data_[Cu10Sn14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cu  1.9000  1.3500  0.8200
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [10.7811]
_cell_length_b [8.7991]
_cell_length_c [6.6338]
_cell_angle_alpha [90.0000]
_cell_angle_beta [126.2221]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Cu5Sn7]
_chemical_formula_sum '[Cu10 Sn14]'
_cell_volume [507.6847]
_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
[
  Cu  Cu0  4  0.0050  0.2240  0.8233  1.0
  Cu  Cu1  2  0.0016  0.0000  0.5495  1.0
  Cu  Cu2  2  0.2232  0.0000  0.0390  1.0
  Cu  Cu3  2  0.2727  0.5000  0.5879  1.0
  Sn  Sn4  4  0.2172  0.2162  0.6946  1.0
  Sn  Sn5  4  0.2852  0.2818  0.2652  1.0
  Sn  Sn6  2  0.0007  0.5000  0.0776  1.0
  Sn  Sn7  2  0.4908  0.5000  0.1181  1.0
  Sn  Sn8  2  0.4965  0.0000  0.5755  1.0
]