# generated using pymatgen
data_Hf18Re5(MoN2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.49768600
_cell_length_b   8.50385799
_cell_length_c   8.38289583
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.97599404
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf18Re5(MoN2)3
_chemical_formula_sum   'Hf18 Re5 Mo3 N6'
_cell_volume   524.74267491
_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  0.45461951  0.90923902  0.25000000  1.0
  Hf  Hf1  1  0.54523371  0.09046643  0.75000000  1.0
  Hf  Hf2  1  0.08991146  0.54543395  0.25000000  1.0
  Hf  Hf3  1  0.90924704  0.45522821  0.75000000  1.0
  Hf  Hf4  1  0.45552149  0.54543395  0.25000000  1.0
  Hf  Hf5  1  0.54598317  0.45522821  0.75000000  1.0
  Hf  Hf6  1  0.20534045  0.41068089  0.55893977  1.0
  Hf  Hf7  1  0.79579278  0.59158556  0.44301444  1.0
  Hf  Hf8  1  0.59117570  0.79559991  0.55737271  1.0
  Hf  Hf9  1  0.79579278  0.59158556  0.05698556  1.0
  Hf  Hf10  1  0.41066032  0.20520940  0.44361993  1.0
  Hf  Hf11  1  0.20534045  0.41068089  0.94106023  1.0
  Hf  Hf12  1  0.20442421  0.79559991  0.55737271  1.0
  Hf  Hf13  1  0.41066032  0.20520940  0.05638007  1.0
  Hf  Hf14  1  0.79454908  0.20520940  0.44361993  1.0
  Hf  Hf15  1  0.59117570  0.79559991  0.94262729  1.0
  Hf  Hf16  1  0.79454908  0.20520940  0.05638007  1.0
  Hf  Hf17  1  0.20442421  0.79559991  0.94262729  1.0
  Re  Re18  1  0.89152840  0.78305580  0.75000000  1.0
  Re  Re19  1  0.77889491  0.88788680  0.25000000  1.0
  Re  Re20  1  0.21797262  0.10893563  0.75000000  1.0
  Re  Re21  1  0.10899189  0.88788680  0.25000000  1.0
  Re  Re22  1  0.89096401  0.10893563  0.75000000  1.0
  Mo  Mo23  1  0.10721295  0.21442589  0.25000000  1.0
  Mo  Mo24  1  0.00025054  0.00050008  0.00186098  1.0
  Mo  Mo25  1  0.00025054  0.00050008  0.49813902  1.0
  N  N26  1  0.49967227  0.99934555  0.99992378  1.0
  N  N27  1  0.99994822  0.50009408  0.99983057  1.0
  N  N28  1  0.49967227  0.99934555  0.50007622  1.0
  N  N29  1  0.50014586  0.50009408  0.99983057  1.0
  N  N30  1  0.99994822  0.50009408  0.50016943  1.0
  N  N31  1  0.50014586  0.50009408  0.50016943  1.0