data_[Zn2In32Sn24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  In  1.7800  1.5500  0.9400
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [11.6728]
_cell_length_b [17.1720]
_cell_length_c [9.5466]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.0135]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Zn(In4Sn3)4]
_chemical_formula_sum '[Zn2 In32 Sn24]'
_cell_volume [1604.6114]
_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
[
  Zn  Zn0  2  0.4478  0.0000  0.7348  1
  In  In1  4  0.0590  0.3466  0.4008  1
  In  In2  4  0.1645  0.8335  0.9999  1
  In  In3  4  0.1714  0.1733  0.6095  1
  In  In4  4  0.2885  0.2860  0.3093  1
  In  In5  4  0.4371  0.1522  0.9990  1
  In  In6  4  0.4924  0.2101  0.7019  1
  In  In7  2  0.1532  0.5000  0.6501  1
  In  In8  2  0.1595  0.5000  0.2860  1
  In  In9  2  0.4916  0.5000  0.3359  1
  In  In10  2  0.4961  0.5000  0.9802  1
  Sn  Sn11  4  0.0087  0.8214  0.2058  1
  Sn  Sn12  4  0.1933  0.4090  0.0053  1
  Sn  Sn13  4  0.3010  0.0932  0.4128  1
  Sn  Sn14  4  0.3123  0.3313  0.8065  1
  Sn  Sn15  4  0.4236  0.4083  0.6083  1
  Sn  Sn16  2  0.2171  0.0000  0.7573  1
  Sn  Sn17  2  0.3312  0.0000  0.1375  1
]