data_TaAl2Ga
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.1
_cell_length_b   5.1
_cell_length_c   4.85
_cell_angle_alpha   95.97
_cell_angle_beta   95.97
_cell_angle_gamma   32.07
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaAl2Ga
_chemical_formula_sum   'Ta1 Al2 Ga1'
_cell_volume   66.62
_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
  Ta  Ta3  1  0.64  0.0  0.41  1.0
  Al  Al0  1  0.29  0.0  0.25  1.0
  Al  Al1  1  1.0  0.0  0.56  1.0
  Ga  Ga2  1  0.0  0.0  0.0  1.0

data_TaAl2Ga
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.82
_cell_length_b   4.85
_cell_length_c   5.1
_cell_angle_alpha   95.97
_cell_angle_beta   106.04
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaAl2Ga
_chemical_formula_sum   'Ta1 Al2 Ga1'
_cell_volume   66.62
_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
  Ta  Ta0  1  0.0  0.41  0.64  1.0
  Al  Al1  1  0.0  0.25  0.29  1.0
  Al  Al2  1  0.0  0.56  1.0  1.0
  Ga  Ga3  1  0.0  0.0  0.0  1.0

Ta Al Al Ga