# generated using pymatgen
data_BN
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.55393920
_cell_length_b   2.55393920
_cell_length_c   4.22685500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99997937
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BN
_chemical_formula_sum   'B2 N2'
_cell_volume   23.87641843
_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
  B  B0  1  0.33333300  0.66666700  0.49972400  1.0
  B  B1  1  0.66666700  0.33333300  0.99972400  1.0
  N  N2  1  0.33333300  0.66666700  0.12527600  1.0
  N  N3  1  0.66666700  0.33333300  0.62527600  1.0