#------------------------------------------------------------------------------
#$Date: 2016-03-25 16:06:50 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179952 $
#$URL: svn://www.crystallography.net/cod/cif/7/02/47/7024711.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_7024711
loop_
_publ_author_name
'Bobev, Svilen'
'Hullmann, Jonathan'
'Harmening, Thomas'
'Pöttgen, Rainer'
_publ_section_title
;
 Novel ternary alkaline-earth and rare-earth metal antimonides from
 gallium or indium flux. Synthesis, structural characterization and 121Sb
 and 151Eu Mössbauer spectroscopy of the series A7Ga8Sb8 (A = Sr, Ba,
 Eu) and Ba7In8Sb8.
;
_journal_issue                   26
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              6049
_journal_page_last               6055
_journal_paper_doi               10.1039/b920583g
_journal_volume                  39
_journal_year                    2010
_chemical_formula_moiety         'Ba0.88 In Sb'
_chemical_formula_sum            'Ba0.88 In Sb'
_chemical_formula_weight         356.74
_chemical_name_systematic
;
?
;
_space_group_IT_number           194
_symmetry_cell_setting           hexagonal
_symmetry_space_group_name_Hall  '-P 6c 2c'
_symmetry_space_group_name_H-M   'P 63/m m c'
_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            4
_cell_length_a                   4.8274(3)
_cell_length_b                   4.8274(3)
_cell_length_c                   18.421(2)
_cell_measurement_reflns_used    3462
_cell_measurement_temperature    120(2)
_cell_measurement_theta_max      27.4
_cell_measurement_theta_min      2.2
_cell_volume                     371.77(5)
_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  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      120(2)
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 1.000
_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  0.0404
_diffrn_reflns_av_sigmaI/netI    0.0169
_diffrn_reflns_limit_h_max       6
_diffrn_reflns_limit_h_min       -6
_diffrn_reflns_limit_k_max       6
_diffrn_reflns_limit_k_min       -6
_diffrn_reflns_limit_l_max       23
_diffrn_reflns_limit_l_min       -23
_diffrn_reflns_number            3462
_diffrn_reflns_theta_full        27.39
_diffrn_reflns_theta_max         27.39
_diffrn_reflns_theta_min         2.21
_exptl_absorpt_coefficient_mu    22.265
_exptl_absorpt_correction_T_max  0.4023
_exptl_absorpt_correction_T_min  0.2143
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
SADABS (Sheldrick, 2003)
;
_exptl_crystal_colour            grey
_exptl_crystal_density_diffrn    6.374
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       irregular
_exptl_crystal_F_000             596
_exptl_crystal_size_max          0.10
_exptl_crystal_size_mid          0.08
_exptl_crystal_size_min          0.05
_refine_diff_density_max         1.942
_refine_diff_density_min         -2.990
_refine_diff_density_rms         0.432
_refine_ls_extinction_coef       0.0040(8)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.352
_refine_ls_matrix_type           full
_refine_ls_number_parameters     18
_refine_ls_number_reflns         204
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.352
