# generated using pymatgen
data_LiB3H18N5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.13557200
_cell_length_b   7.63062700
_cell_length_c   10.83696150
_cell_angle_alpha   84.42122343
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiB3H18N5
_chemical_formula_sum   'Li4 B12 H72 N20'
_cell_volume   998.77134646
_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
  Li  Li0  1  0.25127000  0.48117200  0.80211000  1
  Li  Li1  1  0.74873000  0.51882800  0.19789000  1
  Li  Li2  1  0.75127000  0.51882800  0.69789000  1
  Li  Li3  1  0.24873000  0.48117200  0.30211000  1
  B  B4  1  0.39969000  0.01145900  0.48725800  1
  B  B5  1  0.99554200  0.90699100  0.91367600  1
  B  B6  1  0.00445800  0.09300900  0.08632400  1
  B  B7  1  0.48788400  0.86846400  0.57303400  1
  B  B8  1  0.49554200  0.09300900  0.58632400  1
  B  B9  1  0.98788400  0.13153600  0.92696600  1
  B  B10  1  0.50445800  0.90699100  0.41367600  1
  B  B11  1  0.10031000  0.01145900  0.98725800  1
  B  B12  1  0.51211600  0.13153600  0.42696600  1
  B  B13  1  0.01211600  0.86846400  0.07303400  1
  B  B14  1  0.60031000  0.98854100  0.51274200  1
  B  B15  1  0.89969000  0.98854100  0.01274200  1
  H  H16  1  0.30050200  0.02554200  0.47541000  1
  H  H17  1  0.94566900  0.64593600  0.58823900  1
  H  H18  1  0.53085500  0.04223100  0.03977500  1
  H  H19  1  0.69949800  0.97445800  0.52459000  1
  H  H20  1  0.11122200  0.38495400  0.97467300  1
  H  H21  1  0.04981900  0.56898500  0.37578000  1
  H  H22  1  0.32071000  0.79981100  0.26233400  1
  H  H23  1  0.84017200  0.27442600  0.37206000  1
  H  H24  1  0.34017200  0.72557400  0.12794000  1
  H  H25  1  0.72468400  0.80957200  0.32152700  1
  H  H26  1  0.82071000  0.20018900  0.23766600  1
  H  H27  1  0.22468400  0.19042800  0.17847300  1
  H  H28  1  0.15982800  0.72557400  0.62794000  1
  H  H29  1  0.71730900  0.20683700  0.33664200  1
  H  H30  1  0.45982000  0.43292700  0.76666000  1
  H  H31  1  0.17929000  0.79981100  0.76233400  1
  H  H32  1  0.61458100  0.39747400  0.53624100  1
  H  H33  1  0.55433100  0.64593600  0.08823900  1
  H  H34  1  0.15083500  0.26006600  0.64256900  1
  H  H35  1  0.67929000  0.20018900  0.73766600  1
  H  H36  1  0.29262600  0.48797600  0.54520000  1
  H  H37  1  0.00986200  0.18360400  0.17204600  1
  H  H38  1  0.32417300  0.17542200  0.28357700  1
  H  H39  1  0.95982000  0.56707300  0.73334000  1
  H  H40  1  0.88877800  0.61504600  0.02532700  1
  H  H41  1  0.67582700  0.82457800  0.71642300  1
  H  H42  1  0.11458100  0.60252600  0.96375900  1
  H  H43  1  0.19949800  0.02554200  0.97541000  1
  H  H44  1  0.96914500  0.04223100  0.53977500  1
  H  H45  1  0.38541900  0.60252600  0.46375900  1
  H  H46  1  0.03085500  0.95776900  0.46022500  1
  H  H47  1  0.79262600  0.51202400  0.95480000  1
  H  H48  1  0.52328100  0.26070500  0.35433400  1
  H  H49  1  0.95246300  0.09463100  0.67854500  1
