(4) . 4_565
O18 Cs3 O12 110.6(5) . 4_565
O2 Cs3 O12 59.9(3) . 4_565
O12 Cs3 O12 95.5(4) 1_565 4_565
O20 Cs3 O12 112.6(5) 4_465 4_565
Cs3 Cs3 O21 73.9(3) 4_465 .
O20 Cs3 O21 158.0(5) . .
O18 Cs3 O21 136.6(7) . .
O2 Cs3 O21 100.8(4) . .
O12 Cs3 O21 49.3(2) 1_565 .
O20 Cs3 O21 126.0(5) 4_465 .
O12 Cs3 O21 47.6(2) 4_565 .
Cs3 Cs3 V7 113.1(4) 4_465 .
O20 Cs3 V7 22.3(2) . .
O18 Cs3 V7 27.56(19) . .
O2 Cs3 V7 57.2(2) . .
O12 Cs3 V7 150.4(5) 1_565 .
O20 Cs3 V7 69.5(3) 4_465 .
O12 Cs3 V7 114.0(4) 4_565 .
O21 Cs3 V7 157.6(5) . .
Cs3 Cs3 Cs1 119.0(7) 4_465 .
O20 Cs3 Cs1 112.0(5) . .
O18 Cs3 Cs1 73.4(4) . .
O2 Cs3 Cs1 48.5(3) . .
O12 Cs3 Cs1 100.9(4) 1_565 .
O20 Cs3 Cs1 153.7(4) 4_465 .
O12 Cs3 Cs1 53.0(3) 4_565 .
O21 Cs3 Cs1 63.9(3) . .
V7 Cs3 Cs1 95.2(4) . .
Cs3 Cs3 Cs4 145.1(7) 4_465 2_675
O20 Cs3 Cs4 119.6(5) . 2_675
O18 Cs3 Cs4 76.0(4) . 2_675
O2 Cs3 Cs4 102.3(5) . 2_675
O12 Cs3 Cs4 65.1(3) 1_565 2_675
O20 Cs3 Cs4 135.9(5) 4_465 2_675
O12 Cs3 Cs4 110.7(5) 4_565 2_675
O21 Cs3 Cs4 79.6(4) . 2_675
V7 Cs3 Cs4 100.1(4) . 2_675
Cs1 Cs3 Cs4 66.0(3) . 2_675
Cs3 Cs3 Cs2 92.3(5) 4_465 4_465
O20 Cs3 Cs2 47.5(3) . 4_465
O18 Cs3 Cs2 72.7(3) . 4_465
O2 Cs3 Cs2 112.2(3) . 4_465
O12 Cs3 Cs2 99.2(4) 1_565 4_465
O20 Cs3 Cs2 40.1(2) 4_465 4_465
O12 Cs3 Cs2 151.4(5) 4_565 4_465
O21 Cs3 Cs2 146.6(4) . 4_465
V7 Cs3 Cs2 55.77(19) . 4_465
Cs1 Cs3 Cs2 145.1(4) . 4_465
Cs4 Cs3 Cs2 97.7(3) 2_675 4_465
Cs2 Cs4 O22 131.5(9) . 3_464
Cs2 Cs4 O8 91.3(5) . .
O22 Cs4 O8 67.4(7) 3_464 .
Cs2 Cs4 O16 84.9(4) . 4_455
O22 Cs4 O16 64.6(4) 3_464 4_455
O8 Cs4 O16 109.8(4) . 4_455
Cs2 Cs4 O5 133.6(4) . .
O22 Cs4 O5 63.5(5) 3_464 .
O8 Cs4 O5 50.2(3) . .
O16 Cs4 O5 128.1(5) 4_455 .
Cs2 Cs4 O17 67.7(3) . 3_464
O22 Cs4 O17 126.8(6) 3_464 3_464
O8 Cs4 O17 159.1(6) . 3_464
O16 Cs4 O17 70.4(3) 4_455 3_464
O5 Cs4 O17 146.5(5) . 3_464
Cs2 Cs4 O9 63.7(4) . .
