data_LaCrGa
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.88
_cell_length_b   5.88
_cell_length_c   5.88
_cell_angle_alpha   146.27
_cell_angle_beta   146.27
_cell_angle_gamma   48.44
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaCrGa
_chemical_formula_sum   'La1 Cr1 Ga1'
_cell_volume   62.27
_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
  La  La2  1  0.0  0.0  0.1  1.0
  Cr  Cr0  1  0.0  0.0  0.25  1.0
  Ga  Ga1  1  0.0  0.0  0.08  1.0

data_LaCrGa
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.82
_cell_length_b   4.82
_cell_length_c   5.88
_cell_angle_alpha   90.0
_cell_angle_beta   114.22
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   LaCrGa
_chemical_formula_sum   'La2 Cr2 Ga2'
_cell_volume   124.53
_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
  La  La0  2  0.0  0.0  0.9  1.0
  Cr  Cr1  2  0.0  0.0  0.75  1.0
  Ga  Ga2  2  0.0  0.0  0.92  1.0

La Cr Ga