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 [Cm]
_cell_length_a [5.0832]
_cell_length_b [6.4769]
_cell_length_c [18.1823]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [VP]
_chemical_formula_sum '[V6 P6]'
_cell_volume [598.6249]
_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  4  0.0541  0.2270  0.5031  1
  V  V1  2  0.3129  0.5000  0.4230  1
  P  P2  2  0.2660  0.5000  0.5659  1
  P  P3  2  0.3152  0.0000  0.4150  1
  P  P4  2  0.3388  0.0000  0.5900  1
]