# generated using pymatgen
data_Zn2In2S5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.92201235
_cell_length_b   3.92201235
_cell_length_c   15.79556578
_cell_angle_alpha   82.86838436
_cell_angle_beta   82.86838436
_cell_angle_gamma   59.99999413
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zn2In2S5
_chemical_formula_sum   'Zn2 In2 S5'
_cell_volume   208.24505605
_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  0.68819600  0.68819600  0.93541200  1.0
  Zn  Zn1  1  0.51713300  0.51713300  0.44860100  1.0
  In  In2  1  0.10390400  0.10390400  0.68828800  1.0
  In  In3  1  0.92226500  0.92226500  0.23320500  1.0
  S  S4  1  0.00824000  0.00824000  0.97528000  1.0
  S  S5  1  0.46922600  0.46922600  0.59232200  1.0
  S  S6  1  0.61117400  0.61117400  0.16647800  1.0
  S  S7  1  0.74298400  0.74298400  0.77104800  1.0
  S  S8  1  0.86887800  0.86887800  0.39336600  1.0