# generated using pymatgen
data_LiBH5N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.19423700
_cell_length_b   7.13921200
_cell_length_c   14.03337100
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiBH5N
_chemical_formula_sum   'Li8 B8 H40 N8'
_cell_volume   520.39611645
_cell_formula_units_Z   8
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  0.06419800  0.45130000  0.17728300  1
  Li  Li1  1  0.93580200  0.95130000  0.32271700  1
  Li  Li2  1  0.43580200  0.54870000  0.67728300  1
  Li  Li3  1  0.56419800  0.04870000  0.82271700  1
  Li  Li4  1  0.93580200  0.54870000  0.82271700  1
  Li  Li5  1  0.06419800  0.04870000  0.67728300  1
  Li  Li6  1  0.56419800  0.45130000  0.32271700  1
  Li  Li7  1  0.43580200  0.95130000  0.17728300  1
  B  B8  1  0.53315600  0.59488300  0.15387100  1
  B  B9  1  0.46684400  0.09488300  0.34612900  1
  B  B10  1  0.96684400  0.40511700  0.65387100  1
  B  B11  1  0.03315600  0.90511700  0.84612900  1
  B  B12  1  0.46684400  0.40511700  0.84612900  1
  B  B13  1  0.53315600  0.90511700  0.65387100  1
  B  B14  1  0.03315600  0.59488300  0.34612900  1
  B  B15  1  0.96684400  0.09488300  0.15387100  1
  H  H16  1  0.35468400  0.67749400  0.11198900  1
  H  H17  1  0.64531600  0.17749400  0.38801100  1
  H  H18  1  0.14531600  0.32250600  0.61198900  1
  H  H19  1  0.85468400  0.82250600  0.88801100  1
  H  H20  1  0.64531600  0.32250600  0.88801100  1
  H  H21  1  0.35468400  0.82250600  0.61198900  1
  H  H22  1  0.85468400  0.67749400  0.38801100  1
  H  H23  1  0.14531600  0.17749400  0.11198900  1
  H  H24  1  0.58459400  0.68559900  0.22628900  1
  H  H25  1  0.41540600  0.18559900  0.27371100  1
  H  H26  1  0.91540600  0.31440100  0.72628900  1
  H  H27  1  0.08459400  0.81440100  0.77371100  1
  H  H28  1  0.41540600  0.31440100  0.77371100  1
  H  H29  1  0.58459400  0.81440100  0.72628900  1
  H  H30  1  0.08459400  0.68559900  0.27371100  1
  H  H31  1  0.91540600  0.18559900  0.22628900  1
  H  H32  1  0.44696000  0.44110200  0.18029300  1
  H  H33  1  0.55304000  0.94110200  0.31970700  1
  H  H34  1  0.05304000  0.55889800  0.68029300  1
  H  H35  1  0.94696000  0.05889800  0.81970700  1
  H  H36  1  0.55304000  0.55889800  0.81970700  1
  H  H37  1  0.44696000  0.05889800  0.68029300  1
  H  H38  1  0.94696000  0.44110200  0.31970700  1
  H  H39  1  0.05304000  0.94110200  0.18029300  1
  H  H40  1  0.85892700  0.68836800  0.07444700  1
  H  H41  1  0.14107300  0.18836800  0.42555300  1
  H  H42  1  0.64107300  0.31163200  0.57444700  1
  H  H43  1  0.35892700  0.81163200  0.92555300  1
  H  H44  1  0.14107300  0.31163200  0.92555300  1
  H  H45  1  0.85892700  0.81163200  0.57444700  1
  H  H46  1  0.35892700  0.68836800  0.42555300  1
  H  H47  1  0.64107300  0.18836800  0.07444700  1
  H  H48  1  0.74756100  0.49359300  0.03230100  1
  H  H49  1  0.25243900  0.99359300  0.46769900  1
  H  H50  1  0.75243900  0.50640700  0.53230100  1
  H  H51  1  0.24756100  0.00640700  0.96769900  1
  H  H52  1  0.25243900  0.50640700  0.96769900  1
  H  H53  1  0.74756100  0.00640700  0.53230100  1
  H  H54  1  0.24756100  0.49359300  0.46769900  1
  H  H55  1  0.75243900  0.99359300  0.03230100  1
  N  N56  1  0.78196300  0.56322300  0.09479000  1
  N  N57  1  0.21803700  0.06322300  0.40521000  1
  N  N58  1  0.71803700  0.43677700  0.59479000  1
  N  N59  1  0.28196300  0.93677700  0.90521000  1
  N  N60  1  0.21803700  0.43677700  0.90521000  1
  N  N61  1  0.78196300  0.93677700  0.59479000  1
  N  N62  1  0.28196300  0.56322300  0.40521000  1
  N  N63  1  0.71803700  0.06322300  0.09479000  1
