data_SrCaLa
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.85
_cell_length_b   6.85
_cell_length_c   6.85
_cell_angle_alpha   147.59
_cell_angle_beta   129.25
_cell_angle_gamma   61.51
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrCaLa
_chemical_formula_sum   'Sr1 Ca1 La1'
_cell_volume   132.34
_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
  Sr  Sr2  1  0.0  0.0  0.9  1.0
  Ca  Ca0  1  0.0  0.0  0.06  1.0
  La  La1  1  0.0  0.0  0.82  1.0

data_SrCaLa
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.83
_cell_length_b   5.87
_cell_length_c   6.85
_cell_angle_alpha   115.37
_cell_angle_beta   106.2
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrCaLa
_chemical_formula_sum   'Sr1 Ca1 La1'
_cell_volume   132.34
_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
  Sr  Sr0  1  0.0  0.9  0.9  1.0
  Ca  Ca1  1  0.0  0.06  0.06  1.0
  La  La2  1  0.0  0.82  0.82  1.0

Sr Ca La
Sr Ca La 0 2 o o o 0 1 o o + 