# generated using pymatgen
data_AlH3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   18.34338337
_cell_length_b   26.27657412
_cell_length_c   51.80422313
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   74.22652530
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlH3
_chemical_formula_sum   'Al288 H864'
_cell_volume   24029.440986
_cell_formula_units_Z   288
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
  Al  Al1  1  0.668257  0.730771  0.299587  1
  Al  Al2  1  0.180626  0.755240  0.300007  1
  Al  Al3  1  0.668256  0.397437  0.299587  1
  Al  Al4  1  0.180624  0.421908  0.300007  1
  Al  Al5  1  0.668259  0.064104  0.299585  1
  Al  Al6  1  0.180627  0.088573  0.300007  1
  Al  Al7  1  0.700609  0.625425  0.296854  1
  Al  Al8  1  0.137992  0.629223  0.306411  1
  Al  Al9  1  0.700605  0.292091  0.296854  1
  Al  Al10  1  0.137992  0.295889  0.306412  1
  Al  Al11  1  0.700602  0.958758  0.296853  1
  Al  Al12  1  0.137991  0.962555  0.306412  1
  Al  Al13  1  0.772598  0.875000  0.329998  1
  Al  Al14  1  0.270578  0.897624  0.314151  1
  Al  Al15  1  0.772599  0.541670  0.330000  1
  Al  Al16  1  0.270579  0.564292  0.314150  1
  Al  Al17  1  0.772599  0.208334  0.329999  1
  Al  Al18  1  0.270579  0.230959  0.314152  1
  Al  Al19  1  0.806856  0.672832  0.298252  1
  Al  Al20  1  0.259707  0.662850  0.316168  1
  Al  Al21  1  0.806855  0.339495  0.298251  1
  Al  Al22  1  0.259704  0.329518  0.316168  1
  Al  Al23  1  0.806855  1.006158  0.298252  1
  Al  Al24  1  0.259706  0.996183  0.316168  1
  Al  Al25  1  0.779987  0.775045  0.310518  1
  Al  Al26  1  0.287864  0.799036  0.308220  1
  Al  Al27  1  0.779988  0.441708  0.310518  1
  Al  Al28  1  0.287864  0.465704  0.308219  1
  Al  Al29  1  0.779988  0.108374  0.310518  1
  Al  Al30  1  0.287864  0.132371  0.308221  1
  Al  Al31  1  0.693575  0.862633  0.290505  1
  Al  Al32  1  0.147947  0.862063  0.304657  1
  Al  Al33  1  0.693587  0.529300  0.290505  1
  Al  Al34  1  0.147948  0.528731  0.304655  1
  Al  Al35  1  0.693584  0.195966  0.290505  1
  Al  Al36  1  0.147949  0.195397  0.304656  1
  Al  Al37  1  0.612945  0.691832  0.341878  1
  Al  Al38  1  0.112820  0.710709  0.336280  1
  Al  Al39  1  0.612943  0.358500  0.341879  1
  Al  Al40  1  0.112817  0.377378  0.336280  1
  Al  Al41  1  0.612945  1.025166  0.341876  1
  Al  Al42  1  0.112820  1.044043  0.336281  1
  Al  Al43  1  0.615924  0.589499  0.332004  1
  Al  Al44  1  0.095991  0.577231  0.352797  1
  Al  Al45  1  0.615923  0.256163  0.332005  1
  Al  Al46  1  0.095991  0.243896  0.352797  1
  Al  Al47  1  0.615922  0.922831  0.332006  1
  Al  Al48  1  0.095990  0.910562  0.352798  1
  Al  Al49  1  0.703161  0.841337  0.369478  1
  Al  Al50  1  0.237597  0.844997  0.355114  1
  Al  Al51  1  0.703162  0.508003  0.369477  1