_refine_ls_R_factor_all          0.0495
_refine_ls_R_factor_gt           0.0489
_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)+(0.0000P)²+36.9863P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1136
_refine_ls_wR_factor_ref         0.1140
_reflns_number_gt                201
_reflns_number_total             204
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b920583g.txt
_cod_data_source_block           Ba0.875InSb
_cod_depositor_comments
;
The following automatic conversions were performed:

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

Automatic conversion script
Id: cif_fix_values 1891 2012-01-12 08:04:46Z andrius 
;
_cod_database_code               7024711
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-y, x-y, z'
'-x+y, -x, z'
'-x, -y, z+1/2'
'y, -x+y, z+1/2'
'x-y, x, z+1/2'
'y, x, -z'
'x-y, -y, -z'
'-x, -x+y, -z'
'-y, -x, -z+1/2'
'-x+y, y, -z+1/2'
'x, x-y, -z+1/2'
'-x, -y, -z'
'y, -x+y, -z'
'x-y, x, -z'
'x, y, -z-1/2'
'-y, x-y, -z-1/2'
'-x+y, -x, -z-1/2'
'-y, -x, z'
'-x+y, y, z'
'x, x-y, z'
'y, x, z-1/2'
'x-y, -y, z-1/2'
'-x, -x+y, z-1/2'
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
Ba1 Ba 0.0000 0.0000 0.2500 0.0176(9) Uani 0.75 12 d SP
Ba2 Ba 0.0000 0.0000 0.0000 0.0150(8) Uani 1 12 d S
Sb1 Sb 0.3333 0.6667 0.11875(11) 0.0156(7) Uani 1 6 d S
In1 In 0.6667 0.3333 0.1533(3) 0.0407(16) Uani 0.50 6 d SP
In2 In 0.8110(16) 0.1890(16) 0.2994(4) 0.041(3) Uani 0.17 2 d SP
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
In In -0.7276 1.3100 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ba Ba -0.3244 2.2819 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Sb Sb -0.5866 1.5461 '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
In2 Ba1 In2 128.64(16) 17_546 3_665
In2 Ba1 In2 97.3(4) 17_546 18_666
In2 Ba1 In2 59.8(6) 3_665 18_666
In2 Ba1 In2 59.8(6) 17_546 2_545
In2 Ba1 In2 97.3(4) 3_665 2_545
In2 Ba1 In2 128.64(16) 18_666 2_545
In2 Ba1 In2 97.3(4) 17_546 16_456
In2 Ba1 In2 128.64(16) 3_665 16_456
In2 Ba1 In2 97.3(4) 18_666 16_456
In2 Ba1 In2 128.64(16) 2_545 16_456
In2 Ba1 In2 128.64(16) 17_546 1_455
In2 Ba1 In2 97.3(4) 3_665 1_455
In2 Ba1 In2 128.64(16) 18_666 1_455
In2 Ba1 In2 97.3(4) 2_545 1_455
In2 Ba1 In2 59.8(6) 16_456 1_455
In2 Ba1 In1 129.33(10) 17_546 16_556
In2 Ba1 In1 2.7(3) 3_665 16_556
In2 Ba1 In1 62.5(3) 18_666 16_556
In2 Ba1 In1 95.5(2) 2_545 16_556
In2 Ba1 In1 129.33(10) 16_456 16_556
In2 Ba1 In1 95.5(2) 1_455 16_556
In2 Ba1 In1 2.7(3) 17_546 1_445
In2 Ba1 In1 129.33(10) 3_665 1_445
In2 Ba1 In1 95.5(2) 18_666 1_445
In2 Ba1 In1 62.5(3) 2_545 1_445
In2 Ba1 In1 95.5(2) 16_456 1_445
In2 Ba1 In1 129.33(10) 1_455 1_445
In1 Ba1 In1 130.16(5) 16_556 1_445
In2 Ba1 In1 62.5(3) 17_546 16_446
In2 Ba1 In1 95.5(2) 3_665 16_446
In2 Ba1 In1 129.33(10) 18_666 16_446
In2 Ba1 In1 2.7(3) 2_545 16_446
In2 Ba1 In1 129.33(10) 16_456 16_446
In2 Ba1 In1 95.5(2) 1_455 16_446
In1 Ba1 In1 93.74(12) 16_556 16_446
In1 Ba1 In1 65.15(17) 1_445 16_446
In2 Ba1 In1 95.5(2) 17_546 .
In2 Ba1 In1 62.5(3) 3_665 .
In2 Ba1 In1 2.7(3) 18_666 .
In2 Ba1 In1 129.33(10) 2_545 .
In2 Ba1 In1 95.5(2) 16_456 .
In2 Ba1 In1 129.33(10) 1_455 .
In1 Ba1 In1 65.15(17) 16_556 .
In1 Ba1 In1 93.74(12) 1_445 .
In1 Ba1 In1 130.16(5) 16_446 .
