# generated using pymatgen
data_La3Ni2B2N3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.31581579
_cell_length_b   10.31581579
_cell_length_c   10.31581579
_cell_angle_alpha   158.95865097
_cell_angle_beta   158.95865097
_cell_angle_gamma   29.92913957
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La3Ni2B2N3
_chemical_formula_sum   'La3 Ni2 B2 N3'
_cell_volume   141.43009249
_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
  La  La0  1  0.63036700  0.63036700  0.00000000  1.0
  La  La1  1  0.36963300  0.36963300  0.00000000  1.0
  La  La2  1  0.00000000  0.00000000  0.00000000  1.0
  Ni  Ni3  1  0.75000000  0.25000000  0.50000000  1.0
  Ni  Ni4  1  0.25000000  0.75000000  0.50000000  1.0
  B  B5  1  0.80012300  0.80012300  0.00000000  1.0
  B  B6  1  0.19987700  0.19987700  0.00000000  1.0
  N  N7  1  0.87272600  0.87272600  0.00000000  1.0
  N  N8  1  0.50000000  0.50000000  0.00000000  1.0
  N  N9  1  0.12727400  0.12727400  0.00000000  1.0