  Al  Al52  1  0.237597  0.511666  0.355114  1
  Al  Al53  1  0.703161  0.174668  0.369477  1
  Al  Al54  1  0.237597  0.178330  0.355115  1
  Al  Al55  1  0.765435  0.642136  0.342584  1
  Al  Al56  1  0.215282  0.621401  0.361127  1
  Al  Al57  1  0.765433  0.308801  0.342584  1
  Al  Al58  1  0.215280  0.288068  0.361127  1
  Al  Al59  1  0.765431  0.975466  0.342583  1
  Al  Al60  1  0.215280  0.954734  0.361128  1
  Al  Al61  1  0.729573  0.742396  0.355077  1
  Al  Al62  1  0.259216  0.740857  0.346918  1
  Al  Al63  1  0.729574  0.409062  0.355076  1
  Al  Al64  1  0.259213  0.407526  0.346918  1
  Al  Al65  1  0.729574  0.075727  0.355076  1
  Al  Al66  1  0.259216  0.074190  0.346918  1
  Al  Al67  1  0.624904  0.819807  0.324450  1
  Al  Al68  1  0.103117  0.809984  0.343943  1
  Al  Al69  1  0.624907  0.486476  0.324448  1
  Al  Al70  1  0.103116  0.476653  0.343942  1
  Al  Al71  1  0.624908  0.153140  0.324449  1
  Al  Al72  1  0.103118  0.143318  0.343942  1
  Al  Al73  1  0.539688  0.648033  0.406520  1
  Al  Al74  1  0.062631  0.670363  0.376894  1
  Al  Al75  1  0.539687  0.314699  0.406521  1
  Al  Al76  1  0.062630  0.337029  0.376893  1
  Al  Al77  1  0.539688  0.981366  0.406520  1
  Al  Al78  1  0.062631  1.003695  0.376894  1
  Al  Al79  1  0.560727  0.558269  0.381556  1
  Al  Al80  1  0.004447  0.535601  0.413659  1
  Al  Al81  1  0.560728  0.224933  0.381557  1
  Al  Al82  1  0.004446  0.202268  0.413659  1
  Al  Al83  1  0.560728  0.891599  0.381557  1
  Al  Al84  1  0.004446  0.868934  0.413659  1
  Al  Al85  1  0.587248  0.807508  0.417516  1
  Al  Al86  1  0.146887  0.825631  0.393844  1
  Al  Al87  1  0.587246  0.474175  0.417516  1
  Al  Al88  1  0.146888  0.492297  0.393843  1
  Al  Al89  1  0.587245  0.140841  0.417515  1
  Al  Al90  1  0.146887  0.158964  0.393844  1
  Al  Al91  1  0.674855  0.611909  0.378452  1
  Al  Al92  1  0.107605  0.590835  0.410782  1
  Al  Al93  1  0.674853  0.278575  0.378452  1
  Al  Al94  1  0.107603  0.257502  0.410782  1
  Al  Al95  1  0.674853  0.945243  0.378453  1
  Al  Al96  1  0.107604  0.924168  0.410782  1
  Al  Al97  1  0.632315  0.709636  0.398611  1
  Al  Al98  1  0.178845  0.719079  0.386087  1
  Al  Al99  1  0.632310  0.376304  0.398609  1
  Al  Al100  1  0.178844  0.385744  0.386086  1
  Al  Al101  1  0.632313  1.042970  0.398610  1
  Al  Al102  1  0.178845  1.052411  0.386087  1
  Al  Al103  1  0.575445  0.789381  0.367511  1
  Al  Al104  1  0.034031  0.773313  0.394756  1
  Al  Al105  1  0.575453  0.456056  0.367511  1
  Al  Al106  1  0.034031  0.439981  0.394755  1
  Al  Al107  1  0.575448  0.122716  0.367510  1
  Al  Al108  1  0.034033  0.106646  0.394756  1
  Al  Al109  1  0.408705  0.600353  0.462699  1
  Al  Al110  1  -0.030663  0.629969  0.433993  1
  Al  Al111  1  0.408704  0.267020  0.462699  1
  Al  Al112  1  -0.030665  0.296637  0.433992  1
