# generated using pymatgen
data_Hf3As
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.38173945
_cell_length_b   8.15512727
_cell_length_c   15.32365072
_cell_angle_alpha   90.27933836
_cell_angle_beta   90.00000000
_cell_angle_gamma   109.26637317
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf3As
_chemical_formula_sum   'Hf24 As8'
_cell_volume   634.86217185
_cell_formula_units_Z   8
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  0.95543348  0.83403199  0.80799881  1.0
  Hf  Hf1  1  0.53871387  0.11579313  0.83329809  1.0
  Hf  Hf2  1  0.12140249  0.16596801  0.69200119  1.0
  Hf  Hf3  1  0.57707926  0.11579313  0.33329809  1.0
  Hf  Hf4  1  0.52808805  0.47842749  0.90520473  1.0
  Hf  Hf5  1  0.42292074  0.88420687  0.66670191  1.0
  Hf  Hf6  1  0.12109530  0.68971000  0.98937993  1.0
  Hf  Hf7  1  0.29672672  0.09878365  0.01660598  1.0
  Hf  Hf8  1  0.87890470  0.31029000  0.01062007  1.0
  Hf  Hf9  1  0.43138631  0.31029000  0.51062007  1.0
  Hf  Hf10  1  0.47191195  0.52157251  0.09479527  1.0
  Hf  Hf11  1  0.56861369  0.68971000  0.48937993  1.0
  Hf  Hf12  1  0.47031707  0.46757144  0.30141769  1.0
  Hf  Hf13  1  0.52968293  0.53242856  0.69858231  1.0
  Hf  Hf14  1  0.70327328  0.90121635  0.98339402  1.0
  Hf  Hf15  1  0.04966156  0.52157251  0.59479527  1.0
  Hf  Hf16  1  0.87859751  0.83403199  0.30799881  1.0
  Hf  Hf17  1  0.80205693  0.09878365  0.51660598  1.0
  Hf  Hf18  1  0.19794307  0.90121635  0.48339402  1.0
  Hf  Hf19  1  0.04456652  0.16596801  0.19200119  1.0
  Hf  Hf20  1  0.00274563  0.53242856  0.19858231  1.0
  Hf  Hf21  1  0.46128613  0.88420687  0.16670191  1.0
  Hf  Hf22  1  0.99725437  0.46757144  0.80141769  1.0
  Hf  Hf23  1  0.95033844  0.47842749  0.40520473  1.0
  As  As24  1  0.57912529  0.24425527  0.16750079  1.0
  As  As25  1  0.06217795  0.16811917  0.87174152  1.0
  As  As26  1  0.93782205  0.83188083  0.12825848  1.0
  As  As27  1  0.42087471  0.75574473  0.83249921  1.0
  As  As28  1  0.33486902  0.75574473  0.33249921  1.0
  As  As29  1  0.66513098  0.24425527  0.66750079  1.0
  As  As30  1  0.10594222  0.16811917  0.37174152  1.0
  As  As31  1  0.89405778  0.83188083  0.62825848  1.0