# generated using pymatgen
data_Hf3NbRe2N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.65440053
_cell_length_b   8.65439981
_cell_length_c   8.65439920
_cell_angle_alpha   59.99999856
_cell_angle_beta   60.00000132
_cell_angle_gamma   60.00000029
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf3NbRe2N
_chemical_formula_sum   'Hf12 Nb4 Re8 N4'
_cell_volume   458.34856028
_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  0.81390368  0.81390368  0.18609632  1.0
  Hf  Hf1  1  0.18609632  0.18609632  0.81390368  1.0
  Hf  Hf2  1  0.81390368  0.18609632  0.81390368  1.0
  Hf  Hf3  1  0.18609632  0.81390368  0.18609632  1.0
  Hf  Hf4  1  0.18609632  0.81390368  0.81390368  1.0
  Hf  Hf5  1  0.81390368  0.18609632  0.18609632  1.0
  Hf  Hf6  1  0.43609632  0.43609632  0.06390368  1.0
  Hf  Hf7  1  0.06390368  0.06390368  0.43609632  1.0
  Hf  Hf8  1  0.43609632  0.06390368  0.43609632  1.0
  Hf  Hf9  1  0.06390368  0.43609632  0.06390368  1.0
  Hf  Hf10  1  0.06390368  0.43609632  0.43609632  1.0
  Hf  Hf11  1  0.43609632  0.06390368  0.06390368  1.0
  Nb  Nb12  1  0.12500000  0.62500000  0.62500000  1.0
  Nb  Nb13  1  0.62500000  0.12500000  0.62500000  1.0
  Nb  Nb14  1  0.62500000  0.62500000  0.12500000  1.0
  Nb  Nb15  1  0.62500000  0.62500000  0.62500000  1.0
  Re  Re16  1  0.74780145  0.41739985  0.41739985  1.0
  Re  Re17  1  0.41739985  0.74780145  0.41739985  1.0
  Re  Re18  1  0.41739985  0.41739985  0.74780145  1.0
  Re  Re19  1  0.41739985  0.41739985  0.41739985  1.0
  Re  Re20  1  0.50219855  0.83260015  0.83260015  1.0
  Re  Re21  1  0.83260015  0.50219855  0.83260015  1.0
  Re  Re22  1  0.83260015  0.83260015  0.50219855  1.0
  Re  Re23  1  0.83260015  0.83260015  0.83260015  1.0
  N  N24  1  0.62500000  0.12500000  0.12500000  1.0
  N  N25  1  0.12500000  0.62500000  0.12500000  1.0
  N  N26  1  0.12500000  0.12500000  0.62500000  1.0
  N  N27  1  0.12500000  0.12500000  0.12500000  1.0