  H  H50  1  0.65982800  0.27442600  0.87206000  1
  H  H51  1  0.54753700  0.09463100  0.17854500  1
  H  H52  1  0.45246300  0.90536900  0.82145500  1
  H  H53  1  0.84894800  0.09660100  0.58028200  1
  H  H54  1  0.28269100  0.79316300  0.66335800  1
  H  H55  1  0.54018000  0.56707300  0.23334000  1
  H  H56  1  0.80050200  0.97445800  0.02459000  1
  H  H57  1  0.78269100  0.20683700  0.83664200  1
  H  H58  1  0.77531600  0.80957200  0.82152700  1
  H  H59  1  0.65083500  0.73993400  0.85743100  1
  H  H60  1  0.38877800  0.38495400  0.47467300  1
  H  H61  1  0.84916500  0.73993400  0.35743100  1
  H  H62  1  0.88541900  0.39747400  0.03624100  1
  H  H63  1  0.02328100  0.73929500  0.14566600  1
  H  H64  1  0.15105200  0.90339900  0.41971800  1
  H  H65  1  0.47671900  0.73929500  0.64566600  1
  H  H66  1  0.54981900  0.43101500  0.12422000  1
  H  H67  1  0.21730900  0.79316300  0.16335800  1
  H  H68  1  0.65105200  0.09660100  0.08028200  1
  H  H69  1  0.99013800  0.81639600  0.82795400  1
  H  H70  1  0.27531600  0.19042800  0.67847300  1
  H  H71  1  0.50986200  0.81639600  0.32795400  1
  H  H72  1  0.20737400  0.48797600  0.04520000  1
  H  H73  1  0.34894800  0.90339900  0.91971800  1
  H  H74  1  0.49013800  0.18360400  0.67204600  1
  H  H75  1  0.46914500  0.95776900  0.96022500  1
  H  H76  1  0.34916500  0.26006600  0.14256900  1
  H  H77  1  0.17582700  0.17542200  0.78357700  1
  H  H78  1  0.61122200  0.61504600  0.52532700  1
  H  H79  1  0.04753700  0.90536900  0.32145500  1
  H  H80  1  0.44566900  0.35406400  0.91176100  1
  H  H81  1  0.04018000  0.43292700  0.26666000  1
  H  H82  1  0.82417300  0.82457800  0.21642300  1
  H  H83  1  0.70737400  0.51202400  0.45480000  1
  H  H84  1  0.95018100  0.43101500  0.62422000  1
  H  H85  1  0.05433100  0.35406400  0.41176100  1
  H  H86  1  0.45018100  0.56898500  0.87578000  1
  H  H87  1  0.97671900  0.26070500  0.85433400  1
  N  N88  1  0.33706600  0.49208300  0.46472500  1
  N  N89  1  0.43041100  0.86871500  0.91178300  1
  N  N90  1  0.42049400  0.45331900  0.84775800  1
  N  N91  1  0.93041100  0.13128500  0.58821700  1
  N  N92  1  0.57950600  0.54668100  0.15224200  1
  N  N93  1  0.06958900  0.86871500  0.41178300  1
  N  N94  1  0.78499500  0.27471500  0.30063800  1
  N  N95  1  0.16293400  0.49208300  0.96472500  1
  N  N96  1  0.83706600  0.50791700  0.03527500  1
  N  N97  1  0.66293400  0.50791700  0.53527500  1
  N  N98  1  0.71500500  0.27471500  0.80063800  1
  N  N99  1  0.28499500  0.72528500  0.19936200  1
  N  N100  1  0.21500500  0.72528500  0.69936200  1
  N  N101  1  0.70899200  0.74459800  0.78894000  1
  N  N102  1  0.20899200  0.25540200  0.71106000  1
  N  N103  1  0.56958900  0.13128500  0.08821700  1
  N  N104  1  0.07950600  0.45331900  0.34775800  1
  N  N105  1  0.79100800  0.74459800  0.28894000  1
  N  N106  1  0.92049400  0.54668100  0.65224200  1
  N  N107  1  0.29100800  0.25540200  0.21106000  1
