# generated using pymatgen
data_HfCuSiH
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.73079030
_cell_length_b   3.73079030
_cell_length_c   6.66254599
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfCuSiH
_chemical_formula_sum   'Hf2 Cu2 Si2 H2'
_cell_volume   92.73462023
_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
  Hf  Hf0  1  0.50000000  0.00000000  0.64723151  1.0
  Hf  Hf1  1  0.00000000  0.50000000  0.35276849  1.0
  Cu  Cu2  1  0.00000000  0.00000000  0.00000000  1.0
  Cu  Cu3  1  0.50000000  0.50000000  0.00000000  1.0
  Si  Si4  1  0.50000000  0.00000000  0.21729783  1.0
  Si  Si5  1  0.00000000  0.50000000  0.78270217  1.0
  H  H6  1  0.00000000  0.00000000  0.50000000  1.0
  H  H7  1  0.50000000  0.50000000  0.50000000  1.0