#------------------------------------------------------------------------------
#$Date: 2019-02-09 05:47:22 +0200 (Sat, 09 Feb 2019) $
#$Revision: 213580 $
#$URL: file:///home/coder/svn-repositories/cod/cif/2/24/28/2242846.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2242846
loop_
_publ_author_name
'Schwendtner, Karolina'
'Kolitsch, Uwe'
_publ_section_title
;
 CsGa(HAsO₄)₂, the first Ga representative of the RbAl(HAsO₄)₂
 structure type
;
_journal_coeditor_code           VN2142
_journal_issue                   3
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              346
_journal_page_last               349
_journal_paper_doi               10.1107/S2056989019002081
_journal_volume                  75
_journal_year                    2019
_chemical_formula_iupac          'Cs Ga (H As O4)2'
_chemical_formula_moiety         'Cs Ga (H As O4)2'
_chemical_formula_sum            'As2 Cs Ga H2 O8'
_chemical_formula_weight         482.49
_chemical_name_common            'caesium gallium bis(hydrogen arsenate)'
_chemical_name_systematic
;
Caesium gallium bis[hydrogen arsenate(V)]
;
_space_group_crystal_system      trigonal
_space_group_IT_number           155
_space_group_name_Hall           'R 3 2"'
_space_group_name_H-M_alt        'R 3 2 :H'
_symmetry_space_group_name_Hall  'R 3 2"'
_symmetry_space_group_name_H-M   'R 3 2 :H'
_atom_sites_solution_hydrogens   difmap
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-2016/6
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            9
_cell_length_a                   8.4810(10)
_cell_length_b                   8.4810(10)
_cell_length_c                   27.050(5)
_cell_measurement_reflns_used    1370
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      32.543
_cell_measurement_theta_min      2.259
_cell_volume                     1685.0(4)
_computing_cell_refinement
;
HKL SCALEPACK (Otwinowski et al.,  2003)
;
_computing_data_collection
;
COLLECT (Nonius, 2003)
;
_computing_data_reduction
;
HKL DENZO and SCALEPACK (Otwinowski et al.,  2003)
;
_computing_molecular_graphics
;
DIAMOND (Brandenburg, 2005)
;
_computing_publication_material
;
publCIF (Westrip, 2010)
;
_computing_structure_refinement
;
SHELXL2016 (Sheldrick, 2015)
;
_computing_structure_solution
;
SHELXS97 (Sheldrick, 2008)
;
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Nonius KappaCCD single-crystal four-circle'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0178
_diffrn_reflns_av_unetI/netI     0.0236
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       10
_diffrn_reflns_limit_k_min       -10
_diffrn_reflns_limit_l_max       40
_diffrn_reflns_limit_l_min       -40
_diffrn_reflns_number            2738
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         32.543
_diffrn_reflns_theta_min         2.259
_diffrn_source                   'fine-focus sealed tube'
_exptl_absorpt_coefficient_mu    17.243
_exptl_absorpt_correction_T_max  0.846
_exptl_absorpt_correction_T_min  0.626
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