In2 Ba1 In1 129.33(10) 17_546 16_456
In2 Ba1 In1 95.5(2) 3_665 16_456
In2 Ba1 In1 129.33(10) 18_666 16_456
In2 Ba1 In1 95.5(2) 2_545 16_456
In2 Ba1 In1 62.5(3) 16_456 16_456
In2 Ba1 In1 2.7(3) 1_455 16_456
In1 Ba1 In1 93.74(12) 16_556 16_456
In1 Ba1 In1 130.16(5) 1_445 16_456
In1 Ba1 In1 93.74(12) 16_446 16_456
In1 Ba1 In1 130.16(5) . 16_456
In2 Ba1 In1 95.5(2) 17_546 1_455
In2 Ba1 In1 129.33(10) 3_665 1_455
In2 Ba1 In1 95.5(2) 18_666 1_455
In2 Ba1 In1 129.33(10) 2_545 1_455
In2 Ba1 In1 2.7(3) 16_456 1_455
In2 Ba1 In1 62.5(3) 1_455 1_455
In1 Ba1 In1 130.16(5) 16_556 1_455
In1 Ba1 In1 93.74(12) 1_445 1_455
In1 Ba1 In1 130.16(5) 16_446 1_455
In1 Ba1 In1 93.74(12) . 1_455
In1 Ba1 In1 65.15(17) 16_456 1_455
Sb1 Ba2 Sb1 180.0 . 13
Sb1 Ba2 Sb1 94.12(4) . 13_665
Sb1 Ba2 Sb1 85.88(4) 13 13_665
Sb1 Ba2 Sb1 85.88(4) . 1_445
Sb1 Ba2 Sb1 94.12(4) 13 1_445
Sb1 Ba2 Sb1 180.00(5) 13_665 1_445
Sb1 Ba2 Sb1 94.12(4) . 13_565
Sb1 Ba2 Sb1 85.88(4) 13 13_565
Sb1 Ba2 Sb1 85.88(4) 13_665 13_565
Sb1 Ba2 Sb1 94.12(4) 1_445 13_565
Sb1 Ba2 Sb1 85.88(4) . 1_545
Sb1 Ba2 Sb1 94.12(4) 13 1_545
Sb1 Ba2 Sb1 94.12(4) 13_665 1_545
Sb1 Ba2 Sb1 85.88(4) 1_445 1_545
Sb1 Ba2 Sb1 180.00(5) 13_565 1_545
Sb1 Ba2 In1 44.30(2) . .
Sb1 Ba2 In1 135.70(2) 13 .
Sb1 Ba2 In1 83.51(7) 13_665 .
Sb1 Ba2 In1 96.49(7) 1_445 .
Sb1 Ba2 In1 135.70(2) 13_565 .
Sb1 Ba2 In1 44.30(2) 1_545 .
Sb1 Ba2 In1 135.70(2) . 13
Sb1 Ba2 In1 44.30(2) 13 13
Sb1 Ba2 In1 96.49(7) 13_665 13
Sb1 Ba2 In1 83.51(7) 1_445 13
Sb1 Ba2 In1 44.30(2) 13_565 13
Sb1 Ba2 In1 135.70(2) 1_545 13
In1 Ba2 In1 180.0 . 13
Sb1 Ba2 In1 83.51(7) . 13_665
Sb1 Ba2 In1 96.49(7) 13 13_665
Sb1 Ba2 In1 44.30(2) 13_665 13_665
Sb1 Ba2 In1 135.70(2) 1_445 13_665
Sb1 Ba2 In1 44.30(2) 13_565 13_665
Sb1 Ba2 In1 135.70(2) 1_545 13_665
In1 Ba2 In1 105.07(9) . 13_665
In1 Ba2 In1 74.93(9) 13 13_665
Sb1 Ba2 In1 96.49(7) . 1_445
Sb1 Ba2 In1 83.51(7) 13 1_445
Sb1 Ba2 In1 135.70(2) 13_665 1_445
Sb1 Ba2 In1 44.30(2) 1_445 1_445
Sb1 Ba2 In1 135.70(2) 13_565 1_445
Sb1 Ba2 In1 44.30(2) 1_545 1_445
In1 Ba2 In1 74.93(9) . 1_445
In1 Ba2 In1 105.07(9) 13 1_445
