# generated using pymatgen
data_Al2ZnS4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.71275239
_cell_length_b   3.71275239
_cell_length_c   25.66861700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000695
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al2ZnS4
_chemical_formula_sum   'Al4 Zn2 S8'
_cell_volume   306.42559908
_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
  Al  Al0  1  0.00000000  0.00000000  0.75000200  1.0
  Al  Al1  1  0.00000000  0.00000000  0.24999800  1.0
  Al  Al2  1  0.66666700  0.33333300  0.89359200  1.0
  Al  Al3  1  0.33333300  0.66666700  0.10640800  1.0
  Zn  Zn4  1  0.66666700  0.33333300  0.41334300  1.0
  Zn  Zn5  1  0.33333300  0.66666700  0.58665700  1.0
  S  S6  1  0.66666700  0.33333300  0.29182700  1.0
  S  S7  1  0.33333300  0.66666700  0.70817300  1.0
  S  S8  1  0.66666700  0.33333300  0.56933100  1.0
  S  S9  1  0.33333300  0.66666700  0.43066900  1.0
  S  S10  1  0.66666700  0.33333300  0.80787800  1.0
  S  S11  1  0.33333300  0.66666700  0.19212200  1.0
  S  S12  1  0.66666700  0.33333300  0.06962700  1.0
  S  S13  1  0.33333300  0.66666700  0.93037300  1.0