# generated using pymatgen
data_Zn3In
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.00076023
_cell_length_b   7.00076023
_cell_length_c   4.53184000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   136.99592223
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zn3In
_chemical_formula_sum   'Zn6 In2'
_cell_volume   151.48912239
_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
  Zn  Zn0  1  0.88460100  0.11539900  0.75000000  1.0
  Zn  Zn1  1  0.32892100  0.18452200  0.75000000  1.0
  Zn  Zn2  1  0.81547800  0.67107900  0.75000000  1.0
  Zn  Zn3  1  0.11539900  0.88460100  0.25000000  1.0
  Zn  Zn4  1  0.67107900  0.81547800  0.25000000  1.0
  Zn  Zn5  1  0.18452200  0.32892100  0.25000000  1.0
  In  In6  1  0.70532400  0.29467600  0.25000000  1.0
  In  In7  1  0.29467600  0.70532400  0.75000000  1.0