  Al  Al113  1  0.408705  0.933686  0.462699  1
  Al  Al114  1  -0.030665  0.963303  0.433992  1
  Al  Al115  1  0.451839  0.504017  0.444866  1
  Al  Al116  1  0.890287  0.489082  0.468068  1
  Al  Al117  1  0.451838  0.170683  0.444865  1
  Al  Al118  1  0.890286  0.155748  0.468069  1
  Al  Al119  1  0.451839  0.837350  0.444866  1
  Al  Al120  1  0.890287  0.822415  0.468069  1
  Al  Al121  1  0.473195  0.755816  0.477991  1
  Al  Al122  1  0.032952  0.785141  0.447179  1
  Al  Al123  1  0.473195  0.422482  0.477991  1
  Al  Al124  1  0.032952  0.451808  0.447178  1
  Al  Al125  1  0.473193  0.089150  0.477990  1
  Al  Al126  1  0.032951  0.118475  0.447178  1
  Al  Al127  1  0.543807  0.566389  0.438242  1
  Al  Al128  1  -0.009849  0.546817  0.466461  1
  Al  Al129  1  0.543807  0.233055  0.438243  1
  Al  Al130  1  -0.009850  0.213485  0.466461  1
  Al  Al131  1  0.543807  0.899722  0.438243  1
  Al  Al132  1  -0.009849  0.880151  0.466461  1
  Al  Al133  1  0.509098  0.660477  0.458171  1
  Al  Al134  1  0.074176  0.688679  0.428260  1
  Al  Al135  1  0.509098  0.327143  0.458171  1
  Al  Al136  1  0.074175  0.355347  0.428259  1
  Al  Al137  1  0.509097  0.993811  0.458170  1
  Al  Al138  1  0.074175  1.022013  0.428260  1
  Al  Al139  1  0.497428  0.743164  0.426195  1
  Al  Al140  1  0.934831  0.726326  0.451361  1
  Al  Al141  1  0.497429  0.409831  0.426195  1
  Al  Al142  1  0.934830  0.392993  0.451361  1
  Al  Al143  1  0.497426  0.076498  0.426194  1
  Al  Al144  1  0.934829  0.059659  0.451361  1
  Al  Al145  1  0.294536  0.556348  0.518141  1
  Al  Al146  1  0.849332  0.587031  0.485290  1
  Al  Al147  1  0.294536  0.223015  0.518141  1
  Al  Al148  1  0.849332  0.253698  0.485290  1
  Al  Al149  1  0.294536  0.889681  0.518141  1
  Al  Al150  1  0.849331  0.920364  0.485290  1
  Al  Al151  1  0.331980  0.463916  0.495713  1
  Al  Al152  1  0.769905  0.443726  0.525511  1
  Al  Al153  1  0.331980  0.130582  0.495713  1
  Al  Al154  1  0.769905  0.110394  0.525511  1
  Al  Al155  1  0.331981  0.797249  0.495713  1
  Al  Al156  1  0.769905  0.777060  0.525511  1
  Al  Al157  1  0.345785  0.714384  0.528695  1
  Al  Al158  1  0.907356  0.740857  0.502695  1
  Al  Al159  1  0.345785  0.381051  0.528695  1
  Al  Al160  1  0.907356  0.407524  0.502695  1
  Al  Al161  1  0.345784  1.047718  0.528695  1
  Al  Al162  1  0.907355  0.074191  0.502695  1
  Al  Al163  1  0.434259  0.519219  0.496459  1
  Al  Al164  1  0.866246  0.505012  0.518578  1
  Al  Al165  1  0.434258  0.185886  0.496459  1
  Al  Al166  1  0.866245  0.171679  0.518578  1
  Al  Al167  1  0.434259  0.852553  0.496459  1
  Al  Al168  1  0.866246  0.838346  0.518578  1
  Al  Al169  1  0.389794  0.617616  0.512820  1
  Al  Al170  1  0.948770  0.644602  0.484961  1
  Al  Al171  1  0.389793  0.284283  0.512819  1
