data_LaGaTe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.98
_cell_length_b   4.98
_cell_length_c   3.94
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaGaTe
_chemical_formula_sum   'La1 Ga1 Te1'
_cell_volume   84.67
_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
  La  La1  1  0.49  0.44  0.27  1.0
  Ga  Ga0  1  0.0  0.0  0.39  1.0
  Te  Te2  1  0.0  0.88  0.21  1.0

data_LaGaTe
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.94
_cell_length_b   4.98
_cell_length_c   4.98
_cell_angle_alpha   120.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaGaTe
_chemical_formula_sum   'La1 Ga1 Te1'
_cell_volume   84.67
_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
  La  La0  1  0.27  0.49  0.44  1.0
  Ga  Ga1  1  0.39  0.0  0.0  1.0
  Te  Te2  1  0.21  0.0  0.88  1.0

La Ga Te
La Ga Te 0 2 o - o 0 2 + o o 0 1 o o o 0 1 + + o 1 2 o - o 