data_BaInSb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.49
_cell_length_b   9.49
_cell_length_c   9.49
_cell_angle_alpha   25.93
_cell_angle_beta   25.93
_cell_angle_gamma   25.93
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaInSb2
_chemical_formula_sum   'Ba1 In1 Sb2'
_cell_volume   143.77
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Ba  Ba0  1  0.0  0.0  0.8  1.0
  In  In1  1  0.0  0.0  0.23  1.0
  Sb  Sb2  1  0.0  0.0  0.42  1.0
  Sb  Sb3  1  0.0  0.0  0.27  1.0

data_BaInSb2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   7.37
_cell_length_b   4.26
_cell_length_c   9.49
_cell_angle_alpha   90.0
_cell_angle_beta   105.01
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   BaInSb2
_chemical_formula_sum   'Ba2 In2 Sb4'
_cell_volume   287.53
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Ba  Ba0  2  -0.0  0.0  0.2  1.0
  In  In1  2  0.0  0.0  0.77  1.0
  Sb  Sb2  2  0.0  0.0  0.73  1.0
  Sb  Sb3  2  0.0  0.0  0.58  1.0

Ba In Sb Sb