data_[V16As4P4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  As  2.1800  1.1500  0.6600
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [12.8445]
_cell_length_b [4.5085]
_cell_length_c [6.1313]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.3298]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [V4AsP]
_chemical_formula_sum '[V16 As4 P4]'
_cell_volume [344.0120]
_cell_formula_units_Z [4]
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  8  0.0690  0.3760  0.9299  1
  V  V1  8  0.1735  0.1803  0.6111  1
  As  As2  4  0.0000  0.1272  0.2500  1
  P  P3  4  0.2500  0.2500  0.0000  1
]