O22 Cs4 O9 68.6(8) 3_464 .
O8 Cs4 O9 55.2(3) . .
O16 Cs4 O9 61.1(3) 4_455 .
O5 Cs4 O9 101.2(3) . .
O17 Cs4 O9 112.2(4) 3_464 .
Cs2 Cs4 Cs6 28.7(7) . .
O22 Cs4 Cs6 114.9(8) 3_464 .
O8 Cs4 Cs6 106.9(6) . .
O16 Cs4 Cs6 57.2(7) 4_455 .
O5 Cs4 Cs6 156.8(6) . .
O17 Cs4 Cs6 54.8(4) 3_464 .
O9 Cs4 Cs6 59.7(4) . .
Cs2 Cs4 V1 109.2(4) . .
O22 Cs4 V1 66.9(4) 3_464 .
O8 Cs4 V1 23.3(2) . .
O16 Cs4 V1 124.7(3) 4_455 .
O5 Cs4 V1 27.51(18) . .
O17 Cs4 V1 164.8(4) 3_464 .
O9 Cs4 V1 77.6(2) . .
Cs6 Cs4 V1 129.3(6) . .
Cs2 Cs4 Cs3 122.9(4) . 3_464
O22 Cs4 Cs3 102.3(9) 3_464 3_464
O8 Cs4 Cs3 131.8(5) . 3_464
O16 Cs4 Cs3 106.4(4) 4_455 3_464
O5 Cs4 Cs3 82.4(4) . 3_464
O17 Cs4 Cs3 64.6(3) 3_464 3_464
O9 Cs4 Cs3 166.6(4) . 3_464
Cs6 Cs4 Cs3 119.3(4) . 3_464
V1 Cs4 Cs3 108.5(4) . 3_464
Cs2 Cs4 V5 62.8(2) . 3_464
O22 Cs4 V5 142.7(6) 3_464 3_464
O8 Cs4 V5 148.8(5) . 3_464
O16 Cs4 V5 86.3(3) 4_455 3_464
O5 Cs4 V5 137.8(3) . 3_464
O17 Cs4 V5 16.6(2) 3_464 3_464
O9 Cs4 V5 118.5(4) . 3_464
Cs6 Cs4 V5 58.8(3) . 3_464
V1 Cs4 V5 148.3(3) . 3_464
Cs3 Cs4 V5 62.4(2) 3_464 3_464
Cs2 Cs4 Cs1 101.8(3) . 3_464
O22 Cs4 Cs1 88.1(6) 3_464 3_464
O8 Cs4 Cs1 155.0(4) . 3_464
O16 Cs4 Cs1 51.3(2) 4_455 3_464
O5 Cs4 Cs1 124.1(5) . 3_464
O17 Cs4 Cs1 40.4(2) 3_464 3_464
O9 Cs4 Cs1 112.0(3) . 3_464
Cs6 Cs4 Cs1 77.9(6) . 3_464
V1 Cs4 Cs1 148.4(4) . 3_464
Cs3 Cs4 Cs1 56.5(3) 3_464 3_464
V5 Cs4 Cs1 54.77(9) 3_464 3_464
Cs5 O21 Cs5 104.3(14) . 4_465
Cs5 O21 Cs3 136.6(7) . 4_465
Cs5 O21 Cs3 116.9(6) 4_465 4_465
Cs5 O21 Cs3 116.9(6) . .
Cs5 O21 Cs3 136.6(7) 4_465 .
Cs3 O21 Cs3 32.2(7) 4_465 .
Cs5 O22 Cs4 123.5(16) . 2_675
Cs5 O22 Cs1 121.4(11) . 6_665
Cs4 O22 Cs1 114.0(11) 2_675 6_665
Cs5 O22 Cs6 23.9(6) . 4_575
Cs4 O22 Cs6 147.3(15) 2_675 4_575
Cs1 O22 Cs6 98.5(9) 6_665 4_575
Cs5 Cs6 Cs2 155.5(8) 4_355 .
