data_BaGa2Tc
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.33
_cell_length_b   5.33
_cell_length_c   3.22
_cell_angle_alpha   94.92
_cell_angle_beta   94.92
_cell_angle_gamma   104.68
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaGa2Tc
_chemical_formula_sum   'Ba1 Ga2 Tc1'
_cell_volume   87.68
_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
  Ba  Ba0  1  0.26  0.0  0.0  1.0
  Ga  Ga1  1  0.4  0.11  0.59  1.0
  Ga  Ga2  1  0.4  0.89  0.59  1.0
  Tc  Tc3  1  0.0  0.0  0.0  1.0

data_BaGa2Tc
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.22
_cell_length_b   5.33
_cell_length_c   5.33
_cell_angle_alpha   104.68
_cell_angle_beta   94.92
_cell_angle_gamma   94.92
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaGa2Tc
_chemical_formula_sum   'Ba1 Ga2 Tc1'
_cell_volume   87.68
_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
  Ba  Ba0  1  0.0  0.26  0.0  1.0
  Ga  Ga1  1  0.59  0.4  0.11  1.0
  Ga  Ga2  1  0.59  0.4  0.89  1.0
  Tc  Tc3  1  0.0  0.0  0.0  1.0

Ba Ga Ga Tc