data_YTiGa
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.79
_cell_length_b   5.79
_cell_length_c   5.79
_cell_angle_alpha   147.17
_cell_angle_beta   142.4
_cell_angle_gamma   50.75
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YTiGa
_chemical_formula_sum   'Y1 Ti1 Ga1'
_cell_volume   63.85
_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
  Y  Y2  1  0.0  0.0  0.51  1.0
  Ti  Ti1  1  0.0  0.0  0.69  1.0
  Ga  Ga0  1  0.0  0.0  0.27  1.0

data_YTiGa
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.27
_cell_length_b   3.73
_cell_length_c   5.79
_cell_angle_alpha   108.8
_cell_angle_beta   106.41
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YTiGa
_chemical_formula_sum   'Y1 Ti1 Ga1'
_cell_volume   63.85
_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
  Y  Y0  1  0.49  0.49  0.49  1.0
  Ti  Ti1  1  0.31  0.31  0.31  1.0
  Ga  Ga2  1  0.73  0.73  0.73  1.0

Y Ti Ga