# generated using pymatgen
data_HfFeP3Ru4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.79138847
_cell_length_b   10.42836206
_cell_length_c   12.13560958
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfFeP3Ru4
_chemical_formula_sum   'Hf4 Fe4 P12 Ru16'
_cell_volume   479.81738743
_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  0.25000000  0.58188558  0.70846094  1.0
  Hf  Hf1  1  0.25000000  0.91811442  0.20846094  1.0
  Hf  Hf2  1  0.75000000  0.41811442  0.29153906  1.0
  Hf  Hf3  1  0.75000000  0.08188558  0.79153906  1.0
  Fe  Fe4  1  0.25000000  0.46213761  0.93564484  1.0
  Fe  Fe5  1  0.25000000  0.03786239  0.43564484  1.0
  Fe  Fe6  1  0.75000000  0.53786239  0.06435516  1.0
  Fe  Fe7  1  0.75000000  0.96213761  0.56435516  1.0
  P  P8  1  0.25000000  0.42838882  0.10912960  1.0
  P  P9  1  0.25000000  0.07161118  0.60912960  1.0
  P  P10  1  0.75000000  0.57161118  0.89087040  1.0
  P  P11  1  0.75000000  0.92838882  0.39087040  1.0
  P  P12  1  0.25000000  0.26819906  0.86558920  1.0
  P  P13  1  0.25000000  0.23180094  0.36558920  1.0
  P  P14  1  0.75000000  0.73180094  0.13441080  1.0
  P  P15  1  0.75000000  0.76819906  0.63441080  1.0
  P  P16  1  0.25000000  0.60017148  0.39197600  1.0
  P  P17  1  0.25000000  0.89982852  0.89197600  1.0
  P  P18  1  0.75000000  0.39982852  0.60802400  1.0
  P  P19  1  0.75000000  0.10017148  0.10802400  1.0
  Ru  Ru20  1  0.25000000  0.70589235  0.98933006  1.0
  Ru  Ru21  1  0.25000000  0.79410765  0.48933006  1.0
  Ru  Ru22  1  0.75000000  0.29410765  0.01066994  1.0
  Ru  Ru23  1  0.75000000  0.20589235  0.51066994  1.0
  Ru  Ru24  1  0.25000000  0.40465523  0.48039117  1.0
  Ru  Ru25  1  0.25000000  0.09534477  0.98039117  1.0
  Ru  Ru26  1  0.75000000  0.59534477  0.51960883  1.0
  Ru  Ru27  1  0.75000000  0.90465523  0.01960883  1.0
  Ru  Ru28  1  0.25000000  0.23290147  0.17584523  1.0
  Ru  Ru29  1  0.25000000  0.26709853  0.67584523  1.0
  Ru  Ru30  1  0.75000000  0.76709853  0.82415477  1.0
  Ru  Ru31  1  0.75000000  0.73290147  0.32415477  1.0
  Ru  Ru32  1  0.25000000  0.88763164  0.70379025  1.0
  Ru  Ru33  1  0.25000000  0.61236836  0.20379025  1.0
  Ru  Ru34  1  0.75000000  0.11236836  0.29620975  1.0
  Ru  Ru35  1  0.75000000  0.38763164  0.79620975  1.0