data_[Sr6In4Sn8]
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 [C2/m]
_cell_length_a [13.0391]
_cell_length_b [4.8109]
_cell_length_c [9.9019]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.2038]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Sr3(InSn2)2]
_chemical_formula_sum '[Sr6 In4 Sn8]'
_cell_volume [582.9209]
_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  4  0.1198  0.5000  0.6888  1.0
  Sr  Sr1  2  0.0000  0.0000  0.0000  1.0
  In  In2  4  0.1998  0.5000  0.3489  1.0
  Sn  Sn3  4  0.0831  0.0000  0.3904  1.0
  Sn  Sn4  4  0.2015  0.5000  0.0469  1.0
]