data_[Sr2Ca1La1O4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Ca  1.0000  1.8000  1.1400
  La  1.1000  1.9500  1.1720
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [6.2214]
_cell_length_b [3.6067]
_cell_length_c [6.2455]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.1476]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Sr2CaLaO4]
_chemical_formula_sum '[Sr2 Ca1 La1 O4]'
_cell_volume [132.3870]
_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  0.0000  0.5000  0.5000  1.0
  Sr  Sr1  1  0.5000  0.0000  0.5000  1.0
  Ca  Ca2  1  0.0000  0.0000  0.0000  1.0
  La  La3  1  0.5000  0.5000  0.0000  1.0
  O  O4  2  0.2433  0.5000  0.2332  1.0
  O  O5  2  0.2492  0.0000  0.7630  1.0
]