# generated using pymatgen
data_AlH3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   24.01742915
_cell_length_b   23.37457071
_cell_length_c   47.43738978
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   88.34765307
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlH3
_chemical_formula_sum   'Al324 H972'
_cell_volume   26620.1392739
_cell_formula_units_Z   324
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  0.115863  0.801335  0.358566  1
  Al  Al2  1  0.449200  0.467999  0.358565  1
  Al  Al3  1  0.440145  0.796134  0.384940  1
  Al  Al4  1  0.782529  0.134668  0.358566  1
  Al  Al5  1  0.773477  0.462803  0.384937  1
  Al  Al6  1  0.837121  0.809479  0.339996  1
  Al  Al7  1  0.106816  0.129476  0.384917  1
  Al  Al8  1  0.170455  0.476154  0.339994  1
  Al  Al9  1  0.503786  0.142806  0.339999  1
  Al  Al10  1  0.125149  0.690025  0.357093  1
  Al  Al11  1  0.458488  0.356692  0.357092  1
  Al  Al12  1  0.437823  0.685707  0.379453  1
  Al  Al13  1  0.791817  1.023357  0.357093  1
  Al  Al14  1  0.771157  0.352374  0.379453  1
  Al  Al15  1  0.803298  0.705077  0.346500  1
  Al  Al16  1  0.104498  1.019041  0.379457  1
  Al  Al17  1  0.136632  0.371752  0.346493  1
  Al  Al18  1  0.469972  1.038406  0.346501  1
  Al  Al19  1  0.172770  0.972853  0.339006  1
  Al  Al20  1  0.506102  0.639511  0.339009  1
  Al  Al21  1  0.533781  0.961146  0.373147  1
  Al  Al22  1  0.839436  0.306179  0.339010  1
  Al  Al23  1  0.867120  0.627806  0.373149  1
  Al  Al24  1  0.873097  0.969082  0.390017  1
  Al  Al25  1  0.200453  0.294486  0.373149  1
  Al  Al26  1  0.206431  0.635750  0.390017  1
  Al  Al27  1  0.539763  0.302414  0.390016  1
  Al  Al28  1  0.209089  0.751923  0.341045  1
  Al  Al29  1  0.542420  0.418588  0.341046  1
  Al  Al30  1  0.527489  0.740294  0.361506  1
  Al  Al31  1  0.875755  0.085255  0.341045  1
  Al  Al32  1  0.860822  0.406962  0.361506  1
  Al  Al33  1  0.882553  0.738902  0.379954  1
  Al  Al34  1  0.194151  1.073640  0.361504  1
  Al  Al35  1  0.215896  0.405578  0.379955  1
  Al  Al36  1  0.549199  1.072227  0.379949  1
  Al  Al37  1  0.203099  0.866165  0.350386  1
  Al  Al38  1  0.536427  0.532829  0.350387  1
  Al  Al39  1  0.520740  0.853305  0.360510  1
  Al  Al40  1  0.869762  0.199495  0.350386  1
  Al  Al41  1  0.854077  0.519975  0.360512  1
  Al  Al42  1  0.881317  0.852621  0.387071  1
  Al  Al43  1  0.187447  0.186654  0.360524  1
  Al  Al44  1  0.214651  0.519292  0.387071  1
  Al  Al45  1  0.547980  0.185950  0.387070  1
  Al  Al46  1  0.108729  0.907969  0.374850  1
  Al  Al47  1  0.442059  0.574635  0.374849  1
  Al  Al48  1  0.442104  0.908062  0.390928  1
  Al  Al49  1  0.775392  0.241302  0.374849  1
  Al  Al50  1  0.775435  0.574728  0.390929  1
  Al  Al51  1  0.819870  0.915675  0.350643  1
  Al  Al52  1  0.108782  0.241383  0.390933  1
  Al  Al53  1  0.153203  0.582346  0.350642  1
  Al  Al54  1  0.486539  0.249007  0.350644  1
  Al  Al55  1  0.100545  0.790964  0.416039  1
