data_[Sr4La4In4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  La  1.1000  1.9500  1.1720
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.0216]
_cell_length_b [3.8284]
_cell_length_c [9.2301]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.6964]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [SrLaIn]
_chemical_formula_sum '[Sr4 La4 In4]'
_cell_volume [435.8534]
_cell_formula_units_Z [4]
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  4  0.1516  0.0000  0.1090  1.0
  La  La1  4  0.1223  0.0000  0.5233  1.0
  In  In2  4  0.0455  0.5000  0.7733  1.0
]