data_Cr2GaOs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.95
_cell_length_b   4.95
_cell_length_c   4.95
_cell_angle_alpha   144.6
_cell_angle_beta   131.55
_cell_angle_gamma   61.42
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr2GaOs
_chemical_formula_sum   'Cr2 Ga1 Os1'
_cell_volume   51.92
_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  0.5  0.0  0.15  1.0
  Cr  Cr1  1  0.0  0.03  0.1  1.0
  Ga  Ga2  1  0.0  0.0  0.0  1.0
  Os  Os3  1  0.0  0.0  0.25  1.0

data_Cr2GaOs
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.01
_cell_length_b   4.06
_cell_length_c   4.95
_cell_angle_alpha   114.22
_cell_angle_beta   107.7
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr2GaOs
_chemical_formula_sum   'Cr2 Ga1 Os1'
_cell_volume   51.92
_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  0.36  0.85  0.36  1.0
  Cr  Cr1  1  0.9  0.92  0.92  1.0
  Ga  Ga2  1  0.0  0.0  0.0  1.0
  Os  Os3  1  0.75  0.75  0.75  1.0

Cr Cr Ga Os
Cr Cr Ga Os 0 2 o o o 0 1 o o o 0 3 + o o 1 2 o o o 1 3 o o o 