# generated using pymatgen
data_LiAlH16(CN)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.20014905
_cell_length_b   11.20014905
_cell_length_c   11.20014905
_cell_angle_alpha   100.40475462
_cell_angle_beta   100.40475462
_cell_angle_gamma   129.70228264
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiAlH16(CN)4
_chemical_formula_sum   'Li4 Al4 H64 C16 N16'
_cell_volume   978.49080506
_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  0.75783100  0.41031100  0.32750300  1
  Li  Li1  1  0.08280800  0.43032800  0.67249700  1
  Li  Li2  1  0.68032800  0.50783100  0.84752000  1
  Li  Li3  1  0.66031100  0.83280800  0.15248000  1
  Al  Al4  1  0.71681300  0.56613600  0.16902900  1
  Al  Al5  1  0.39710700  0.54778400  0.83097100  1
  Al  Al6  1  0.79778400  0.46681300  0.65067700  1
  Al  Al7  1  0.81613600  0.14710700  0.34932300  1
  H  H8  1  0.64262500  0.29921500  0.05718000  1
  H  H9  1  0.24203500  0.58544500  0.94282000  1
  H  H10  1  0.83544500  0.39262500  0.84341000  1
  H  H11  1  0.54921500  0.99203500  0.15659000  1
  H  H12  1  0.47371500  0.53689200  0.08780900  1
  H  H13  1  0.44908300  0.38590700  0.91219100  1
  H  H14  1  0.63590700  0.22371500  0.43682400  1
  H  H15  1  0.78689200  0.19908300  0.56317600  1
  H  H16  1  0.84772200  0.76991100  0.07121000  1
  H  H17  1  0.69870100  0.77651300  0.92879000  1
  H  H18  1  0.02651300  0.59772200  0.57781100  1
  H  H19  1  0.01991100  0.44870100  0.42218900  1
  H  H20  1  0.81437400  0.67326800  0.40835200  1
  H  H21  1  0.26491600  0.40602200  0.59164800  1
  H  H22  1  0.65602200  0.56437400  0.64110600  1
  H  H23  1  0.92326800  0.01491600  0.35889400  1
  H  H24  1  0.34434000  0.15507100  0.96797300  1
  H  H25  1  0.18709800  0.37636700  0.03202700  1
  H  H26  1  0.62636700  0.09434000  0.68926900  1
  H  H27  1  0.40507100  0.93709800  0.31073100  1
  H  H28  1  0.37347900  0.23384100  0.13301400  1
  H  H29  1  0.10082700  0.24046400  0.86698600  1
  H  H30  1  0.49046400  0.12347900  0.63963700  1
  H  H31  1  0.48384100  0.85082700  0.36036300  1
  H  H32  1  0.38417500  0.08311300  0.08304300  1
  H  H33  1  0.00007000  0.30113200  0.91695700  1
  H  H34  1  0.55113200  0.13417500  0.80106200  1
  H  H35  1  0.33311300  0.75007000  0.19893800  1
  H  H36  1  0.60648700  0.63334000  0.37465200  1
  H  H37  1  0.25868800  0.23183500  0.62534800  1
  H  H38  1  0.48183500  0.35648700  0.47314700  1
  H  H39  1  0.88334000  0.00868800  0.52685300  1
  H  H40  1  0.40262500  0.44218200  0.26176100  1
  H  H41  1  0.18042100  0.14086400  0.73823900  1
  H  H42  1  0.39086400  0.15262500  0.46044300  1
  H  H43  1  0.69218200  0.93042100  0.53955700  1
  H  H44  1  0.45885300  0.63608800  0.29355400  1
  H  H45  1  0.34253400  0.16529900  0.70644600  1
  H  H46  1  0.41529900  0.20885300  0.32276500  1
  H  H47  1  0.88608800  0.09253400  0.67723500  1