  Al  Al56  1  0.433882  0.457630  0.416037  1
  Al  Al57  1  0.435700  0.786878  0.442775  1
  Al  Al58  1  0.767214  0.124297  0.416038  1
  Al  Al59  1  0.769035  0.453545  0.442772  1
  Al  Al60  1  0.779610  0.793495  0.387633  1
  Al  Al61  1  0.102381  0.120219  0.442750  1
  Al  Al62  1  0.112943  0.460162  0.387635  1
  Al  Al63  1  0.446287  0.126822  0.387633  1
  Al  Al64  1  0.103985  0.677666  0.413045  1
  Al  Al65  1  0.437324  0.344334  0.413044  1
  Al  Al66  1  0.430261  0.675019  0.436409  1
  Al  Al67  1  0.770653  1.011000  0.413045  1
  Al  Al68  1  0.763596  0.341685  0.436409  1
  Al  Al69  1  0.772625  0.684907  0.399896  1
  Al  Al70  1  0.096927  1.008354  0.436412  1
  Al  Al71  1  0.105955  0.351566  0.399890  1
  Al  Al72  1  0.439303  1.018244  0.399891  1
  Al  Al73  1  0.207243  0.964823  0.391347  1
  Al  Al74  1  0.540568  0.631497  0.391352  1
  Al  Al75  1  0.524254  0.952441  0.430514  1
  Al  Al76  1  0.873903  0.298162  0.391352  1
  Al  Al77  1  0.857587  0.619107  0.430516  1
  Al  Al78  1  0.848116  0.952689  0.446531  1
  Al  Al79  1  0.190917  0.285768  0.430515  1
  Al  Al80  1  0.181450  0.619355  0.446531  1
  Al  Al81  1  0.514784  0.286022  0.446531  1
  Al  Al82  1  0.199587  0.748114  0.395586  1
  Al  Al83  1  0.532919  0.414781  0.395584  1
  Al  Al84  1  0.525346  0.727316  0.419333  1
  Al  Al85  1  0.866252  0.081447  0.395586  1
  Al  Al86  1  0.858681  0.393983  0.419332  1
  Al  Al87  1  0.852889  0.731367  0.434998  1
  Al  Al88  1  0.192017  1.060642  0.419326  1
  Al  Al89  1  0.186218  0.398033  0.434996  1
  Al  Al90  1  0.519555  1.064699  0.434995  1
  Al  Al91  1  0.196918  0.858561  0.408112  1
  Al  Al92  1  0.530251  0.525231  0.408110  1
  Al  Al93  1  0.531064  0.840856  0.416257  1
  Al  Al94  1  0.863586  0.191896  0.408110  1
  Al  Al95  1  0.864397  0.507521  0.416257  1
  Al  Al96  1  0.851424  0.841860  0.441902  1
  Al  Al97  1  0.197733  0.174181  0.416261  1
  Al  Al98  1  0.184757  0.508526  0.441903  1
  Al  Al99  1  0.518091  0.175191  0.441902  1
  Al  Al100  1  0.101508  0.896835  0.434190  1
  Al  Al101  1  0.434843  0.563501  0.434191  1
  Al  Al102  1  0.434602  0.896091  0.449870  1
  Al  Al103  1  0.768178  0.230167  0.434191  1
  Al  Al104  1  0.767934  0.562758  0.449871  1
  Al  Al105  1  0.775982  0.899971  0.403682  1
  Al  Al106  1  0.101261  0.229426  0.449874  1
  Al  Al107  1  0.109314  0.566636  0.403682  1
  Al  Al108  1  0.442654  0.233305  0.403683  1
  Al  Al109  1  0.094752  0.779072  0.483350  1
  Al  Al110  1  0.428087  0.445739  0.483348  1
  Al  Al111  1  0.419621  0.769603  0.514434  1
  Al  Al112  1  0.761421  0.112406  0.483348  1
  Al  Al113  1  0.752955  0.436271  0.514434  1
  Al  Al114  1  0.761862  0.784066  0.462263  1
  Al  Al115  1  0.086287  0.102937  0.514436  1
  Al  Al116  1  0.095194  0.450732  0.462262  1
  Al  Al117  1  0.428530  0.117399  0.462263  1
  Al  Al118  1  0.094193  0.668769  0.479969  1
  Al  Al119  1  0.427528  0.335437  0.479968  1
