# generated using pymatgen
data_V2NiS4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.16383880
_cell_length_b   3.22423520
_cell_length_c   5.85472658
_cell_angle_alpha   90.00000000
_cell_angle_beta   115.76979961
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V2NiS4
_chemical_formula_sum   'V4 Ni2 S8'
_cell_volume   206.78111922
_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  0.24179100  0.50000000  0.69090500  1
  V  V1  1  0.25820900  0.00000000  0.30909500  1
  V  V2  1  0.74179100  0.00000000  0.69090500  1
  V  V3  1  0.75820900  0.50000000  0.30909500  1
  Ni  Ni4  1  0.00000000  0.00000000  0.00000000  1
  Ni  Ni5  1  0.50000000  0.50000000  -0.00000000  1
  S  S6  1  0.10729200  0.00000000  0.44658600  1
  S  S7  1  0.36142100  0.00000000  0.01991100  1
  S  S8  1  0.39270800  0.50000000  0.55341400  1
  S  S9  1  0.13857900  0.50000000  0.98008900  1
  S  S10  1  0.60729200  0.50000000  0.44658600  1
  S  S11  1  0.86142100  0.50000000  0.01991100  1
  S  S12  1  0.89270800  0.00000000  0.55341400  1
  S  S13  1  0.63857900  0.00000000  0.98008900  1
