data_[Sr4La4In16]
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 [Cmcm]
_cell_length_a [4.5960]
_cell_length_b [21.1110]
_cell_length_c [7.4539]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [SrLaIn4]
_chemical_formula_sum '[Sr4 La4 In16]'
_cell_volume [723.2268]
_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  0.0000  0.0930  0.2500  1
  La  La1  4  0.0000  0.2349  0.7500  1
  In  In2  8  0.0000  0.3531  0.0436  1
  In  In3  4  0.0000  0.0708  0.7500  1
  In  In4  4  0.0000  0.5000  0.0000  1
]