# generated using pymatgen
data_HfPaCrB6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.55053635
_cell_length_b   8.92457969
_cell_length_c   11.28544787
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfPaCrB6
_chemical_formula_sum   'Hf4 Pa4 Cr4 B24'
_cell_volume   357.60249031
_cell_formula_units_Z   4
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  0.00000000  0.44398469  0.12842478  1.0
  Hf  Hf1  1  0.00000000  0.55601531  0.87157522  1.0
  Hf  Hf2  1  0.00000000  0.94398469  0.37157522  1.0
  Hf  Hf3  1  0.00000000  0.05601531  0.62842478  1.0
  Pa  Pa4  1  0.00000000  0.82300939  0.08555042  1.0
  Pa  Pa5  1  0.00000000  0.17699061  0.91444958  1.0
  Pa  Pa6  1  0.00000000  0.32300939  0.41444958  1.0
  Pa  Pa7  1  0.00000000  0.67699061  0.58555042  1.0
  Cr  Cr8  1  0.00000000  0.14138351  0.18193722  1.0
  Cr  Cr9  1  0.00000000  0.85861649  0.81806278  1.0
  Cr  Cr10  1  0.00000000  0.64138351  0.31806278  1.0
  Cr  Cr11  1  0.00000000  0.35861649  0.68193722  1.0
  B  B12  1  0.50000000  0.05516773  0.06819887  1.0
  B  B13  1  0.50000000  0.94483227  0.93180113  1.0
  B  B14  1  0.50000000  0.55516773  0.43180113  1.0
  B  B15  1  0.50000000  0.44483227  0.56819887  1.0
  B  B16  1  0.50000000  0.25190312  0.08291802  1.0
  B  B17  1  0.50000000  0.74809688  0.91708198  1.0
  B  B18  1  0.50000000  0.75190312  0.41708198  1.0
  B  B19  1  0.50000000  0.24809688  0.58291802  1.0
  B  B20  1  0.50000000  0.29437881  0.23531189  1.0
  B  B21  1  0.50000000  0.70562119  0.76468811  1.0
  B  B22  1  0.50000000  0.79437881  0.26468811  1.0
  B  B23  1  0.50000000  0.20562119  0.73531189  1.0
  B  B24  1  0.50000000  0.13029492  0.31597855  1.0
  B  B25  1  0.50000000  0.86970508  0.68402145  1.0
  B  B26  1  0.50000000  0.63029492  0.18402145  1.0
  B  B27  1  0.50000000  0.36970508  0.81597855  1.0
  B  B28  1  0.50000000  0.48325088  0.28613406  1.0
  B  B29  1  0.50000000  0.51674912  0.71386594  1.0
  B  B30  1  0.50000000  0.98325088  0.21386594  1.0
  B  B31  1  0.50000000  0.01674912  0.78613406  1.0
  B  B32  1  0.50000000  0.10077667  0.47291198  1.0
  B  B33  1  0.50000000  0.89922333  0.52708802  1.0
  B  B34  1  0.50000000  0.60077667  0.02708802  1.0
  B  B35  1  0.50000000  0.39922333  0.97291198  1.0