data_GaFe2Sn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.48
_cell_length_b   4.48
_cell_length_c   4.92
_cell_angle_alpha   101.75
_cell_angle_beta   101.75
_cell_angle_gamma   40.71
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaFe2Sn
_chemical_formula_sum   'Ga1 Fe2 Sn1'
_cell_volume   62.83
_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  Ga2  1  0.0  0.0  0.0  1.0
  Fe  Fe0  1  0.05  0.0  0.97  1.0
  Fe  Fe1  1  0.27  0.0  0.84  1.0
  Sn  Sn3  1  0.66  0.0  0.4  1.0

data_GaFe2Sn
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.12
_cell_length_b   4.48
_cell_length_c   4.92
_cell_angle_alpha   101.75
_cell_angle_beta   90.0
_cell_angle_gamma   110.35
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaFe2Sn
_chemical_formula_sum   'Ga1 Fe2 Sn1'
_cell_volume   62.83
_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  0.0  0.0  1.0
  Fe  Fe1  1  0.0  0.73  0.16  1.0
  Fe  Fe2  1  0.0  0.95  0.03  1.0
  Sn  Sn3  1  0.0  0.34  0.6  1.0

Ga Fe Fe Sn