data_[V8As6]
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
]
_symmetry_space_group_name_H-M [Pcc2]
_cell_length_a [4.3992]
_cell_length_b [19.3936]
_cell_length_c [9.7887]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [27]
_chemical_formula_structural [V4As3]
_chemical_formula_sum '[V8 As6]'
_cell_volume [835.1240]
_cell_formula_units_Z [2]
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  0.4518  0.4414  0.4278  1
  V  V1  2  0.0000  0.5000  0.0463  1
  V  V2  2  0.5000  0.5000  0.1750  1
  As  As3  4  0.2563  0.3867  0.1169  1
  As  As4  2  0.0000  0.5000  0.3017  1
]