Cs5 Cs6 O17 84.9(8) 4_355 3_464
Cs2 Cs6 O17 71.6(7) . 3_464
Cs5 Cs6 O16 84.4(13) 4_355 4_455
Cs2 Cs6 O16 81.6(7) . 4_455
O17 Cs6 O16 71.1(4) 3_464 4_455
Cs5 Cs6 O15 74.4(13) 4_355 1_445
Cs2 Cs6 O15 128.1(11) . 1_445
O17 Cs6 O15 158.8(18) 3_464 1_445
O16 Cs6 O15 101.6(9) 4_455 1_445
Cs5 Cs6 O11 122.5(13) 4_355 1_445
Cs2 Cs6 O11 81.0(11) . 1_445
O17 Cs6 O11 152.5(17) 3_464 1_445
O16 Cs6 O11 107.0(6) 4_455 1_445
O15 Cs6 O11 48.1(3) 1_445 1_445
Cs5 Cs6 O9 124.7(15) 4_355 .
Cs2 Cs6 O9 63.6(8) . .
O17 Cs6 O9 116.5(8) 3_464 .
O16 Cs6 O9 60.1(4) 4_455 .
O15 Cs6 O9 73.3(4) 1_445 .
O11 Cs6 O9 48.6(4) 1_445 .
Cs5 Cs6 Cs4 130.6(9) 4_355 .
Cs2 Cs6 Cs4 28.6(3) . .
O17 Cs6 Cs4 59.3(5) 3_464 .
O16 Cs6 Cs4 53.9(5) 4_455 .
O15 Cs6 Cs4 133.0(7) 1_445 .
O11 Cs6 Cs4 96.8(10) 1_445 .
O9 Cs6 Cs4 59.7(6) . .
Cs5 Cs6 O19 106.1(7) 4_355 4_465
Cs2 Cs6 O19 61.9(9) . 4_465
O17 Cs6 O19 45.2(4) 3_464 4_465
O16 Cs6 O19 112.5(6) 4_455 4_465
O15 Cs6 O19 145.9(7) 1_445 4_465
O11 Cs6 O19 119.1(13) 1_445 4_465
O9 Cs6 O19 125.5(14) . 4_465
Cs4 Cs6 O19 73.3(8) . 4_465
Cs5 Cs6 O22 35.1(8) 4_355 4_355
Cs2 Cs6 O22 120.5(8) . 4_355
O17 Cs6 O22 52.1(7) 3_464 4_355
O16 Cs6 O22 64.7(8) 4_455 4_355
O15 Cs6 O22 106.7(15) 1_445 4_355
O11 Cs6 O22 153.2(14) 1_445 4_355
O9 Cs6 O22 123.2(8) . 4_355
Cs4 Cs6 O22 97.4(7) . 4_355
O19 Cs6 O22 86.8(5) 4_465 4_355
Cs5 Cs6 V5 86.6(6) 4_355 3_464
Cs2 Cs6 V5 74.2(7) . 3_464
O17 Cs6 V5 21.8(2) 3_464 3_464
O16 Cs6 V5 92.9(3) 4_455 3_464
O15 Cs6 V5 154.7(11) 1_445 3_464
O11 Cs6 V5 145.4(14) 1_445 3_464
O9 Cs6 V5 131.9(10) . 3_464
Cs4 Cs6 V5 72.2(5) . 3_464
O19 Cs6 V5 26.8(2) 4_465 3_464
O22 Cs6 V5 61.1(5) 4_355 3_464
Cs5 Cs6 V4 96.3(12) 4_355 1_445
Cs2 Cs6 V4 106.6(10) . 1_445
O17 Cs6 V4 175.3(7) 3_464 1_445
O16 Cs6 V4 104.4(6) 4_455 1_445
O15 Cs6 V4 21.8(2) 1_445 1_445
O11 Cs6 V4 26.3(2) 1_445 1_445
O9 Cs6 V4 59.2(3) . 1_445
Cs4 Cs6 V4 117.1(8) . 1_445
O19 Cs6 V4 138.1(9) 4_465 1_445
O22 Cs6 V4 127.8(14) 4_355 1_445
V5 Cs6 V4 162.6(7) 3_464 1_445
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
As O2 1.752(10) .
