data_BaSrLa2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.09
_cell_length_b   7.09
_cell_length_c   6.83
_cell_angle_alpha   99.41
_cell_angle_beta   99.41
_cell_angle_gamma   32.22
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaSrLa2
_chemical_formula_sum   'Ba1 Sr1 La2'
_cell_volume   180.5
_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  0.23  0.0  0.36  1.0
  Sr  Sr3  1  0.0  0.0  0.0  1.0
  La  La1  1  0.53  0.0  0.04  1.0
  La  La2  1  0.94  0.0  0.69  1.0

data_BaSrLa2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.94
_cell_length_b   6.83
_cell_length_c   7.09
_cell_angle_alpha   99.41
_cell_angle_beta   106.11
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaSrLa2
_chemical_formula_sum   'Ba1 Sr1 La2'
_cell_volume   180.5
_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  0.36  0.23  1.0
  Sr  Sr1  1  0.0  0.0  0.0  1.0
  La  La2  1  0.0  0.04  0.53  1.0
  La  La3  1  0.0  0.69  0.94  1.0

Ba Sr La La
Ba Sr La La 0 1 o o o 0 3 - o o 0 2 o o o 1 3 - o - 1 2 o o o 1 2 - o o 2 2 + - o 2 3 o o - 