  Al  Al120  1  0.425241  0.660819  0.504656  1
  Al  Al121  1  0.760859  1.002103  0.479968  1
  Al  Al122  1  0.758575  0.327486  0.504655  1
  Al  Al123  1  0.758642  0.672990  0.458512  1
  Al  Al124  1  0.091905  0.994154  0.504653  1
  Al  Al125  1  0.091976  0.339657  0.458509  1
  Al  Al126  1  0.425310  1.006323  0.458512  1
  Al  Al127  1  0.175633  0.949169  0.467644  1
  Al  Al128  1  0.508968  0.615837  0.467646  1
  Al  Al129  1  0.503208  0.942543  0.490828  1
  Al  Al130  1  0.842302  0.282504  0.467646  1
  Al  Al131  1  0.836541  0.609210  0.490828  1
  Al  Al132  1  0.823433  0.935559  0.519119  1
  Al  Al133  1  0.169874  0.275877  0.490827  1
  Al  Al134  1  0.156766  0.602226  0.519120  1
  Al  Al135  1  0.490102  0.268893  0.519118  1
  Al  Al136  1  0.178286  0.730855  0.451692  1
  Al  Al137  1  0.511621  0.397521  0.451691  1
  Al  Al138  1  0.504170  0.724003  0.478276  1
  Al  Al139  1  0.844957  1.064189  0.451692  1
  Al  Al140  1  0.837503  0.390670  0.478275  1
  Al  Al141  1  0.832154  0.719487  0.498305  1
  Al  Al142  1  0.170826  1.057337  0.478271  1
  Al  Al143  1  0.165487  0.386154  0.498305  1
  Al  Al144  1  0.498821  1.052820  0.498306  1
  Al  Al145  1  0.185654  0.839204  0.466542  1
  Al  Al146  1  0.518989  0.505872  0.466540  1
  Al  Al147  1  0.503599  0.832980  0.485435  1
  Al  Al148  1  0.852325  0.172538  0.466540  1
  Al  Al149  1  0.836932  0.499647  0.485434  1
  Al  Al150  1  0.829567  0.828095  0.507038  1
  Al  Al151  1  0.170263  0.166312  0.485431  1
  Al  Al152  1  0.162900  0.494761  0.507038  1
  Al  Al153  1  0.496235  0.161427  0.507039  1
  Al  Al154  1  0.094556  0.884856  0.497692  1
  Al  Al155  1  0.427892  0.551521  0.497693  1
  Al  Al156  1  0.422447  0.878488  0.521858  1
  Al  Al157  1  0.761226  0.218189  0.497692  1
  Al  Al158  1  0.755780  0.545155  0.521858  1
  Al  Al159  1  0.762050  0.893827  0.469668  1
  Al  Al160  1  0.089113  0.211822  0.521855  1
  Al  Al161  1  0.095383  0.560493  0.469667  1
  Al  Al162  1  0.428718  0.227160  0.469670  1
  Al  Al163  1  0.072321  0.745782  0.569755  1
  Al  Al164  1  0.405655  0.412450  0.569753  1
  Al  Al165  1  0.389572  0.751885  0.581504  1
  Al  Al166  1  0.738988  0.079114  0.569753  1
  Al  Al167  1  0.722906  0.418552  0.581504  1
  Al  Al168  1  0.747122  0.762390  0.535731  1
  Al  Al169  1  0.056239  0.085218  0.581502  1
  Al  Al170  1  0.080457  0.429054  0.535729  1
  Al  Al171  1  0.413788  0.095720  0.535730  1
  Al  Al172  1  0.058048  0.648754  0.543308  1
  Al  Al173  1  0.391381  0.315422  0.543308  1
  Al  Al174  1  0.393655  0.638352  0.575608  1
  Al  Al175  1  0.724717  0.982089  0.543308  1
  Al  Al176  1  0.726992  0.305017  0.575605  1
  Al  Al177  1  0.753993  0.654589  0.524413  1
  Al  Al178  1  0.060324  0.971683  0.575602  1
  Al  Al179  1  0.087324  0.321256  0.524412  1
  Al  Al180  1  0.420659  0.987922  0.524413  1
  Al  Al181  1  0.151365  0.926522  0.546307  1
