data_ZnAs2Cl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.4
_cell_length_b   6.4
_cell_length_c   6.4
_cell_angle_alpha   151.74
_cell_angle_beta   140.36
_cell_angle_gamma   49.39
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnAs2Cl
_chemical_formula_sum   'Zn1 As2 Cl1'
_cell_volume   78.92
_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
  Zn  Zn3  1  0.0  0.0  0.82  1.0
  As  As0  1  0.56  0.0  0.45  1.0
  As  As1  1  0.0  0.17  0.37  1.0
  Cl  Cl2  1  0.0  0.0  0.0  1.0

data_ZnAs2Cl
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.13
_cell_length_b   4.34
_cell_length_c   6.4
_cell_angle_alpha   109.82
_cell_angle_beta   104.13
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnAs2Cl
_chemical_formula_sum   'Zn1 As2 Cl1'
_cell_volume   78.92
_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
  Zn  Zn0  1  0.18  0.18  0.18  1.0
  As  As1  1  0.11  0.55  0.11  1.0
  As  As2  1  0.63  0.8  0.8  1.0
  Cl  Cl3  1  0.0  0.0  0.0  1.0

Zn As As Cl
Zn As As Cl 0 3 o o + 0 1 - o o 2 3 o o o 