# generated using pymatgen
data_Hf(Ta2N3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.23303620
_cell_length_b   5.23303689
_cell_length_c   10.45858170
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999566
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf(Ta2N3)2
_chemical_formula_sum   'Hf2 Ta8 N12'
_cell_volume   248.03386415
_cell_formula_units_Z   2
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  0.66666700  0.33333300  0.00000000  1.0
  Hf  Hf1  1  0.33333300  0.66666700  0.00000000  1.0
  Ta  Ta2  1  0.67700022  0.67700022  0.74628202  1.0
  Ta  Ta3  1  0.32299978  0.00000000  0.74628202  1.0
  Ta  Ta4  1  0.00000000  0.32299978  0.74628202  1.0
  Ta  Ta5  1  0.32299978  0.32299978  0.25371798  1.0
  Ta  Ta6  1  0.67700022  0.00000000  0.25371798  1.0
  Ta  Ta7  1  1.00000000  0.67700022  0.25371798  1.0
  Ta  Ta8  1  0.33333300  0.66666700  0.50000000  1.0
  Ta  Ta9  1  0.66666700  0.33333300  0.50000000  1.0
  N  N10  1  0.65802731  0.65802731  0.38212325  1.0
  N  N11  1  0.34197269  0.00000000  0.38212325  1.0
  N  N12  1  1.00000000  0.34197269  0.38212325  1.0
  N  N13  1  0.34197269  0.34197269  0.61787675  1.0
  N  N14  1  0.65802731  0.00000000  0.61787675  1.0
  N  N15  1  0.00000000  0.65802731  0.61787675  1.0
  N  N16  1  0.34525896  0.34525896  0.87244717  1.0
  N  N17  1  0.65474104  0.00000000  0.87244717  1.0
  N  N18  1  0.00000000  0.65474104  0.87244717  1.0
  N  N19  1  0.65474104  0.65474104  0.12755283  1.0
  N  N20  1  0.34525896  0.00000000  0.12755283  1.0
  N  N21  1  1.00000000  0.34525896  0.12755283  1.0