# generated using pymatgen
data_La3TaN3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.97071510
_cell_length_b   5.44728718
_cell_length_c   6.97073005
_cell_angle_alpha   90.00000000
_cell_angle_beta   98.50612948
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La3TaN3
_chemical_formula_sum   'La6 Ta2 N6'
_cell_volume   261.77741876
_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
  La  La0  1  0.89061195  0.25000000  0.10937714  1.0
  La  La1  1  0.40560339  0.25000000  0.17074244  1.0
  La  La2  1  0.17076465  0.74999900  0.40557598  1.0
  La  La3  1  0.82923535  0.25000000  0.59442402  1.0
  La  La4  1  0.59439561  0.74999900  0.82925756  1.0
  La  La5  1  0.10938705  0.74999900  0.89062286  1.0
  Ta  Ta6  1  0.68128456  0.74999900  0.31872469  1.0
  Ta  Ta7  1  0.31871444  0.25000000  0.68127531  1.0
  N  N8  1  0.86979612  0.74999900  0.13020205  1.0
  N  N9  1  0.41580868  0.74999900  0.15318795  1.0
  N  N10  1  0.15321744  0.25000000  0.41579671  1.0
  N  N11  1  0.84678256  0.74999900  0.58420229  1.0
  N  N12  1  0.58419232  0.25000000  0.84681205  1.0
  N  N13  1  0.13020388  0.25000000  0.86979895  1.0