(HKL SCALEPACK; Otwinowski et al.,  2003)
;
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    4.279
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       'tiny hexagonal platelets'
_exptl_crystal_F_000             1962
_exptl_crystal_size_max          0.030
_exptl_crystal_size_mid          0.030
_exptl_crystal_size_min          0.010
_refine_diff_density_max         0.719
_refine_diff_density_min         -0.736
_refine_ls_abs_structure_details
;
 Refined as an inversion twin
;
_refine_ls_abs_structure_Flack   0.46(2)
_refine_ls_extinction_coef       0.00041(4)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method
;
SHELXL2016 (Sheldrick, 2015)
;
_refine_ls_goodness_of_fit_ref   1.066
_refine_ls_hydrogen_treatment    refall
_refine_ls_matrix_type           full
_refine_ls_number_parameters     76
_refine_ls_number_reflns         1375
_refine_ls_number_restraints     2
_refine_ls_restrained_S_all      1.067
_refine_ls_R_factor_all          0.0225
_refine_ls_R_factor_gt           0.0194
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0194P)²+2.6152P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0409
_refine_ls_wR_factor_ref         0.0418
_reflns_number_gt                1283
_reflns_number_total             1375
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            vn2142sup1.cif
_cod_data_source_block           I
_cod_original_cell_volume        1685.0(5)
_cod_database_code               2242846
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_shelx_estimated_absorpt_t_min   0.626
_shelx_estimated_absorpt_t_max   0.846
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-y, x-y, z'
'-x+y, -x, z'
'y, x, -z'
'x-y, -y, -z'
'-x, -x+y, -z'
'x+2/3, y+1/3, z+1/3'
'-y+2/3, x-y+1/3, z+1/3'
'-x+y+2/3, -x+1/3, z+1/3'
'y+2/3, x+1/3, -z+1/3'
'x-y+2/3, -y+1/3, -z+1/3'
'-x+2/3, -x+y+1/3, -z+1/3'
'x+1/3, y+2/3, z+2/3'
'-y+1/3, x-y+2/3, z+2/3'
'-x+y+1/3, -x+2/3, z+2/3'
'y+1/3, x+2/3, -z+2/3'
'x-y+1/3, -y+2/3, -z+2/3'
'-x+1/3, -x+y+2/3, -z+2/3'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_calc_flag
_atom_site_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
O O1 0.2225(4) 0.1039(5) 0.04039(9) 0.0161(5) Uani d 1 . .
Cs Cs1 0.333333 0.666667 0.166667 0.02717(16) Uani d 1 A 1
Cs Cs2 0.333333 0.666667 0.00046(2) 0.02105(12) Uani d 1 A 1
Ga Ga1 0.000000 0.000000 0.17439(2) 0.00792(13) Uani d 1 A 1
Ga Ga2 0.000000 0.000000 0.000000 0.00791(17) Uani d 1 B 1
As As 0.29653(6) 0.22380(6) 0.09219(2) 0.00852(10) Uani d 0.9461(12) A 1
O O2 0.1465(4) 0.2152(5) 0.13347(13) 0.0110(6) Uani d 0.9461(12) A 1
O O3 0.4566(4) 0.1811(5) 0.11541(11) 0.0110(5) Uani d 0.9461(12) A 1
O O4 0.4135(4) 0.4521(4) 0.07510(12) 0.0151(5) Uani d 0.9461(12) A 1
As AsB 0.2984(10) 0.0710(10) 0.0923(3) 0.00852(10) Uani d 0.0540(12) B 2
O O2B 0.081(9) 0.213(10) 0.134(2) 0.0110(6) Uani d 0.0540(12) B 2
O O3B 0.457(7) 0.265(8) 0.117(2) 0.0110(5) Uani d 0.0540(12) B 2
O O4B 0.549(8) 0.587(7) 0.077(2) 0.0151(5) Uani d 0.0540(12) B 2
H H 0.510(7) 0.474(8) 0.0874(17) 0.017(13) Uiso d 1 . .
