# generated using pymatgen
data_Li3BN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.61560926
_cell_length_b   4.61560926
_cell_length_c   5.16815895
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3BN2
_chemical_formula_sum   'Li6 B2 N4'
_cell_volume   110.10167706
_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
  Li  Li0  1  0.50000000  0.00000000  0.25000000  1
  Li  Li1  1  0.50000000  0.00000000  0.75000000  1
  Li  Li2  1  0.50000000  0.50000000  0.00000000  1
  Li  Li3  1  -0.00000000  -0.00000000  0.50000000  1
  Li  Li4  1  -0.00000000  0.50000000  0.25000000  1
  Li  Li5  1  -0.00000000  0.50000000  0.75000000  1
  B  B6  1  0.50000000  0.50000000  0.50000000  1
  B  B7  1  -0.00000000  -0.00000000  0.00000000  1
  N  N8  1  0.79505350  0.79505350  -0.00000000  1
  N  N9  1  0.70494650  0.29505350  0.50000000  1
  N  N10  1  0.29505350  0.70494650  0.50000000  1
  N  N11  1  0.20494650  0.20494650  0.00000000  1
