data_Ga2FeMo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.06
_cell_length_b   3.06
_cell_length_c   6.09
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ga2FeMo
_chemical_formula_sum   'Ga2 Fe1 Mo1'
_cell_volume   57.15
_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  Ga1  1  0.53  0.53  0.92  1.0
  Ga  Ga2  1  0.0  0.0  0.54  1.0
  Fe  Fe0  1  0.0  0.0  0.62  1.0
  Mo  Mo3  1  0.53  0.53  0.15  1.0

data_Ga2FeMo
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.33
_cell_length_b   4.33
_cell_length_c   6.09
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Ga2FeMo
_chemical_formula_sum   'Ga4 Fe2 Mo2'
_cell_volume   114.31
_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  0.0  0.0  0.54  1.0
  Ga  Ga1  2  0.03  0.5  0.92  1.0
  Fe  Fe2  2  0.0  0.0  0.62  1.0
  Mo  Mo3  2  0.03  0.5  0.15  1.0

Ga Ga Fe Mo
Ga Ga Fe Mo 0 3 o o + 1 2 o o o 