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'
Ga Ga 0.2307 1.6083 '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'
H H 0.0000 0.0000 '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_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle
As O1 Ga2 . . 136.69(19)
AsB O1 Cs2 . 4 87.7(3)
As O1 Cs2 . 4 87.31(11)
Ga2 O1 Cs2 . 4 127.46(10)
O4 Cs1 O4 . 3_565 70.99(9)
O4 Cs1 O4 . 2_665 70.99(9)
O4 Cs1 O4 3_565 2_665 70.99(9)
O4 Cs1 O4 . 12 99.40(11)
O4 Cs1 O4 3_565 12 123.13(11)
O4 Cs1 O4 2_665 12 160.35(10)
O4 Cs1 O4 . 11_565 123.13(11)
O4 Cs1 O4 3_565 11_565 160.35(10)
O4 Cs1 O4 2_665 11_565 99.40(11)
O4 Cs1 O4 12 11_565 70.99(9)
O4 Cs1 O4 . 10_455 160.35(10)
O4 Cs1 O4 3_565 10_455 99.40(11)
O4 Cs1 O4 2_665 10_455 123.13(11)
O4 Cs1 O4 12 10_455 70.99(9)
O4 Cs1 O4 11_565 10_455 70.99(9)
O4 Cs1 O2 . 12 63.50(8)
O4 Cs1 O2 3_565 12 126.94(7)
O4 Cs1 O2 2_665 12 115.11(8)
O4 Cs1 O2 12 12 46.21(8)
O4 Cs1 O2 11_565 12 72.50(8)
O4 Cs1 O2 10_455 12 114.43(8)
O4 Cs1 O2 . 3_565 114.43(8)
O4 Cs1 O2 3_565 3_565 46.21(8)
O4 Cs1 O2 2_665 3_565 72.51(8)
O4 Cs1 O2 12 3_565 126.94(8)
O4 Cs1 O2 11_565 3_565 115.11(8)
O4 Cs1 O2 10_455 3_565 63.50(8)
O2 Cs1 O2 12 3_565 169.02(11)
O4 Cs1 O2 . . 46.21(8)
O4 Cs1 O2 3_565 . 72.50(8)
O4 Cs1 O2 2_665 . 114.43(8)
O4 Cs1 O2 12 . 63.50(8)
O4 Cs1 O2 11_565 . 126.94(7)
O4 Cs1 O2 10_455 . 115.11(8)
O2 Cs1 O2 12 . 56.73(11)
O2 Cs1 O2 3_565 . 113.48(5)
O4 Cs1 O2 . 2_665 72.50(8)
O4 Cs1 O2 3_565 2_665 114.43(8)
O4 Cs1 O2 2_665 2_665 46.21(8)
O4 Cs1 O2 12 2_665 115.11(8)
O4 Cs1 O2 11_565 2_665 63.50(9)
O4 Cs1 O2 10_455 2_665 126.94(8)
O2 Cs1 O2 12 2_665 76.70(11)
O2 Cs1 O2 3_565 2_665 113.48(5)
O2 Cs1 O2 . 2_665 113.48(5)
O4 Cs1 O2 . 11_565 126.94(8)
O4 Cs1 O2 3_565 11_565 115.11(8)
O4 Cs1 O2 2_665 11_565 63.50(9)
O4 Cs1 O2 12 11_565 114.43(8)
O4 Cs1 O2 11_565 11_565 46.21(8)
O4 Cs1 O2 10_455 11_565 72.50(8)
O2 Cs1 O2 12 11_565 113.48(5)
O2 Cs1 O2 3_565 11_565 76.70(11)
O2 Cs1 O2 . 11_565 169.02(11)
O2 Cs1 O2 2_665 11_565 56.74(11)
O4 Cs1 O2 . 10_455 115.11(8)
O4 Cs1 O2 3_565 10_455 63.50(8)
O4 Cs1 O2 2_665 10_455 126.94(7)
O4 Cs1 O2 12 10_455 72.50(8)
O4 Cs1 O2 11_565 10_455 114.43(8)
O4 Cs1 O2 10_455 10_455 46.21(8)
