# generated using pymatgen
data_BN
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.59146400
_cell_length_b   4.29204900
_cell_length_c   4.88008900
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BN
_chemical_formula_sum   'B4 N4'
_cell_volume   54.27971941
_cell_formula_units_Z   4
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  0.75000000  0.09290400  0.65958700  1.0
  B  B1  1  0.25000000  0.59290400  0.84041300  1.0
  B  B2  1  0.75000000  0.40709600  0.15958700  1.0
  B  B3  1  0.25000000  0.90709600  0.34041300  1.0
  N  N4  1  0.75000000  0.39351400  0.82113000  1.0
  N  N5  1  0.25000000  0.60648600  0.17887000  1.0
  N  N6  1  0.25000000  0.89351400  0.67887000  1.0
  N  N7  1  0.75000000  0.10648600  0.32113000  1.0