As O3 1.790(9) .
As O1 1.798(9) .
As Cs1 4.359(2) .
Cs1 O17 2.989(11) .
Cs1 O10 3.096(9) 4_565
Cs1 O22 3.15(4) 6_655
Cs1 O6 3.161(9) 6_665
Cs1 O15 3.167(11) .
Cs1 O2 3.209(9) .
Cs1 O9 3.276(11) 4_565
Cs1 O8 3.427(11) 4_565
Cs1 O12 3.563(11) 4_565
Cs1 O16 3.597(11) 6_665
Cs1 V4 3.885(3) .
Cs1 V2 3.892(3) 4_565
V1 O8 1.613(10) .
V1 O5 1.774(10) .
V1 O14 1.814(11) 4_565
V1 O7 1.976(9) 4_455
V1 O6 2.014(9) 3_564
V1 V4 3.075(3) 4_455
V1 Cs4 3.835(8) .
V1 Cs1 4.130(3) 4_455
V2 O9 1.601(9) .
V2 O10 1.706(9) .
V2 O7 1.913(10) 1_445
V2 O1 1.927(9) .
V2 O11 2.002(10) 1_445
V2 V4 2.920(3) 1_445
V2 Cs1 3.892(3) 4_455
V2 Cs2 4.055(3) .
V2 Cs6 4.25(2) .
V3 O12 1.598(9) .
V3 O14 1.818(11) .
V3 O5 1.823(10) 2_665
V3 O10 1.934(9) .
V3 O13 1.953(10) .
V3 Cs5 4.088(8) 1_545
V3 Cs1 4.165(3) 4_455
V4 O15 1.584(9) .
V4 O11 1.799(10) .
V4 O4 1.815(9) .
V4 O7 1.884(10) .
V4 O6 1.900(9) 6_665
V4 V2 2.920(3) 1_665
V4 V6 2.937(3) 6_665
V4 V1 3.075(3) 4_565
V4 Cs6 4.032(13) 1_665
V4 Cs5 4.340(8) .
V5 O17 1.578(10) .
V5 O18 1.777(10) .
V5 O19 1.799(10) 6
V5 O4 1.980(10) 6_655
V5 O3 2.016(9) .
V5 Cs2 3.947(3) 2_675
V5 Cs6 3.987(17) 2_675
V5 Cs5 4.254(7) 6_655
V5 Cs4 4.439(9) 2_675
V6 O16 1.601(9) .
V6 O13 1.683(9) .
V6 O6 1.890(9) .
V6 O3 1.968(9) .
V6 O4 1.982(10) 6_655
V6 V4 2.937(3) 6_655
V6 Cs5 4.068(8) 1_545
V6 Cs1 4.183(3) 6_655
V6 Cs6 4.29(3) 4_565
V7 O20 1.578(10) .
V7 O19 1.793(10) .
V7 O18 1.804(10) .
V7 O11 2.007(10) 1_445
V7 O1 2.022(10) .
V7 Cs3 3.888(10) .
V7 Cs2 4.089(3) .
V7 Cs2 4.235(4) 4_465
O4 V5 1.980(10) 6_665
O4 V6 1.982(10) 6_665
O4 Cs5 3.698(12) .
O5 V3 1.823(10) 3_564
O5 Cs4 3.301(15) .
O6 V4 1.900(9) 6_655
O6 V1 2.014(9) 2_665
O6 Cs1 3.161(8) 6_655
O7 V2 1.913(10) 1_665
O7 V1 1.976(9) 4_565
O10 Cs1 3.096(9) 4_455
O9 Cs2 3.165(12) .