  Al  Al182  1  0.484698  0.593188  0.546309  1
  Al  Al183  1  0.474278  0.924708  0.569156  1
  Al  Al184  1  0.818031  0.259856  0.546309  1
  Al  Al185  1  0.807609  0.591379  0.569156  1
  Al  Al186  1  0.802302  0.930477  0.578750  1
  Al  Al187  1  0.140942  0.258043  0.569155  1
  Al  Al188  1  0.135641  0.597142  0.578754  1
  Al  Al189  1  0.468974  0.263802  0.578751  1
  Al  Al190  1  0.144485  0.711666  0.528230  1
  Al  Al191  1  0.477821  0.378333  0.528228  1
  Al  Al192  1  0.480174  0.702994  0.553735  1
  Al  Al193  1  0.811151  1.045001  0.528230  1
  Al  Al194  1  0.813508  0.369662  0.553735  1
  Al  Al195  1  0.803292  0.700204  0.575816  1
  Al  Al196  1  0.146841  1.036328  0.553733  1
  Al  Al197  1  0.136629  0.366871  0.575815  1
  Al  Al198  1  0.469962  1.033537  0.575816  1
  Al  Al199  1  0.156307  0.819357  0.534092  1
  Al  Al200  1  0.489642  0.486026  0.534094  1
  Al  Al201  1  0.481323  0.813661  0.560955  1
  Al  Al202  1  0.822974  0.152690  0.534093  1
  Al  Al203  1  0.814656  0.480327  0.560955  1
  Al  Al204  1  0.804940  0.813515  0.579521  1
  Al  Al205  1  0.147987  0.146994  0.560953  1
  Al  Al206  1  0.138275  0.480185  0.579522  1
  Al  Al207  1  0.471604  0.146850  0.579524  1
  Al  Al208  1  0.070710  0.858990  0.567601  1
  Al  Al209  1  0.404036  0.525662  0.567598  1
  Al  Al210  1  0.388019  0.864955  0.586578  1
  Al  Al211  1  0.737375  0.192327  0.567600  1
  Al  Al212  1  0.721353  0.531625  0.586578  1
  Al  Al213  1  0.738279  0.871970  0.538863  1
  Al  Al214  1  0.054686  0.198291  0.586578  1
  Al  Al215  1  0.071614  0.538637  0.538864  1
  Al  Al216  1  0.404944  0.205305  0.538864  1
  Al  Al217  1  0.033271  0.737088  0.637147  1
  Al  Al218  1  0.366603  0.403740  0.637141  1
  Al  Al219  1  0.371499  0.738155  0.642540  1
  Al  Al220  1  0.699927  1.070431  0.637133  1
  Al  Al221  1  0.704831  0.404825  0.642539  1
  Al  Al222  1  0.716247  0.750711  0.603825  1
  Al  Al223  1  0.038166  1.071493  0.642538  1
  Al  Al224  1  0.049581  0.417386  0.603829  1
  Al  Al225  1  0.382914  0.084050  0.603828  1
  Al  Al226  1  0.037680  0.646377  0.601932  1
  Al  Al227  1  0.371009  0.313030  0.601931  1
  Al  Al228  1  0.371298  0.625048  0.634907  1
  Al  Al229  1  0.704347  0.979702  0.601930  1
  Al  Al230  1  0.704638  0.291720  0.634907  1
  Al  Al231  1  0.718781  0.637895  0.605008  1
  Al  Al232  1  0.037976  0.958389  0.634905  1
  Al  Al233  1  0.052115  0.304564  0.605009  1
  Al  Al234  1  0.385449  0.971226  0.605011  1
  Al  Al235  1  0.139979  0.910045  0.609151  1
  Al  Al236  1  0.473308  0.576711  0.609153  1
  Al  Al237  1  0.465011  0.910790  0.636642  1
  Al  Al238  1  0.806642  0.243375  0.609152  1
  Al  Al239  1  0.798345  0.577449  0.636640  1
  Al  Al240  1  0.791486  0.914942  0.638477  1
  Al  Al241  1  0.131677  0.244123  0.636641  1
  Al  Al242  1  0.124823  0.581599  0.638481  1
  Al  Al243  1  0.458149  0.248258  0.638480  1
  Al  Al244  1  0.135046  0.688853  0.615435  1
