# generated using pymatgen
data_TiZn2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.02647857
_cell_length_b   5.02647822
_cell_length_c   8.11843830
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000225
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiZn2
_chemical_formula_sum   'Ti4 Zn8'
_cell_volume   177.63590646
_cell_formula_units_Z   4
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
  Ti  Ti0  1  0.33333300  0.66666700  0.06542920  1.0
  Ti  Ti1  1  0.66666700  0.33333300  0.56540404  1.0
  Ti  Ti2  1  0.66666700  0.33333300  0.93457080  1.0
  Ti  Ti3  1  0.33333300  0.66666700  0.43459596  1.0
  Zn  Zn4  1  -0.00000000  -0.00000000  -0.00000000  1.0
  Zn  Zn5  1  -0.00000000  -0.00000000  0.50000000  1.0
  Zn  Zn6  1  0.82867753  0.65735406  0.24964945  1.0
  Zn  Zn7  1  0.17132247  0.82867753  0.75035055  1.0
  Zn  Zn8  1  0.65735406  0.82867753  0.75035055  1.0
  Zn  Zn9  1  0.34264594  0.17132247  0.24964945  1.0
  Zn  Zn10  1  0.82867753  0.17132247  0.24964945  1.0
  Zn  Zn11  1  0.17132247  0.34264594  0.75035055  1.0