data_GaRuPt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.91
_cell_length_b   6.65
_cell_length_c   2.79
_cell_angle_alpha   83.26
_cell_angle_beta   73.07
_cell_angle_gamma   23.67
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaRuPt
_chemical_formula_sum   'Ga1 Ru1 Pt1'
_cell_volume   45.39
_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  0.48  0.37  0.96  1.0
  Ru  Ru2  1  0.48  0.37  0.46  1.0
  Pt  Pt1  1  0.48  0.37  0.53  1.0

data_GaRuPt
_symmetry_space_group_name_H-M   Cm
_cell_length_a   2.95
_cell_length_b   12.97
_cell_length_c   2.79
_cell_angle_alpha   90.0
_cell_angle_beta   121.93
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   GaRuPt
_chemical_formula_sum   'Ga2 Ru2 Pt2'
_cell_volume   90.79
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.46  0.5  0.43  1.0
  Ru  Ru1  2  0.46  0.0  0.94  1.0
  Pt  Pt2  2  0.03  0.5  0.0  1.0

Ga Ru Pt
Ga Ru Pt 0 2 o o o 0 1 o o o 0 1 o o + 1 2 o o o 