data_[V8Ni16P8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  Ni  1.9100  1.3500  0.7400
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [12.8507]
_cell_length_b [6.4396]
_cell_length_c [4.5243]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [VNi2P]
_chemical_formula_sum '[V8 Ni16 P8]'
_cell_volume [374.4003]
_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
[
  V  V0  4  0.1063  0.2500  0.7404  1
  V  V1  4  0.1392  0.7500  0.5427  1
  Ni  Ni2  8  0.0350  0.0566  0.2596  1
  Ni  Ni3  8  0.2143  0.5554  0.0408  1
  P  P4  4  0.0682  0.7500  0.0388  1
  P  P5  4  0.1836  0.2500  0.2506  1
]