data_[V3Cl11]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P6]
_cell_length_a [9.1236]
_cell_length_b [9.1236]
_cell_length_c [19.3124]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [168]
_chemical_formula_structural [V3Cl11]
_chemical_formula_sum '[V3 Cl11]'
_cell_volume [1392.1797]
_cell_formula_units_Z [1]
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  0.3333  0.6667  0.5505  1
  V  V1  1  0.0000  0.0000  0.3638  1
  Cl  Cl2  6  0.1517  0.7311  0.5871  1
  Cl  Cl3  3  0.0000  0.5000  0.3746  1
  Cl  Cl4  2  0.3333  0.6667  0.4445  1
]