data_[Pr6Ni8Sn4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Ni  1.9100  1.3500  0.7400
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.4185]
_cell_length_b [4.3121]
_cell_length_c [8.5272]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.5652]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pr3(Ni2Sn)2]
_chemical_formula_sum '[Pr6 Ni8 Sn4]'
_cell_volume [380.5754]
_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
[
  Pr  Pr0  4  0.1265  0.5000  0.3794  1.0
  Pr  Pr1  2  0.0000  0.0000  0.0000  1.0
  Ni  Ni2  4  0.0767  0.0000  0.6225  1.0
  Ni  Ni3  4  0.2378  0.5000  0.0812  1.0
  Sn  Sn4  4  0.1703  0.5000  0.7814  1.0
]