data_GaSn2Mo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.42
_cell_length_b   10.42
_cell_length_c   10.42
_cell_angle_alpha   17.22
_cell_angle_beta   17.22
_cell_angle_gamma   17.22
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaSn2Mo
_chemical_formula_sum   'Ga1 Sn2 Mo1'
_cell_volume   86.48
_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  0.02  1.0
  Sn  Sn2  1  0.0  0.0  0.46  1.0
  Sn  Sn3  1  0.0  0.0  0.43  1.0
  Mo  Mo1  1  0.0  0.0  0.26  1.0

data_GaSn2Mo
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.4
_cell_length_b   3.12
_cell_length_c   10.42
_cell_angle_alpha   90.0
_cell_angle_beta   99.96
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   GaSn2Mo
_chemical_formula_sum   'Ga2 Sn4 Mo2'
_cell_volume   172.97
_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  0.98  1.0
  Sn  Sn1  2  0.0  0.0  0.54  1.0
  Sn  Sn2  2  0.0  0.0  0.57  1.0
  Mo  Mo3  2  0.0  0.0  0.74  1.0

Ga Sn Sn Mo