# generated using pymatgen
data_VNCl3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.30126254
_cell_length_b   7.30126254
_cell_length_c   5.92042100
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000493
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VNCl3
_chemical_formula_sum   'V2 N2 Cl6'
_cell_volume   273.32485812
_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  0.00000000  0.00000000  0.00000000  1.0
  V  V1  1  0.00000000  0.00000000  0.50000000  1.0
  N  N2  1  0.33333300  0.66666700  0.75000000  1.0
  N  N3  1  0.66666700  0.33333300  0.25000000  1.0
  Cl  Cl4  1  0.14729200  0.29458400  0.25000000  1.0
  Cl  Cl5  1  0.85270800  0.70541600  0.75000000  1.0
  Cl  Cl6  1  0.70541600  0.85270800  0.25000000  1.0
  Cl  Cl7  1  0.29458400  0.14729200  0.75000000  1.0
  Cl  Cl8  1  0.14729200  0.85270800  0.25000000  1.0
  Cl  Cl9  1  0.85270800  0.14729200  0.75000000  1.0