data_CdGaW
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.93
_cell_length_b   2.93
_cell_length_c   7.16
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdGaW
_chemical_formula_sum   'Cd1 Ga1 W1'
_cell_volume   53.11
_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
  Cd  Cd0  1  1.0  0.69  0.16  1.0
  Ga  Ga1  1  0.0  0.0  0.49  1.0
  W  W2  1  0.46  0.84  0.67  1.0

data_CdGaW
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.93
_cell_length_b   2.93
_cell_length_c   7.16
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdGaW
_chemical_formula_sum   'Cd1 Ga1 W1'
_cell_volume   53.11
_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
  Cd  Cd0  1  1.0  0.69  0.16  1.0
  Ga  Ga1  1  0.0  0.0  0.49  1.0
  W  W2  1  0.46  0.84  0.67  1.0

Cd Ga W
Cd Ga W 0 0 + + o 0 0 o + o 0 0 + o o 0 1 + + o 0 1 + o o 1 2 - - o 1 2 o - o 