data_AsCl3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.0
_cell_length_b   8.06
_cell_length_c   8.09
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AsCl3
_chemical_formula_sum   'As2 Cl6'
_cell_volume   325.89
_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
  As  As0  1  0.5  0.0  0.83  1.0
  As  As1  1  0.0  0.03  0.25  1.0
  Cl  Cl2  1  0.0  0.0  0.36  1.0
  Cl  Cl3  1  0.5  0.03  0.72  1.0
  Cl  Cl4  1  0.5  0.39  0.42  1.0
  Cl  Cl5  1  0.5  0.67  0.42  1.0
  Cl  Cl6  1  0.0  0.36  0.67  1.0
  Cl  Cl7  1  0.0  0.7  0.67  1.0

data_AsCl3
_symmetry_space_group_name_H-M   Pm
_cell_length_a   8.06
_cell_length_b   5.0
_cell_length_c   8.09
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   AsCl3
_chemical_formula_sum   'As2 Cl6'
_cell_volume   325.89
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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
  As  As0  1  0.0  0.5  0.83  1.0
  As  As1  1  0.03  0.0  0.25  1.0
  Cl  Cl2  1  0.0  0.0  0.36  1.0
  Cl  Cl3  1  0.03  0.5  0.72  1.0
  Cl  Cl4  1  0.36  0.0  0.67  1.0
  Cl  Cl5  1  0.39  0.5  0.42  1.0
  Cl  Cl6  1  0.67  0.5  0.42  1.0
  Cl  Cl7  1  0.7  0.0  0.67  1.0

As As Cl Cl Cl Cl Cl Cl