In1 Ba2 In1 180.00(12) 13_665 1_445
Sb1 Ba2 In1 135.70(2) . 13_655
Sb1 Ba2 In1 44.30(2) 13 13_655
Sb1 Ba2 In1 44.30(2) 13_665 13_655
Sb1 Ba2 In1 135.70(2) 1_445 13_655
Sb1 Ba2 In1 96.49(7) 13_565 13_655
Sb1 Ba2 In1 83.51(7) 1_545 13_655
In1 Ba2 In1 105.07(9) . 13_655
In1 Ba2 In1 74.93(9) 13 13_655
In1 Ba2 In1 74.93(9) 13_665 13_655
In1 Ba2 In1 105.07(9) 1_445 13_655
Sb1 Ba2 In1 44.30(2) . 1_455
Sb1 Ba2 In1 135.70(2) 13 1_455
Sb1 Ba2 In1 135.70(2) 13_665 1_455
Sb1 Ba2 In1 44.30(2) 1_445 1_455
Sb1 Ba2 In1 83.51(7) 13_565 1_455
Sb1 Ba2 In1 96.49(7) 1_545 1_455
In1 Ba2 In1 74.93(9) . 1_455
In1 Ba2 In1 105.07(9) 13 1_455
In1 Ba2 In1 105.07(9) 13_665 1_455
In1 Ba2 In1 74.93(9) 1_445 1_455
In1 Ba2 In1 180.00(12) 13_655 1_455
In2 Sb1 In2 43.0(5) 16_566 18_676
In2 Sb1 In2 94.6(2) 16_566 17_556
In2 Sb1 In2 57.3(5) 18_676 17_556
In2 Sb1 In2 115.6(3) 16_566 16_456
In2 Sb1 In2 94.6(2) 18_676 16_456
In2 Sb1 In2 43.0(5) 17_556 16_456
In2 Sb1 In2 57.3(5) 16_566 17_656
In2 Sb1 In2 94.6(2) 18_676 17_656
In2 Sb1 In2 115.6(3) 17_556 17_656
In2 Sb1 In2 94.6(2) 16_456 17_656
In2 Sb1 In2 94.6(2) 16_566 18_666
In2 Sb1 In2 115.6(3) 18_676 18_666
In2 Sb1 In2 94.6(2) 17_556 18_666
In2 Sb1 In2 57.3(5) 16_456 18_666
In2 Sb1 In2 43.0(5) 17_656 18_666
In2 Sb1 In1 86.9(3) 16_566 .
In2 Sb1 In1 124.4(2) 18_676 .
In2 Sb1 In1 124.4(2) 17_556 .
In2 Sb1 In1 86.9(3) 16_456 .
In2 Sb1 In1 30.2(3) 17_656 .
In2 Sb1 In1 30.2(3) 18_666 .
In2 Sb1 In1 30.2(3) 16_566 1_565
In2 Sb1 In1 30.2(3) 18_676 1_565
In2 Sb1 In1 86.9(3) 17_556 1_565
In2 Sb1 In1 124.4(2) 16_456 1_565
In2 Sb1 In1 86.9(3) 17_656 1_565
In2 Sb1 In1 124.4(2) 18_666 1_565
In1 Sb1 In1 115.18(8) . 1_565
In2 Sb1 In1 124.4(2) 16_566 1_455
In2 Sb1 In1 86.9(3) 18_676 1_455
In2 Sb1 In1 30.2(3) 17_556 1_455
In2 Sb1 In1 30.2(3) 16_456 1_455
In2 Sb1 In1 124.4(2) 17_656 1_455
In2 Sb1 In1 86.9(3) 18_666 1_455
In1 Sb1 In1 115.18(8) . 1_455
In1 Sb1 In1 115.18(8) 1_565 1_455
In2 Sb1 Ba2 158.2(2) 16_566 .
In2 Sb1 Ba2 158.2(2) 18_676 .
In2 Sb1 Ba2 106.0(2) 17_556 .
In2 Sb1 Ba2 77.04(16) 16_456 .
In2 Sb1 Ba2 106.0(2) 17_656 .
