# generated using pymatgen
data_HfTh2HgPd12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.79381798
_cell_length_b   5.79381820
_cell_length_c   9.47403879
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999317
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfTh2HgPd12
_chemical_formula_sum   'Hf1 Th2 Hg1 Pd12'
_cell_volume   275.42003625
_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
  Hf  Hf0  1  0.66666700  0.33333300  0.75000000  1.0
  Th  Th1  1  0.00000000  0.00000000  0.49659740  1.0
  Th  Th2  1  0.00000000  0.00000000  0.00340260  1.0
  Hg  Hg3  1  0.33333300  0.66666700  0.25000000  1.0
  Pd  Pd4  1  0.50293447  0.49706553  0.50647424  1.0
  Pd  Pd5  1  0.50293447  0.00586994  0.50647424  1.0
  Pd  Pd6  1  0.99413006  0.49706553  0.50647424  1.0
  Pd  Pd7  1  0.50293447  0.49706553  0.99352576  1.0
  Pd  Pd8  1  0.50293447  0.00586994  0.99352576  1.0
  Pd  Pd9  1  0.99413006  0.49706553  0.99352576  1.0
  Pd  Pd10  1  0.82539321  0.65078642  0.25000000  1.0
  Pd  Pd11  1  0.34921358  0.17460679  0.25000000  1.0
  Pd  Pd12  1  0.82539321  0.17460679  0.25000000  1.0
  Pd  Pd13  1  0.17268385  0.34536770  0.75000000  1.0
  Pd  Pd14  1  0.65463230  0.82731615  0.75000000  1.0
  Pd  Pd15  1  0.17268385  0.82731615  0.75000000  1.0