data_BaGa2Te
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.44
_cell_length_b   6.44
_cell_length_c   6.44
_cell_angle_alpha   143.48
_cell_angle_beta   129.91
_cell_angle_gamma   63.56
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaGa2Te
_chemical_formula_sum   'Ba1 Ga2 Te1'
_cell_volume   120.26
_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  0.47  1.0
  Ga  Ga1  1  0.02  0.0  0.43  1.0
  Ga  Ga2  1  0.0  0.72  0.04  1.0
  Te  Te3  1  0.0  0.0  0.0  1.0

data_BaGa2Te
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.03
_cell_length_b   5.45
_cell_length_c   6.44
_cell_angle_alpha   115.04
_cell_angle_beta   108.26
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaGa2Te
_chemical_formula_sum   'Ba1 Ga2 Te1'
_cell_volume   120.26
_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  0.47  0.47  1.0
  Ga  Ga1  1  0.0  0.43  0.41  1.0
  Ga  Ga2  1  0.28  0.32  0.32  1.0
  Te  Te3  1  0.0  0.0  0.0  1.0

Ba Ga Ga Te