# generated using pymatgen
data_HfCrSi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.45723900
_cell_length_b   6.73006900
_cell_length_c   7.85571300
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfCrSi
_chemical_formula_sum   'Hf4 Cr4 Si4'
_cell_volume   182.78246458
_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  0.75000000  0.45852500  0.17022000  1.0
  Hf  Hf1  1  0.75000000  0.95852500  0.32978000  1.0
  Hf  Hf2  1  0.25000000  0.54147500  0.82978000  1.0
  Hf  Hf3  1  0.25000000  0.04147500  0.67022000  1.0
  Cr  Cr4  1  0.75000000  0.37368800  0.56150100  1.0
  Cr  Cr5  1  0.75000000  0.87368700  0.93849900  1.0
  Cr  Cr6  1  0.25000000  0.62631300  0.43849900  1.0
  Cr  Cr7  1  0.25000000  0.12631200  0.06150100  1.0
  Si  Si8  1  0.75000000  0.23880300  0.86834100  1.0
  Si  Si9  1  0.75000000  0.73880300  0.63165900  1.0
  Si  Si10  1  0.25000000  0.76119700  0.13165900  1.0
  Si  Si11  1  0.25000000  0.26119700  0.36834100  1.0