  Al  Al172  1  0.948769  0.311269  0.484960  1
  Al  Al173  1  0.389794  0.950949  0.512820  1
  Al  Al174  1  0.948768  0.977936  0.484960  1
  Al  Al175  1  0.372136  0.699681  0.478104  1
  Al  Al176  1  0.808506  0.682403  0.505561  1
  Al  Al177  1  0.372136  0.366348  0.478104  1
  Al  Al178  1  0.808507  0.349069  0.505560  1
  Al  Al179  1  0.372135  1.033014  0.478104  1
  Al  Al180  1  0.808504  1.015736  0.505561  1
  Al  Al181  1  0.163745  0.517503  0.569573  1
  Al  Al182  1  0.733843  0.536923  0.547052  1
  Al  Al183  1  0.163744  0.184170  0.569573  1
  Al  Al184  1  0.733842  0.203590  0.547052  1
  Al  Al185  1  0.163745  0.850837  0.569573  1
  Al  Al186  1  0.733843  0.870256  0.547052  1
  Al  Al187  1  0.203423  0.413532  0.553615  1
  Al  Al188  1  0.654678  0.403747  0.574062  1
  Al  Al189  1  0.203423  0.080199  0.553615  1
  Al  Al190  1  0.654678  0.070414  0.574061  1
  Al  Al191  1  0.203423  0.746865  0.553616  1
  Al  Al192  1  0.654678  0.737080  0.574061  1
  Al  Al193  1  0.258539  0.664513  0.592667  1
  Al  Al194  1  0.797025  0.693543  0.558013  1
  Al  Al195  1  0.258538  0.331179  0.592667  1
  Al  Al196  1  0.797025  0.360210  0.558012  1
  Al  Al197  1  0.258538  0.997846  0.592667  1
  Al  Al198  1  0.797024  1.026876  0.558012  1
  Al  Al199  1  0.302833  0.473260  0.549367  1
  Al  Al200  1  0.761793  0.456111  0.579823  1
  Al  Al201  1  0.302832  0.139927  0.549367  1
  Al  Al202  1  0.761792  0.122778  0.579823  1
  Al  Al203  1  0.302833  0.806593  0.549367  1
  Al  Al204  1  0.761793  0.789444  0.579823  1
  Al  Al205  1  0.283960  0.564148  0.573450  1
  Al  Al206  1  0.829141  0.599647  0.537311  1
  Al  Al207  1  0.283960  0.230815  0.573450  1
  Al  Al208  1  0.829140  0.266314  0.537310  1
  Al  Al209  1  0.283960  0.897481  0.573451  1
  Al  Al210  1  0.829140  0.932980  0.537311  1
  Al  Al211  1  0.257853  0.648058  0.540421  1
  Al  Al212  1  0.695642  0.633535  0.563636  1
  Al  Al213  1  0.257852  0.314725  0.540421  1
  Al  Al214  1  0.695642  0.300202  0.563636  1
  Al  Al215  1  0.257853  0.981391  0.540421  1
  Al  Al216  1  0.695641  0.966869  0.563636  1
  Al  Al217  1  0.080632  0.489145  0.609600  1
  Al  Al218  1  0.615288  0.504486  0.596992  1
  Al  Al219  1  0.080632  0.155811  0.609600  1
  Al  Al220  1  0.615288  0.171153  0.596992  1
  Al  Al221  1  0.080632  0.822478  0.609600  1
  Al  Al222  1  0.615288  0.837820  0.596992  1
  Al  Al223  1  0.112024  0.390413  0.592251  1
  Al  Al224  1  0.573170  0.383019  0.612496  1
  Al  Al225  1  0.112024  0.057080  0.592251  1
  Al  Al226  1  0.573171  1.049686  0.612496  1
  Al  Al227  1  0.112025  0.723746  0.592251  1
  Al  Al228  1  0.573171  0.716353  0.612496  1
  Al  Al229  1  0.193022  0.634441  0.636219  1
  Al  Al230  1  0.719921  0.651737  0.614105  1
