# generated using pymatgen
data_TaNb5N3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.32630982
_cell_length_b   5.32630718
_cell_length_c   4.99489418
_cell_angle_alpha   89.86202637
_cell_angle_beta   89.86198925
_cell_angle_gamma   119.87327004
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaNb5N3
_chemical_formula_sum   'Ta1 Nb5 N3'
_cell_volume   122.87335703
_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
  Ta  Ta0  1  0.33437383  0.33437583  0.75268411  1.0
  Nb  Nb1  1  0.33402562  0.99893272  0.24837208  1.0
  Nb  Nb2  1  0.66533773  0.66533673  0.24290783  1.0
  Nb  Nb3  1  0.99893372  0.33402462  0.24837308  1.0
  Nb  Nb4  1  0.99975770  0.66552898  0.75269984  1.0
  Nb  Nb5  1  0.66552698  0.99975870  0.75270284  1.0
  N  N6  1  0.00439740  0.00439740  0.99808184  1.0
  N  N7  1  0.66296475  0.33467827  0.50208968  1.0
  N  N8  1  0.33468027  0.66296575  0.50208968  1.0