# generated using pymatgen
data_TiPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.57045186
_cell_length_b   2.77508999
_cell_length_c   4.87578130
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiPd
_chemical_formula_sum   'Ti2 Pd2'
_cell_volume   61.84155868
_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
  Ti  Ti0  1  0.25000100  0.00000000  0.20247686  1.0
  Ti  Ti1  1  0.75000000  0.00000000  0.79752114  1.0
  Pd  Pd2  1  0.25000100  0.50000000  0.68660348  1.0
  Pd  Pd3  1  0.75000000  0.50000000  0.31339452  1.0