  Al  Al231  1  0.193022  0.301108  0.636219  1
  Al  Al232  1  0.719920  0.318404  0.614105  1
  Al  Al233  1  0.193022  0.967775  0.636219  1
  Al  Al234  1  0.719921  0.985070  0.614105  1
  Al  Al235  1  0.238496  0.437144  0.602917  1
  Al  Al236  1  0.716359  0.416827  0.623606  1
  Al  Al237  1  0.238496  0.103811  0.602917  1
  Al  Al238  1  0.716359  0.083494  0.623606  1
  Al  Al239  1  0.238496  0.770478  0.602917  1
  Al  Al240  1  0.716359  0.750161  0.623606  1
  Al  Al241  1  0.213459  0.536287  0.620014  1
  Al  Al242  1  0.729446  0.551980  0.603714  1
  Al  Al243  1  0.213459  0.202954  0.620013  1
  Al  Al244  1  0.729446  0.218647  0.603714  1
  Al  Al245  1  0.213459  0.869620  0.620015  1
  Al  Al246  1  0.729446  0.885313  0.603714  1
  Al  Al247  1  0.139226  0.620700  0.582477  1
  Al  Al248  1  0.584215  0.608633  0.610585  1
  Al  Al249  1  0.139225  0.287366  0.582477  1
  Al  Al250  1  0.584215  0.275300  0.610585  1
  Al  Al251  1  0.139226  0.954033  0.582477  1
  Al  Al252  1  0.584215  0.941966  0.610585  1
  Al  Al253  1  0.032321  0.455328  0.655528  1
  Al  Al254  1  0.568048  0.471770  0.640910  1
  Al  Al255  1  0.032321  0.121995  0.655528  1
  Al  Al256  1  0.568048  0.138437  0.640910  1
  Al  Al257  1  0.032321  0.788661  0.655528  1
  Al  Al258  1  0.568048  0.805103  0.640910  1
  Al  Al259  1  0.046450  0.363542  0.633910  1
  Al  Al260  1  0.530365  0.333823  0.652334  1
  Al  Al261  1  0.046450  1.030208  0.633910  1
  Al  Al262  1  0.530365  1.000490  0.652334  1
  Al  Al263  1  0.046451  0.696875  0.633910  1
  Al  Al264  1  0.530366  0.667157  0.652334  1
  Al  Al265  1  0.085251  0.620817  0.667066  1
  Al  Al266  1  0.673719  0.608451  0.656788  1
  Al  Al267  1  0.085251  0.287484  0.667066  1
  Al  Al268  1  0.673718  0.275118  0.656788  1
  Al  Al269  1  0.085250  0.954151  0.667066  1
  Al  Al270  1  0.673718  0.941785  0.656788  1
  Al  Al271  1  0.169671  0.405269  0.642461  1
  Al  Al272  1  0.638288  0.379298  0.659422  1
  Al  Al273  1  0.169671  0.071936  0.642461  1
  Al  Al274  1  0.638288  1.045965  0.659422  1
  Al  Al275  1  0.169671  0.738602  0.642461  1
  Al  Al276  1  0.638288  0.712631  0.659422  1
  Al  Al277  1  0.117248  0.518584  0.655981  1
  Al  Al278  1  0.693523  0.506363  0.648076  1
  Al  Al279  1  0.117248  0.185251  0.655981  1
  Al  Al280  1  0.693523  0.173030  0.648076  1
  Al  Al281  1  0.117246  0.851918  0.655981  1
  Al  Al282  1  0.693523  0.839697  0.648076  1
  Al  Al283  1  0.059166  0.593648  0.620247  1
  Al  Al284  1  0.558149  0.566396  0.656893  1
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  H  H1149  1  0.205931  1.012964  0.675078  1
  H  H1150  1  0.602975  0.995491  0.690779  1
  H  H1151  1  0.205932  0.679630  0.675078  1
  H  H1152  1  0.602975  0.662158  0.690779  1
