data_VAsCl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.14
_cell_length_b   7.14
_cell_length_c   7.14
_cell_angle_alpha   156.3
_cell_angle_beta   140.61
_cell_angle_gamma   46.48
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VAsCl2
_chemical_formula_sum   'V1 As1 Cl2'
_cell_volume   92.64
_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  V3  1  0.0  0.0  0.41  1.0
  As  As0  1  0.0  0.41  0.93  1.0
  Cl  Cl1  1  0.0  0.0  0.17  1.0
  Cl  Cl2  1  0.47  0.0  0.61  1.0

data_VAsCl2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.93
_cell_length_b   4.81
_cell_length_c   7.14
_cell_angle_alpha   109.69
_cell_angle_beta   101.85
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VAsCl2
_chemical_formula_sum   'V1 As1 Cl2'
_cell_volume   92.64
_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  0.41  0.41  1.0
  As  As1  1  0.59  0.53  0.53  1.0
  Cl  Cl2  1  0.0  0.17  0.17  1.0
  Cl  Cl3  1  0.0  0.61  0.14  1.0

V As Cl Cl
V As Cl Cl 0 1 o o o 0 1 o - - 0 2 o o o 0 3 o o o 2 3 o o o 2 3 - o - 