data_Ga2ReOs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.51
_cell_length_b   4.51
_cell_length_c   4.96
_cell_angle_alpha   100.54
_cell_angle_beta   100.54
_cell_angle_gamma   36.81
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ga2ReOs
_chemical_formula_sum   'Ga2 Re1 Os1'
_cell_volume   59.18
_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  0.41  0.0  0.62  1.0
  Ga  Ga1  1  0.18  0.0  0.24  1.0
  Re  Re3  1  0.0  0.0  0.0  1.0
  Os  Os2  1  0.8  0.0  0.43  1.0

data_Ga2ReOs
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.85
_cell_length_b   4.51
_cell_length_c   4.96
_cell_angle_alpha   100.54
_cell_angle_beta   90.0
_cell_angle_gamma   108.41
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ga2ReOs
_chemical_formula_sum   'Ga2 Re1 Os1'
_cell_volume   59.18
_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  0.59  0.38  1.0
  Ga  Ga1  1  0.0  0.82  0.76  1.0
  Re  Re2  1  0.0  0.0  0.0  1.0
  Os  Os3  1  0.0  0.2  0.57  1.0

Ga Ga Re Os
Ga Ga Re Os 0 1 o o o 0 3 o o o 1 2 o o o 1 3 - o o 2 3 - o o 