data_GaTe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.5
_cell_length_b   6.5
_cell_length_c   6.5
_cell_angle_alpha   152.44
_cell_angle_beta   135.8
_cell_angle_gamma   52.89
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaTe2
_chemical_formula_sum   'Ga1 Te2'
_cell_volume   88.17
_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
  Ga  Ga0  1  0.0  0.0  0.0  1.0
  Te  Te1  1  0.0  0.0  0.4  1.0
  Te  Te2  1  0.0  0.0  0.24  1.0

data_GaTe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.1
_cell_length_b   4.89
_cell_length_c   6.5
_cell_angle_alpha   112.1
_cell_angle_beta   103.78
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaTe2
_chemical_formula_sum   'Ga1 Te2'
_cell_volume   88.17
_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
  Ga  Ga0  1  0.0  0.0  0.0  1.0
  Te  Te1  1  0.0  0.24  0.24  1.0
  Te  Te2  1  0.0  0.4  0.4  1.0

Ga Te Te
Ga Te Te 0 2 o o o 1 2 o o o 