data_GaW2Se
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.09
_cell_length_b   5.09
_cell_length_c   2.99
_cell_angle_alpha   102.22
_cell_angle_beta   102.22
_cell_angle_gamma   113.21
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaW2Se
_chemical_formula_sum   'Ga1 W2 Se1'
_cell_volume   65.66
_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
  W  W2  1  0.82  0.88  0.38  1.0
  W  W3  1  0.82  0.12  0.38  1.0
  Se  Se1  1  0.8  0.0  0.0  1.0

data_GaW2Se
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.99
_cell_length_b   5.09
_cell_length_c   5.09
_cell_angle_alpha   113.21
_cell_angle_beta   102.22
_cell_angle_gamma   102.22
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaW2Se
_chemical_formula_sum   'Ga1 W2 Se1'
_cell_volume   65.66
_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
  W  W1  1  0.38  0.82  0.88  1.0
  W  W2  1  0.38  0.82  0.12  1.0
  Se  Se3  1  0.0  0.8  0.0  1.0

Ga W W Se