data_V2NiCl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.88
_cell_length_b   3.88
_cell_length_c   5.55
_cell_angle_alpha   98.57
_cell_angle_beta   98.57
_cell_angle_gamma   41.33
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V2NiCl
_chemical_formula_sum   'V2 Ni1 Cl1'
_cell_volume   54.4
_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  V2  1  0.22  0.0  0.39  1.0
  V  V3  1  0.15  0.0  0.08  1.0
  Ni  Ni1  1  0.19  0.0  0.74  1.0
  Cl  Cl0  1  0.0  0.0  0.0  1.0

data_V2NiCl
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.74
_cell_length_b   3.88
_cell_length_c   5.55
_cell_angle_alpha   98.57
_cell_angle_beta   90.0
_cell_angle_gamma   110.67
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V2NiCl
_chemical_formula_sum   'V2 Ni1 Cl1'
_cell_volume   54.4
_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  1  0.0  0.78  0.61  1.0
  V  V1  1  0.0  0.85  0.92  1.0
  Ni  Ni2  1  0.0  0.81  0.26  1.0
  Cl  Cl3  1  0.0  0.0  0.0  1.0

V V Ni Cl