data_CrGaW
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.29
_cell_length_b   4.29
_cell_length_c   2.69
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrGaW
_chemical_formula_sum   'Cr1 Ga1 W1'
_cell_volume   42.77
_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
  Cr  Cr0  1  0.0  0.0  0.65  1.0
  Ga  Ga1  1  0.0  0.47  0.79  1.0
  W  W2  1  0.14  0.24  0.94  1.0

data_CrGaW
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.69
_cell_length_b   4.29
_cell_length_c   4.29
_cell_angle_alpha   120.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrGaW
_chemical_formula_sum   'Cr1 Ga1 W1'
_cell_volume   42.77
_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
  Cr  Cr0  1  0.65  0.0  0.0  1.0
  Ga  Ga1  1  0.79  0.0  0.47  1.0
  W  W2  1  0.94  0.14  0.24  1.0

Cr Ga W
Cr Ga W 0 2 o o o 1 2 o o o 