O2 Cs1 O2 12 10_455 113.48(5)
O2 Cs1 O2 3_565 10_455 56.73(11)
O2 Cs1 O2 . 10_455 76.70(11)
O2 Cs1 O2 2_665 10_455 169.02(11)
O2 Cs1 O2 11_565 10_455 113.48(5)
O4 Cs1 H . . 13.6(7)
O4 Cs1 H 3_565 . 84.3(7)
O4 Cs1 H 2_665 . 71.9(10)
O4 Cs1 H 12 . 94.7(9)
O4 Cs1 H 11_565 . 109.6(7)
O4 Cs1 H 10_455 . 164.9(10)
O2 Cs1 H 12 . 53.6(8)
O2 Cs1 H 3_565 . 126.1(7)
O2 Cs1 H . . 51.8(10)
O2 Cs1 H 2_665 . 62.9(9)
O2 Cs1 H 11_565 . 119.3(10)
O2 Cs1 H 10_455 . 126.0(9)
O4 Cs2 O4 2_665 3_565 80.04(10)
O4 Cs2 O4 2_665 . 80.04(10)
O4 Cs2 O4 3_565 . 80.04(10)
O4 Cs2 O1 2_665 5_565 90.97(8)
O4 Cs2 O1 3_565 5_565 74.30(8)
O4 Cs2 O1 . 5_565 153.94(8)
O4 Cs2 O1 2_665 4 153.94(8)
O4 Cs2 O1 3_565 4 90.97(8)
O4 Cs2 O1 . 4 74.30(8)
O1 Cs2 O1 5_565 4 110.22(4)
O4 Cs2 O1 2_665 6_665 74.30(8)
O4 Cs2 O1 3_565 6_665 153.94(8)
O4 Cs2 O1 . 6_665 90.97(8)
O1 Cs2 O1 5_565 6_665 110.22(4)
O1 Cs2 O1 4 6_665 110.22(4)
O4 Cs2 O4 2_665 5_565 136.20(4)
O4 Cs2 O4 3_565 5_565 78.31(9)
O4 Cs2 O4 . 5_565 131.91(5)
O1 Cs2 O4 5_565 5_565 46.56(8)
O1 Cs2 O4 4 5_565 63.74(8)
O1 Cs2 O4 6_665 5_565 124.15(7)
O4 Cs2 O4 2_665 6_665 78.31(9)
O4 Cs2 O4 3_565 6_665 131.91(5)
O4 Cs2 O4 . 6_665 136.20(4)
O1 Cs2 O4 5_565 6_665 63.74(8)
O1 Cs2 O4 4 6_665 124.15(7)
O1 Cs2 O4 6_665 6_665 46.56(8)
O4 Cs2 O4 5_565 6_665 88.64(8)
O4 Cs2 O4 2_665 4 131.91(5)
O4 Cs2 O4 3_565 4 136.20(4)
O4 Cs2 O4 . 4 78.32(9)
O1 Cs2 O4 5_565 4 124.15(7)
O1 Cs2 O4 4 4 46.56(8)
O1 Cs2 O4 6_665 4 63.74(8)
O4 Cs2 O4 5_565 4 88.64(8)
O4 Cs2 O4 6_665 4 88.64(8)
O4 Cs2 O3 2_665 4 159.00(8)
O4 Cs2 O3 3_565 4 115.45(8)
O4 Cs2 O3 . 4 115.32(8)
O1 Cs2 O3 5_565 4 80.58(7)
O1 Cs2 O3 4 4 45.29(7)
O1 Cs2 O3 6_665 4 90.53(7)
O4 Cs2 O3 5_565 4 43.57(8)
O4 Cs2 O3 6_665 4 80.71(8)
O4 Cs2 O3 4 4 46.05(8)
O4 Cs2 O3 2_665 5_565 115.45(8)
O4 Cs2 O3 3_565 5_565 115.32(8)
O4 Cs2 O3 . 5_565 159.00(8)
O1 Cs2 O3 5_565 5_565 45.29(7)
O1 Cs2 O3 4 5_565 90.53(7)
O1 Cs2 O3 6_665 5_565 80.58(7)
O4 Cs2 O3 5_565 5_565 46.05(8)
O4 Cs2 O3 6_665 5_565 43.57(8)
O4 Cs2 O3 4 5_565 80.71(8)
O3 Cs2 O3 4 5_565 46.22(9)
O4 Cs2 O3 2_665 6_665 115.32(8)
O4 Cs2 O3 3_565 6_665 159.00(8)
O4 Cs2 O3 . 6_665 115.45(8)
O1 Cs2 O3 5_565 6_665 90.53(7)
O1 Cs2 O3 4 6_665 80.58(7)
O1 Cs2 O3 6_665 6_665 45.29(7)