  H  H48  1  0.03811600  0.77390900  0.00127500  1
  H  H49  1  0.77263500  0.03684100  0.99872500  1
  H  H50  1  0.28684100  0.78811600  0.76420600  1
  H  H51  1  0.02390900  0.52263500  0.23579400  1
  H  H52  1  0.96897600  0.60234200  0.04561200  1
  H  H53  1  0.55673000  0.92336300  0.95438800  1
  H  H54  1  0.17336300  0.71897600  0.86663300  1
  H  H55  1  0.85234200  0.30673000  0.13336700  1
  H  H56  1  0.08991300  0.80377100  0.16952700  1
  H  H57  1  0.63424400  0.92038600  0.83047300  1
  H  H58  1  0.17038600  0.83991300  0.78614200  1
  H  H59  1  0.05377100  0.38424400  0.21385800  1
  H  H60  1  0.08705900  0.91499900  0.38954500  1
  H  H61  1  0.52545400  0.69751400  0.61045500  1
  H  H62  1  0.94751400  0.83705900  0.67206000  1
  H  H63  1  0.16499900  0.27545400  0.32794000  1
  H  H64  1  0.10703300  0.76895700  0.35988200  1
  H  H65  1  0.40907500  0.74715100  0.64011800  1
  H  H66  1  0.99715100  0.85703300  0.83807600  1
  H  H67  1  0.01895700  0.15907500  0.16192400  1
  H  H68  1  0.09725800  0.83537000  0.51012800  1
  H  H69  1  0.32524200  0.58713000  0.48987200  1
  H  H70  1  0.83713000  0.84725800  0.76188800  1
  H  H71  1  0.08537000  0.07524200  0.23811200  1
  C  C72  1  0.41954600  0.19654900  0.07177300  1
  C  C73  1  0.12477700  0.34777400  0.92822700  1
  C  C74  1  0.59777400  0.16954600  0.72299700  1
  C  C75  1  0.44654900  0.87477700  0.27700300  1
  C  C76  1  0.50639000  0.57589600  0.27914500  1
  C  C77  1  0.29675100  0.22724400  0.72085500  1
  C  C78  1  0.47724400  0.25639000  0.43049300  1
  C  C79  1  0.82589600  0.04675100  0.56950700  1
  C  C80  1  0.98830500  0.71473000  0.07022300  1
  C  C81  1  0.64450700  0.91808200  0.92977700  1
  C  C82  1  0.16808200  0.73830500  0.77357500  1
  C  C83  1  0.96473000  0.39450700  0.22642500  1
  C  C84  1  0.04453400  0.79974500  0.40307600  1
  C  C85  1  0.39666900  0.64145800  0.59692400  1
  C  C86  1  0.89145800  0.79453400  0.74478900  1
  C  C87  1  0.04974500  0.14666900  0.25521100  1
  N  N88  1  0.60227300  0.33632800  0.11509400  1
  N  N89  1  0.22123400  0.48717800  0.88490600  1
  N  N90  1  0.73717800  0.35227300  0.76594400  1
  N  N91  1  0.58632800  0.97123400  0.23405600  1
  N  N92  1  0.57369600  0.60174400  0.17500800  1
  N  N93  1  0.42673600  0.39868800  0.82499200  1
  N  N94  1  0.64868800  0.32369600  0.47195200  1
  N  N95  1  0.85174400  0.17673600  0.52804800  1
  N  N96  1  0.82750500  0.66477600  0.05843400  1
  N  N97  1  0.60634300  0.76907100  0.94156600  1
  N  N98  1  0.01907100  0.57750500  0.66272800  1
  N  N99  1  0.91477600  0.35634300  0.33727200  1
  N  N100  1  0.86148000  0.65500800  0.34501400  1
  N  N101  1  0.30999400  0.51646600  0.65498600  1
  N  N102  1  0.76646600  0.61148000  0.70647200  1
  N  N103  1  0.90500800  0.05999400  0.29352800  1