In2 Sb1 Ba2 77.04(16) 18_666 .
In1 Sb1 Ba2 75.77(8) . .
In1 Sb1 Ba2 154.75(12) 1_565 .
In1 Sb1 Ba2 75.77(8) 1_455 .
In2 Sb1 Ba2 106.0(2) 16_566 1_565
In2 Sb1 Ba2 77.04(16) 18_676 1_565
In2 Sb1 Ba2 77.04(16) 17_556 1_565
In2 Sb1 Ba2 106.0(2) 16_456 1_565
In2 Sb1 Ba2 158.2(2) 17_656 1_565
In2 Sb1 Ba2 158.2(2) 18_666 1_565
In1 Sb1 Ba2 154.75(12) . 1_565
In1 Sb1 Ba2 75.77(8) 1_565 1_565
In1 Sb1 Ba2 75.77(8) 1_455 1_565
Ba2 Sb1 Ba2 85.88(4) . 1_565
In2 Sb1 Ba2 77.04(16) 16_566 1_665
In2 Sb1 Ba2 106.0(2) 18_676 1_665
In2 Sb1 Ba2 158.2(2) 17_556 1_665
In2 Sb1 Ba2 158.2(2) 16_456 1_665
In2 Sb1 Ba2 77.04(16) 17_656 1_665
In2 Sb1 Ba2 106.0(2) 18_666 1_665
In1 Sb1 Ba2 75.77(8) . 1_665
In1 Sb1 Ba2 75.77(8) 1_565 1_665
In1 Sb1 Ba2 154.75(12) 1_455 1_665
Ba2 Sb1 Ba2 85.88(4) . 1_665
Ba2 Sb1 Ba2 85.88(4) 1_565 1_665
In2 In1 In2 89.2(6) 16_556 17_656
In2 In1 In2 89.2(6) 16_556 18_666
In2 In1 In2 89.2(6) 17_656 18_666
In2 In1 Sb1 74.64(19) 16_556 1_545
In2 In1 Sb1 157.0(5) 17_656 1_545
In2 In1 Sb1 74.64(19) 18_666 1_545
In2 In1 Sb1 74.64(19) 16_556 1_655
In2 In1 Sb1 74.64(19) 17_656 1_655
In2 In1 Sb1 157.0(5) 18_666 1_655
Sb1 In1 Sb1 115.18(8) 1_545 1_655
In2 In1 Sb1 157.0(5) 16_556 .
In2 In1 Sb1 74.65(19) 17_656 .
In2 In1 Sb1 74.65(19) 18_666 .
Sb1 In1 Sb1 115.19(8) 1_545 .
Sb1 In1 Sb1 115.19(8) 1_655 .
In2 In1 In2 68.4(5) 16_556 2_655
In2 In1 In2 30.0(3) 17_656 2_655
In2 In1 In2 68.4(5) 18_666 2_655
Sb1 In1 In2 127.0(3) 1_545 2_655
Sb1 In1 In2 90.22(16) 1_655 2_655
Sb1 In1 In2 90.22(15) . 2_655
In2 In1 In2 68.4(5) 16_556 3_665
In2 In1 In2 68.4(5) 17_656 3_665
In2 In1 In2 30.0(3) 18_666 3_665
Sb1 In1 In2 90.22(16) 1_545 3_665
Sb1 In1 In2 127.0(3) 1_655 3_665
Sb1 In1 In2 90.22(15) . 3_665
In2 In1 In2 41.5(4) 2_655 3_665
In2 In1 In2 30.0(3) 16_556 .
In2 In1 In2 68.4(5) 17_656 .
In2 In1 In2 68.4(5) 18_666 .
Sb1 In1 In2 90.22(15) 1_545 .
Sb1 In1 In2 90.22(15) 1_655 .
Sb1 In1 In2 127.0(3) . .
In2 In1 In2 41.5(4) 2_655 .
In2 In1 In2 41.5(4) 3_665 .