O4 Cs2 O3 5_565 6_665 80.71(8)
O4 Cs2 O3 6_665 6_665 46.05(8)
O4 Cs2 O3 4 6_665 43.57(8)
O3 Cs2 O3 4 6_665 46.22(9)
O3 Cs2 O3 5_565 6_665 46.22(9)
O2 Ga1 O2 2 . 91.18(14)
O2 Ga1 O2 2 3 91.18(14)
O2 Ga1 O2 . 3 91.18(14)
O2 Ga1 O3 2 12 176.98(13)
O2 Ga1 O3 . 12 91.84(14)
O2 Ga1 O3 3 12 88.69(14)
O2 Ga1 O3 2 10_445 88.69(14)
O2 Ga1 O3 . 10_445 176.98(13)
O2 Ga1 O3 3 10_445 91.84(14)
O3 Ga1 O3 12 10_445 88.30(14)
O2 Ga1 O3 2 11_455 91.84(14)
O2 Ga1 O3 . 11_455 88.69(14)
O2 Ga1 O3 3 11_455 176.98(13)
O3 Ga1 O3 12 11_455 88.30(14)
O3 Ga1 O3 10_445 11_455 88.30(14)
O2 Ga1 Cs2 2 7_445 124.43(10)
O2 Ga1 Cs2 . 7_445 124.43(10)
O2 Ga1 Cs2 3 7_445 124.43(10)
O3 Ga1 Cs2 12 7_445 53.54(10)
O3 Ga1 Cs2 10_445 7_445 53.54(10)
O3 Ga1 Cs2 11_455 7_445 53.54(10)
O1 Ga2 O1 . 6 176.3(2)
O1 Ga2 O1 . 2 92.14(11)
O1 Ga2 O1 6 2 90.55(19)
O1 Ga2 O1 . 5 85.29(19)
O1 Ga2 O1 6 5 92.13(11)
O1 Ga2 O1 2 5 176.3(2)
O1 Ga2 O1 . 3 92.14(11)
O1 Ga2 O1 6 3 85.29(19)
O1 Ga2 O1 2 3 92.13(11)
O1 Ga2 O1 5 3 90.55(19)
O1 Ga2 O1 . 4 90.55(19)
O1 Ga2 O1 6 4 92.13(11)
O1 Ga2 O1 2 4 85.29(19)
O1 Ga2 O1 5 4 92.13(11)
O1 Ga2 O1 3 4 176.3(2)
O1 As O2 . . 119.51(15)
O1 As O3 . . 106.29(15)
O2 As O3 . . 114.75(17)
O1 As O4 . . 106.75(16)
O2 As O4 . . 102.97(16)
O3 As O4 . . 105.36(17)
O1 As Cs2 . 4 66.48(10)
O2 As Cs2 . 4 169.73(12)
O3 As Cs2 . 4 68.86(11)
O4 As Cs2 . 4 66.81(11)
O1 As Cs1 . . 143.32(12)
O2 As Cs1 . . 54.72(12)
O3 As Cs1 . . 108.02(11)
O4 As Cs1 . . 51.41(11)
Cs2 As Cs1 4 . 115.260(12)
O1 As H . . 117.5(13)
O2 As H . . 110.9(13)
O3 As H . . 81.6(12)
O4 As H . . 24.0(12)
Cs2 As H 4 . 59.4(13)
Cs1 As H . . 56.4(13)
As O2 Ga1 . . 122.30(19)
As O2 Cs1 . . 102.06(14)
Ga1 O2 Cs1 . . 127.77(14)
As O3 Ga1 . 10 129.62(19)
As O3 Cs2 . 4 84.49(12)
Ga1 O3 Cs2 10 4 99.51(12)
As O4 Cs2 . . 132.43(15)
As O4 Cs1 . . 104.56(13)
Cs2 O4 Cs1 . . 89.95(9)
As O4 Cs2 . 4 85.66(12)
Cs2 O4 Cs2 . 4 98.06(9)
Cs1 O4 Cs2 . 4 157.27(10)
As O4 H . . 96(4)
Cs2 O4 H . . 130(4)
Cs1 O4 H . . 92(3)
Cs2 O4 H 4 . 67(3)
O1 AsB O3B . . 112(2)
O1 AsB O4B . 2_655 105.6(18)
O3B AsB O4B . 2_655 104(3)
O1 AsB O2B . 3 116(2)
AsB O4B H 3_665 . 105(6)
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
O1 AsB . 1.625(7) ?