O9 Cs1 3.276(11) 4_455
O9 Cs6 3.49(3) .
O9 Cs4 3.495(15) .
O15 Cs6 3.23(3) 1_665
O15 Cs5 3.232(12) 4_465
O15 Cs5 3.673(14) .
O8 Cs4 2.970(13) .
O8 Cs1 3.427(11) 4_455
O8 Cs2 3.622(11) .
O11 V2 2.002(10) 1_665
O11 V7 2.007(10) 1_665
O11 Cs6 3.43(2) 1_665
O11 Cs2 3.692(10) 1_665
O17 Cs6 3.149(17) 2_675
O17 Cs2 3.157(11) 2_675
O17 Cs4 3.314(13) 2_675
O17 Cs5 3.458(14) 6_655
O12 Cs5 3.380(13) 1_545
O12 Cs3 3.461(14) 1_545
O12 Cs1 3.563(11) 4_455
O12 Cs3 3.731(18) 4_455
O16 Cs4 3.051(12) 4_565
O16 Cs6 3.17(2) 4_565
O16 Cs5 3.465(14) 1_545
O16 Cs2 3.499(10) 4_565
O16 Cs1 3.597(11) 6_655
O2 Cs3 3.421(19) .
O13 Cs5 3.291(11) 1_545
O14 V1 1.814(11) 4_455
O18 Cs3 3.314(17) .
O19 V5 1.799(10) 6
O19 Cs2 3.233(10) 4_465
O19 Cs6 3.65(3) 4_465
O20 Cs3 3.032(17) .
O20 Cs2 3.187(11) .
O20 Cs2 3.661(11) 4_465
O20 Cs3 3.73(2) 4_465
Cs2 Cs4 2.004(16) .
Cs2 Cs6 2.01(5) .
Cs2 O17 3.157(11) 3_464
Cs2 O19 3.233(10) 4_465
Cs2 O16 3.499(10) 4_455
Cs2 O20 3.661(11) 4_465
Cs2 Cs5 3.662(11) 4_355
Cs2 O11 3.692(10) 1_445
Cs2 V5 3.947(3) 3_464
Cs5 Cs6 1.74(5) 4_575
Cs5 O22 2.46(4) .
Cs5 O21 2.76(3) .
Cs5 O15 3.232(12) 4_465
Cs5 O13 3.291(11) 1_565
Cs5 O12 3.380(14) 1_565
Cs5 O17 3.458(14) 6_665
Cs5 O16 3.465(14) 1_565
Cs5 Cs2 3.662(11) 4_575
Cs5 V6 4.068(8) 1_565
Cs3 Cs3 2.09(4) 4_465
Cs3 O12 3.461(14) 1_565
Cs3 O20 3.73(2) 4_465
Cs3 O12 3.731(18) 4_565
Cs3 O21 3.76(4) .
Cs3 Cs4 4.25(2) 2_675
Cs3 Cs2 4.945(17) 4_465
Cs4 O22 2.90(3) 3_464
Cs4 O16 3.051(12) 4_455
Cs4 O17 3.314(13) 3_464
Cs4 Cs6 3.52(4) .
Cs4 Cs3 4.25(2) 3_464
Cs4 V5 4.439(9) 3_464
Cs4 Cs1 4.603(9) 3_464
O21 Cs5 2.76(3) 4_465
O21 Cs3 3.76(4) 4_465
O22 Cs4 2.90(3) 2_675
O22 Cs1 3.15(4) 6_665
O22 Cs6 3.67(5) 4_575
Cs6 Cs5 1.74(5) 4_355
Cs6 O17 3.149(17) 3_464
Cs6 O16 3.17(2) 4_455
Cs6 O15 3.23(3) 1_445
Cs6 O11 3.43(2) 1_445
Cs6 O19 3.65(3) 4_465
Cs6 O22 3.67(5) 4_355
Cs6 V5 3.987(17) 3_464
Cs6 V4 4.032(13) 1_445
