# generated using pymatgen
data_Hf18Nb3Re5N6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.55439712
_cell_length_b   8.56944613
_cell_length_c   8.39217651
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.94114289
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf18Nb3Re5N6
_chemical_formula_sum   'Hf18 Nb3 Re5 N6'
_cell_volume   533.09507413
_cell_formula_units_Z   1
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  0.45421041  0.90842373  0.25000000  1.0
  Hf  Hf1  1  0.54500670  0.08999082  0.75000000  1.0
  Hf  Hf2  1  0.09008934  0.54585803  0.25000000  1.0
  Hf  Hf3  1  0.90904081  0.45567135  0.75000000  1.0
  Hf  Hf4  1  0.45575075  0.54584753  0.25000000  1.0
  Hf  Hf5  1  0.54663959  0.45566831  0.75000000  1.0
  Hf  Hf6  1  0.20744604  0.41488313  0.56221830  1.0
  Hf  Hf7  1  0.79531952  0.59064250  0.44264036  1.0
  Hf  Hf8  1  0.58961857  0.79472319  0.55739500  1.0
  Hf  Hf9  1  0.79531952  0.59064250  0.05735964  1.0
  Hf  Hf10  1  0.41476195  0.20741147  0.44376354  1.0
  Hf  Hf11  1  0.20744604  0.41488313  0.93778170  1.0
  Hf  Hf12  1  0.20512025  0.79471720  0.55740129  1.0
  Hf  Hf13  1  0.41476195  0.20741147  0.05623646  1.0
  Hf  Hf14  1  0.79264071  0.20741897  0.44375973  1.0
  Hf  Hf15  1  0.58961857  0.79472319  0.94260500  1.0
  Hf  Hf16  1  0.79264071  0.20741897  0.05624027  1.0
  Hf  Hf17  1  0.20512025  0.79471720  0.94259871  1.0
  Nb  Nb18  1  0.10731812  0.21463963  0.25000000  1.0
  Nb  Nb19  1  0.99920193  0.99840625  0.99747058  1.0
  Nb  Nb20  1  0.99920193  0.99840625  0.50252942  1.0
  Re  Re21  1  0.88916444  0.77832378  0.75000000  1.0
  Re  Re22  1  0.77469574  0.88368482  0.25000000  1.0
  Re  Re23  1  0.22285328  0.11163833  0.75000000  1.0
  Re  Re24  1  0.10898341  0.88369204  0.25000000  1.0
  Re  Re25  1  0.88879047  0.11164921  0.75000000  1.0
  N  N26  1  0.49934256  0.99869559  0.99950931  1.0
  N  N27  1  0.99946836  0.50027995  0.99925470  1.0
  N  N28  1  0.49934256  0.99869559  0.50049069  1.0
  N  N29  1  0.50081109  0.50027797  0.99925248  1.0
  N  N30  1  0.99946836  0.50027995  0.50074530  1.0
  N  N31  1  0.50081109  0.50027797  0.50074752  1.0