# generated using pymatgen
data_HfZr3N2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.38594739
_cell_length_b   5.38594739
_cell_length_c   3.29315418
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   89.26238129
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfZr3N2
_chemical_formula_sum   'Hf1 Zr3 N2'
_cell_volume   95.52131393
_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  0.79693930  0.20306070  0.50000000  1.0
  Zr  Zr1  1  0.29568936  0.29565796  0.00000000  1.0
  Zr  Zr2  1  0.70434204  0.70431064  0.00000000  1.0
  Zr  Zr3  1  0.20492703  0.79507297  0.50000000  1.0
  N  N4  1  0.99427117  0.00572883  0.00000000  1.0
  N  N5  1  0.50383110  0.49616890  0.50000000  1.0