  Al  Al245  1  0.468383  0.355523  0.615429  1
  Al  Al246  1  0.465846  0.688129  0.617154  1
  Al  Al247  1  0.801713  1.022186  0.615430  1
  Al  Al248  1  0.799183  0.354799  0.617153  1
  Al  Al249  1  0.794938  0.690150  0.641099  1
  Al  Al250  1  0.132517  1.021464  0.617151  1
  Al  Al251  1  0.128268  0.356811  0.641098  1
  Al  Al252  1  0.461603  1.023471  0.641098  1
  Al  Al253  1  0.139638  0.798037  0.606745  1
  Al  Al254  1  0.472976  0.464699  0.606743  1
  Al  Al255  1  0.462670  0.801833  0.620248  1
  Al  Al256  1  0.806304  0.131378  0.606742  1
  Al  Al257  1  0.796005  0.468506  0.620248  1
  Al  Al258  1  0.794722  0.802844  0.639405  1
  Al  Al259  1  0.129338  0.135170  0.620247  1
  Al  Al260  1  0.128056  0.469518  0.639401  1
  Al  Al261  1  0.461383  0.136195  0.639403  1
  Al  Al262  1  0.040555  0.846693  0.623470  1
  Al  Al263  1  0.373894  0.513354  0.623468  1
  Al  Al264  1  0.367254  0.852106  0.645067  1
  Al  Al265  1  0.707226  0.180015  0.623470  1
  Al  Al266  1  0.700588  0.518772  0.645066  1
  Al  Al267  1  0.712547  0.865742  0.603345  1
  Al  Al268  1  0.033923  0.185440  0.645067  1
  Al  Al269  1  0.045889  0.532405  0.603349  1
  Al  Al270  1  0.379221  0.199061  0.603350  1
  Al  Al271  1  0.042691  0.721970  0.694018  1
  Al  Al272  1  0.376018  0.388652  0.694008  1
  Al  Al273  1  0.367374  0.720617  0.698224  1
  Al  Al274  1  0.709364  1.055302  0.694031  1
  Al  Al275  1  0.700704  0.387288  0.698223  1
  Al  Al276  1  0.695558  0.740467  0.660679  1
  Al  Al277  1  0.034040  1.053949  0.698221  1
  Al  Al278  1  0.028902  0.407147  0.660677  1
  Al  Al279  1  0.362233  1.073812  0.660680  1
  Al  Al280  1  0.019160  0.633817  0.660732  1
  Al  Al281  1  0.352492  0.300490  0.660729  1
  Al  Al282  1  0.364908  0.608151  0.690833  1
  Al  Al283  1  0.685819  0.967126  0.660731  1
  Al  Al284  1  0.698242  0.274807  0.690829  1
  Al  Al285  1  0.695715  0.625598  0.663400  1
  Al  Al286  1  0.031582  0.941481  0.690829  1
  Al  Al287  1  0.029049  0.292262  0.663398  1
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  Al  Al289  1  0.118940  0.891334  0.664929  1
  Al  Al290  1  0.452265  0.558006  0.664928  1
  Al  Al291  1  0.441612  0.901663  0.691129  1
  Al  Al292  1  0.785598  0.224675  0.664929  1
  Al  Al293  1  0.774938  0.568333  0.691129  1
  Al  Al294  1  0.755347  0.911616  0.694273  1
  Al  Al295  1  0.108272  0.234996  0.691126  1
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  Al  Al297  1  0.422021  0.244983  0.694267  1
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  Al  Al299  1  0.463445  0.336351  0.672802  1
  Al  Al300  1  0.453753  0.670551  0.674496  1
  Al  Al301  1  0.796808  1.003025  0.672805  1
  Al  Al302  1  0.787091  0.337216  0.674496  1
  Al  Al303  1  0.764441  0.683308  0.695944  1
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  H  H330  1  0.776885  0.665128  0.305612  1
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