data_[Pr16Ni24P8]
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
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [Fmmm]
_cell_length_a [8.0487]
_cell_length_b [8.0621]
_cell_length_c [13.9585]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [69]
_chemical_formula_structural [Pr2Ni3P]
_chemical_formula_sum '[Pr16 Ni24 P8]'
_cell_volume [905.7538]
_cell_formula_units_Z [8]
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  8  0.2410  0.0000  0.0000  1.0
  Pr  Pr1  8  0.2500  0.2500  0.2500  1.0
  Ni  Ni2  16  0.0000  0.2419  0.4144  1.0
  Ni  Ni3  8  0.0000  0.0000  0.1717  1.0
  P  P4  8  0.0000  0.0000  0.3333  1.0
]