# generated using pymatgen
data_Er(TiZn2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.45418739
_cell_length_b   5.45418773
_cell_length_c   5.45418736
_cell_angle_alpha   101.31805795
_cell_angle_beta   101.31805297
_cell_angle_gamma   127.40820975
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Er(TiZn2)2
_chemical_formula_sum   'Er1 Ti2 Zn4'
_cell_volume   115.54440981
_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
  Er  Er0  1  0.00000000  0.00000000  0.00000000  1.0
  Ti  Ti1  1  0.25000000  0.75000000  0.50000000  1.0
  Ti  Ti2  1  0.75000000  0.25000000  0.50000000  1.0
  Zn  Zn3  1  0.30759591  0.30759591  0.61519282  1.0
  Zn  Zn4  1  0.69240409  0.69240409  0.38480718  1.0
  Zn  Zn5  1  0.69240409  0.30759591  0.00000000  1.0
  Zn  Zn6  1  0.30759591  0.69240409  1.00000000  1.0