data_[Sr4In2Sn2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  In  1.7800  1.5500  0.9400
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.6656]
_cell_length_b [4.7232]
_cell_length_c [9.6577]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.0060]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Sr2InSn]
_chemical_formula_sum '[Sr4 In2 Sn2]'
_cell_volume [289.1593]
_cell_formula_units_Z [2]
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  2  0.2131  0.2500  0.4329  1.0
  Sr  Sr1  2  0.2964  0.7500  0.0720  1.0
  In  In2  2  0.1311  0.2500  0.7881  1.0
  Sn  Sn3  2  0.3578  0.7500  0.7133  1.0
]