In2 In1 Ba1 91.5(3) 16_556 1_665
In2 In1 Ba1 3.2(4) 17_656 1_665
In2 In1 Ba1 91.5(3) 18_666 1_665
Sb1 In1 Ba1 160.3(2) 1_545 1_665
Sb1 In1 Ba1 73.09(4) 1_655 1_665
Sb1 In1 Ba1 73.10(4) . 1_665
In2 In1 Ba1 33.3(2) 2_655 1_665
In2 In1 Ba1 71.4(2) 3_665 1_665
In2 In1 Ba1 71.4(2) . 1_665
In2 In1 Ba1 3.2(4) 16_556 1_655
In2 In1 Ba1 91.5(3) 17_656 1_655
In2 In1 Ba1 91.5(3) 18_666 1_655
Sb1 In1 Ba1 73.09(4) 1_545 1_655
Sb1 In1 Ba1 73.09(4) 1_655 1_655
Sb1 In1 Ba1 160.3(2) . 1_655
In2 In1 Ba1 71.41(19) 2_655 1_655
In2 In1 Ba1 71.41(19) 3_665 1_655
In2 In1 Ba1 33.3(2) . 1_655
Ba1 In1 Ba1 93.74(12) 1_665 1_655
In2 In1 Ba1 91.5(3) 16_556 .
In2 In1 Ba1 91.5(3) 17_656 .
In2 In1 Ba1 3.2(4) 18_666 .
Sb1 In1 Ba1 73.09(4) 1_545 .
Sb1 In1 Ba1 160.3(2) 1_655 .
Sb1 In1 Ba1 73.10(4) . .
In2 In1 Ba1 71.4(2) 2_655 .
In2 In1 Ba1 33.3(2) 3_665 .
In2 In1 Ba1 71.4(2) . .
Ba1 In1 Ba1 93.74(12) 1_665 .
Ba1 In1 Ba1 93.74(12) 1_655 .
In1 In2 In2 125.8(4) 16_556 16_556
In1 In2 Ba1 174.1(7) 16_556 1_655
In2 In2 Ba1 60.1(3) 16_556 1_655
In1 In2 In2 45.4(3) 16_556 3_665
In2 In2 In2 90.000(1) 16_556 3_665
Ba1 In2 In2 138.6(2) 1_655 3_665
In1 In2 In2 45.4(3) 16_556 2_655
In2 In2 In2 90.000(2) 16_556 2_655
Ba1 In2 In2 138.6(2) 1_655 2_655
In2 In2 In2 60.000(6) 3_665 2_655
In1 In2 In2 134.6(3) 16_556 3_765
In2 In2 In2 90.000(1) 16_556 3_765
Ba1 In2 In2 41.36(19) 1_655 3_765
In2 In2 In2 180.000(7) 3_665 3_765
In2 In2 In2 120.000(4) 2_655 3_765
In1 In2 In2 134.6(3) 16_556 2_645
In2 In2 In2 90.000(1) 16_556 2_645
Ba1 In2 In2 41.36(19) 1_655 2_645
In2 In2 In2 120.000(3) 3_665 2_645
In2 In2 In2 180.0(6) 2_655 2_645
In2 In2 In2 60.000(3) 3_765 2_645
In1 In2 In2 81.6(6) 16_556 18_666
In2 In2 In2 49.0(4) 16_556 18_666
Ba1 In2 In2 103.8(4) 1_655 18_666
In2 In2 In2 41.0(4) 3_665 18_666
In2 In2 In2 67.84(14) 2_655 18_666
In2 In2 In2 139.0(4) 3_765 18_666
In2 In2 In2 112.16(15) 2_645 18_666
In1 In2 In2 81.6(6) 16_556 17_656
In2 In2 In2 49.0(4) 16_556 17_656
Ba1 In2 In2 103.8(4) 1_655 17_656
In2 In2 In2 67.84(14) 3_665 17_656
In2 In2 In2 41.0(4) 2_655 17_656
In2 In2 In2 112.16(15) 3_765 17_656
In2 In2 In2 139.0(4) 2_645 17_656
In2 In2 In2 44.3(3) 18_666 17_656
