data_ScTaGa2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.54
_cell_length_b   5.54
_cell_length_c   4.63
_cell_angle_alpha   114.2
_cell_angle_beta   114.2
_cell_angle_gamma   33.41
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScTaGa2
_chemical_formula_sum   'Sc1 Ta1 Ga2'
_cell_volume   70.61
_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
  Sc  Sc2  1  0.31  0.0  0.19  1.0
  Ta  Ta3  1  0.43  0.0  0.91  1.0
  Ga  Ga0  1  0.48  0.0  0.1  1.0
  Ga  Ga1  1  0.33  0.0  0.07  1.0

data_ScTaGa2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.18
_cell_length_b   4.63
_cell_length_c   5.54
_cell_angle_alpha   114.2
_cell_angle_beta   106.7
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScTaGa2
_chemical_formula_sum   'Sc1 Ta1 Ga2'
_cell_volume   70.61
_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
  Sc  Sc0  1  0.0  0.19  0.31  1.0
  Ta  Ta1  1  0.0  0.91  0.43  1.0
  Ga  Ga2  1  0.0  0.07  0.33  1.0
  Ga  Ga3  1  0.0  0.1  0.48  1.0

Sc Ta Ga Ga