# generated using pymatgen
data_B9N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.86556961
_cell_length_b   10.86556961
_cell_length_c   10.86556961
_cell_angle_alpha   99.37479409
_cell_angle_beta   99.37479409
_cell_angle_gamma   132.39330888
_symmetry_Int_Tables_number   1
_chemical_formula_structural   B9N
_chemical_formula_sum   'B9 N1'
_cell_volume   866.79980059
_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
  B  B0  1  0.00000000  0.55744100  0.55744100  1.0
  B  B1  1  0.00000000  0.44255900  0.44255900  1.0
  B  B2  1  0.44255900  0.00000000  0.44255900  1.0
  B  B3  1  0.55744100  0.00000000  0.55744100  1.0
  B  B4  1  0.65822600  0.15822600  0.50000000  1.0
  B  B5  1  0.34177400  0.84177400  0.50000000  1.0
  B  B6  1  0.84177400  0.34177400  0.50000000  1.0
  B  B7  1  0.15822600  0.65822600  0.50000000  1.0
  B  B8  1  0.00000000  0.00000000  0.00000000  1.0
  N  N9  1  0.50000000  0.50000000  0.00000000  1.0