In1 In2 Sb1 75.1(2) 16_556 16_656
In2 In2 Sb1 121.92(14) 16_556 16_656
Ba1 In2 Sb1 101.9(3) 1_655 16_656
In2 In2 Sb1 118.7(3) 3_665 16_656
In2 In2 Sb1 68.5(3) 2_655 16_656
In2 In2 Sb1 61.3(3) 3_765 16_656
In2 In2 Sb1 111.5(2) 2_645 16_656
In2 In2 Sb1 135.2(3) 18_666 16_656
In2 In2 Sb1 94.1(4) 17_656 16_656
In1 In2 Sb1 75.1(2) 16_556 16_546
In2 In2 Sb1 121.92(15) 16_556 16_546
Ba1 In2 Sb1 101.9(3) 1_655 16_546
In2 In2 Sb1 68.5(3) 3_665 16_546
In2 In2 Sb1 118.7(3) 2_655 16_546
In2 In2 Sb1 111.5(3) 3_765 16_546
In2 In2 Sb1 61.3(3) 2_645 16_546
In2 In2 Sb1 94.1(4) 18_666 16_546
In2 In2 Sb1 135.2(3) 17_656 16_546
Sb1 In2 Sb1 115.6(3) 16_656 16_546
In1 In2 In1 101.7(6) 16_556 .
In2 In2 In1 24.2(3) 16_556 .
Ba1 In2 In1 84.2(3) 1_655 .
In2 In2 In1 69.2(2) 3_665 .
In2 In2 In1 69.2(2) 2_655 .
In2 In2 In1 110.8(2) 3_765 .
In2 In2 In1 110.8(2) 2_645 .
In2 In2 In1 30.0(2) 18_666 .
In2 In2 In1 30.0(2) 17_656 .
Sb1 In2 In1 120.61(19) 16_656 .
Sb1 In2 In1 120.61(19) 16_546 .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ba1 In2 1.823(12) 17_546
Ba1 In2 1.823(12) 3_665
Ba1 In2 1.823(12) 18_666
Ba1 In2 1.823(12) 2_545
Ba1 In2 1.823(12) 16_456
Ba1 In2 1.823(12) 1_455
Ba1 In1 3.307(3) 16_556
Ba1 In1 3.307(3) 1_445
Ba1 In1 3.307(3) 16_446
Ba1 In1 3.307(3) .
Ba1 In1 3.307(3) 16_456
Ba1 In1 3.307(3) 1_455
Ba2 Sb1 3.5430(12) .
Ba2 Sb1 3.5430(12) 13
Ba2 Sb1 3.5430(12) 13_665
Ba2 Sb1 3.5430(12) 1_445
Ba2 Sb1 3.5431(12) 13_565
Ba2 Sb1 3.5431(12) 1_545
Sb1 In2 2.852(5) 16_566
Sb1 In2 2.852(5) 18_676
Sb1 In2 2.852(5) 17_556
Sb1 In2 2.852(5) 16_456
Sb1 In2 2.852(5) 17_656
Sb1 In2 2.852(5) 18_666
Sb1 In1 2.8590(13) .
Sb1 In1 2.8590(13) 1_565
Sb1 In1 2.8590(13) 1_455
In1 In2 1.488(12) 16_556
In1 In2 1.488(12) 17_656
In1 In2 1.488(12) 18_666
In1 Sb1 2.8590(13) 1_545
In1 Sb1 2.8590(13) 1_655
In1 In2 2.949(11) 2_655
In1 In2 2.949(11) 3_665
In1 In2 2.949(11) .
In1 Ba1 3.307(3) 1_665
In1 Ba1 3.307(3) 1_655
In2 In1 1.488(12) 16_556
In2 In2 1.819(16) 16_556
In2 Ba1 1.823(12) 1_655
In2 In2 2.09(2) 3_665
In2 In2 2.09(2) 2_655
In2 In2 2.74(2) 3_765
In2 In2 2.74(2) 2_645
In2 In2 2.77(2) 18_666
In2 In2 2.77(2) 17_656
In2 Sb1 2.852(5) 16_656
In2 Sb1 2.852(5) 16_546
