data_[V6P6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [2.5441]
_cell_length_b [19.1974]
_cell_length_c [19.1974]
_cell_angle_alpha [120.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [VP]
_chemical_formula_sum '[V6 P6]'
_cell_volume [811.9864]
_cell_formula_units_Z [6]
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  2  0.1392  0.5431  0.1834  1
  V  V1  2  0.1593  0.4368  0.9308  1
  V  V2  2  0.4059  0.4236  0.0568  1
  P  P3  2  0.1977  0.6752  0.0607  1
  P  P4  2  0.2530  0.5736  0.8277  1
  P  P5  2  0.3835  0.3390  0.7878  1
]