# generated using pymatgen
data_VCl3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.94421299
_cell_length_b   6.94202840
_cell_length_c   6.94232537
_cell_angle_alpha   51.67195128
_cell_angle_beta   51.74757368
_cell_angle_gamma   51.75280564
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VCl3
_chemical_formula_sum   'V2 Cl6'
_cell_volume   190.56535084
_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  1  0.66648696  0.66677111  0.66685545  1.0
  V  V1  1  0.33351281  0.33322987  0.33314125  1.0
  Cl  Cl2  1  0.57424417  0.27537575  0.92512470  1.0
  Cl  Cl3  1  0.27530271  0.92498994  0.57465510  1.0
  Cl  Cl4  1  0.07434692  0.42296259  0.72586584  1.0
  Cl  Cl5  1  0.72468160  0.07502710  0.42534877  1.0
  Cl  Cl6  1  0.42576257  0.72461248  0.07488339  1.0
  Cl  Cl7  1  0.92566126  0.57703216  0.27412750  1.0