# generated using pymatgen
data_Hf(Nb3N4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.26690122
_cell_length_b   5.26689961
_cell_length_c   10.48664408
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00001010
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf(Nb3N4)3
_chemical_formula_sum   'Hf1 Nb9 N12'
_cell_volume   251.92851639
_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  0.33333300  0.66666700  0.50000000  1.0
  Nb  Nb1  1  0.66666700  0.33333300  0.00000000  1.0
  Nb  Nb2  1  0.66666700  0.33333300  0.50000000  1.0
  Nb  Nb3  1  0.33333300  0.66666700  0.00000000  1.0
  Nb  Nb4  1  0.67643134  0.00008491  0.75132054  1.0
  Nb  Nb5  1  0.67643134  0.67634643  0.24867946  1.0
  Nb  Nb6  1  0.99991509  0.32356866  0.24867946  1.0
  Nb  Nb7  1  0.99991509  0.67634643  0.75132054  1.0
  Nb  Nb8  1  0.32365357  0.32356866  0.75132054  1.0
  Nb  Nb9  1  0.32365357  0.00008491  0.24867946  1.0
  N  N10  1  0.34567822  0.34303266  0.37732340  1.0
  N  N11  1  0.65696734  0.00264456  0.37732340  1.0
  N  N12  1  0.99735544  0.65432178  0.37732340  1.0
  N  N13  1  0.00012427  0.34126827  0.87844793  1.0
  N  N14  1  0.65873173  0.99987573  0.12155207  1.0
  N  N15  1  0.65873173  0.65885600  0.87844793  1.0
  N  N16  1  0.34114400  0.99987573  0.87844793  1.0
  N  N17  1  0.65696734  0.65432178  0.62267660  1.0
  N  N18  1  0.99735544  0.34303266  0.62267660  1.0
  N  N19  1  0.00012427  0.65885600  0.12155207  1.0
  N  N20  1  0.34567822  0.00264456  0.62267660  1.0
  N  N21  1  0.34114400  0.34126827  0.12155207  1.0