O1 As . 1.659(3) ?
O1 Ga2 . 1.967(3) ?
O1 Cs2 4 3.445(3) ?
Cs1 O4 . 3.338(3) ?
Cs1 O4 3_565 3.338(3) ?
Cs1 O4 2_665 3.338(3) ?
Cs1 O4 12 3.338(3) ?
Cs1 O4 11_565 3.338(3) ?
Cs1 O4 10_455 3.338(3) ?
Cs1 O2 12 3.451(3) ?
Cs1 O2 3_565 3.451(3) ?
Cs1 O2 . 3.451(3) ?
Cs1 O2 2_665 3.451(3) ?
Cs1 O2 11_565 3.451(3) ?
Cs1 O2 10_455 3.451(3) ?
Cs1 H . 3.46(5) ?
Cs2 O4 2_665 3.014(3) ?
Cs2 O4 3_565 3.014(3) ?
Cs2 O4 . 3.014(3) ?
Cs2 O4 5_565 3.459(3) ?
Cs2 O4 6_665 3.459(3) ?
Cs2 O4 4 3.459(3) ?
Cs2 O3 4 3.516(3) ?
Cs2 O3 5_565 3.516(3) ?
Cs2 O3 6_665 3.516(3) ?
Ga1 O2 2 1.958(3) ?
Ga1 O2 . 1.958(3) ?
Ga1 O2 3 1.958(3) ?
Ga1 O3 12 1.982(3) ?
Ga1 O3 10_445 1.982(3) ?
Ga1 O3 11_455 1.982(3) ?
As O2 . 1.667(3) ?
As O3 . 1.691(3) ?
As O4 . 1.740(3) ?
As H . 1.99(6) ?
O4 H . 0.81(4) ?
AsB O3B . 1.66(6) ?
AsB O4B 2_655 1.69(6) ?
AsB O2B 3 1.76(7) ?
O4B H . 0.88(7) ?
Cs1 'O4 (6x)' . 3.338(3) y
Cs1 'O2 (6x)' . 3.451(3) y
Cs2 'O4 (3x)' . 3.014(3) y
Cs2 'O1 (3x)' . 3.445(3) y
Cs2 'O4 (3x)' . 3.459(3) y
Cs2 'O3 (3x)' . 3.516(3) y
Ga1 'O2 (3x)' . 1.958(3) y
Ga1 'O3 (3x)' . 1.982(3) y
Ga2 'O1 (6x)' . 1.967(3) y
As O1 . 1.659(3) y
As O2 . 1.667(3) y
As O3 . 1.691(3) y
As O4 . 1.740(3) y
AsB O1 . 1.625(7) y
AsB O3B . 1.66(6) y
AsB O4B 2_655 1.69(6) y
AsB O2B 3 1.76(7) y
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_site_symmetry_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
O4 H O3 3_665 0.81(4) 1.78(4) 2.589(5) 175(6)

_cod_database_fobs_code 2242846
