# generated using pymatgen
data_Al144H431
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.57200402
_cell_length_b   44.26294737
_cell_length_c   24.11685172
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al144H431
_chemical_formula_sum   'Al144 H431'
_cell_volume   5948.01922093
_cell_formula_units_Z   1
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  0.352507  -0.137453  0.195168  1
  Al  Al2  1  0.341870  -0.141267  0.530844  1
  Al  Al3  1  0.341018  -0.141685  0.864125  1
  Al  Al4  1  0.337260  0.111148  0.197217  1
  Al  Al5  1  0.335890  0.110976  0.530383  1
  Al  Al6  1  0.334843  0.110696  0.863775  1
  Al  Al7  1  0.335448  0.362440  0.197075  1
  Al  Al8  1  0.335403  0.362582  0.530400  1
  Al  Al9  1  0.336107  0.362444  0.863738  1
  Al  Al10  1  0.332501  0.610739  0.195446  1
  Al  Al11  1  0.323570  0.613643  0.529001  1
  Al  Al12  1  0.330132  0.614275  0.862367  1
  Al  Al13  1  0.853189  -0.138320  0.195939  1
  Al  Al14  1  0.842010  -0.141329  0.530846  1
  Al  Al15  1  0.840605  -0.141717  0.864171  1
  Al  Al16  1  0.837930  0.111105  0.197350  1
  Al  Al17  1  0.835134  0.110971  0.530292  1
  Al  Al18  1  0.834876  0.110770  0.863794  1
  Al  Al19  1  0.834718  0.362478  0.197098  1
  Al  Al20  1  0.836689  0.362574  0.530395  1
  Al  Al21  1  0.835945  0.362438  0.863761  1
  Al  Al22  1  0.830481  0.610910  0.195335  1
  Al  Al23  1  0.824383  0.613645  0.529048  1
  Al  Al24  1  0.830468  0.614273  0.862356  1
  Al  Al25  1  0.350873  -0.139753  0.085102  1
  Al  Al26  1  0.344922  -0.141981  0.419292  1
  Al  Al27  1  0.342083  -0.141842  0.752978  1
  Al  Al28  1  0.338421  0.111192  0.085760  1
  Al  Al29  1  0.338374  0.111288  0.419113  1
  Al  Al30  1  0.336417  0.110921  0.752417  1
  Al  Al31  1  0.336458  0.362657  0.085783  1
  Al  Al32  1  0.336534  0.362713  0.419020  1
  Al  Al33  1  0.337988  0.362630  0.752358  1
  Al  Al34  1  0.332985  0.612833  0.083998  1
  Al  Al35  1  0.319505  0.613150  0.417699  1
  Al  Al36  1  0.332322  0.614136  0.750824  1
  Al  Al37  1  0.851785  -0.139708  0.085614  1
  Al  Al38  1  0.845337  -0.141955  0.419118  1
  Al  Al39  1  0.841145  -0.141866  0.752977  1
  Al  Al40  1  0.838853  0.111267  0.085958  1
  Al  Al41  1  0.837679  0.111208  0.419021  1
  Al  Al42  1  0.837000  0.110996  0.752349  1
  Al  Al43  1  0.836637  0.362685  0.085713  1
  Al  Al44  1  0.837345  0.362740  0.419074  1
  Al  Al45  1  0.838161  0.362637  0.752318  1
  Al  Al46  1  0.832134  0.612771  0.083885  1
  Al  Al47  1  0.821945  0.613370  0.417746  1
  Al  Al48  1  0.832175  0.614118  0.750844  1
  Al  Al49  1  0.603422  -0.091521  0.365285  1
  Al  Al50  1  0.596346  -0.092827  0.697957  1
  Al  Al51  1  0.602848  -0.091177  1.029876  1
  Al  Al52  1  0.594784  0.160138  0.363885  1
  Al  Al53  1  0.593085  0.159700  0.697574  1
  Al  Al54  1  0.594659  0.159968  1.030599  1
  Al  Al55  1  0.591991  0.411549  0.363664  1
  Al  Al56  1  0.594729  0.411402  0.696977  1
  Al  Al57  1  0.591427  0.411364  1.030832  1
  Al  Al58  1  0.546148  0.661397  0.362439  1
  Al  Al59  1  0.589599  0.662810  0.695841  1
  Al  Al60  1  0.587161  0.662298  1.030204  1
  Al  Al61  1  1.102195  -0.091280  0.364873  1
  Al  Al62  1  1.095890  -0.092934  0.697426  1
  Al  Al63  1  1.102126  -0.091229  1.030335  1
  Al  Al64  1  1.094084  0.159975  0.364043  1
  Al  Al65  1  1.093873  0.159838  0.697278  1
  Al  Al66  1  1.094414  0.159925  1.030751  1
  Al  Al67  1  1.091460  0.411389  0.364058  1
  Al  Al68  1  1.095029  0.411494  0.697399  1
  Al  Al69  1  1.092168  0.411520  1.030352  1
  Al  Al70  1  1.043272  0.662649  0.360906  1
  Al  Al71  1  1.090256  0.662981  0.695095  1
  Al  Al72  1  1.087619  0.662262  1.029781  1
  Al  Al73  1  0.601704  -0.089738  0.140276  1
  Al  Al74  1  0.592726  -0.092628  0.475579  1
  Al  Al75  1  0.591064  -0.092533  0.808596  1
  Al  Al76  1  0.587581  0.160177  0.141537  1
  Al  Al77  1  0.586009  0.160039  0.474731  1
  Al  Al78  1  0.585477  0.159915  0.808237  1
  Al  Al79  1  0.586163  0.411749  0.141835  1
  Al  Al80  1  0.586021  0.411475  0.474326  1
  Al  Al81  1  0.586852  0.411336  0.807790  1
  Al  Al82  1  0.580109  0.660906  0.141153  1
  Al  Al83  1  0.576611  0.662283  0.473085  1
  Al  Al84  1  0.582285  0.662821  0.806920  1
  Al  Al85  1  1.100721  -0.089382  0.141151  1
  Al  Al86  1  1.092661  -0.092905  0.474850  1
  Al  Al87  1  1.091168  -0.092944  0.807855  1
  Al  Al88  1  1.087750  0.160073  0.141520  1
  Al  Al89  1  1.085996  0.160279  0.474788  1
  Al  Al90  1  1.085500  0.159718  0.808207  1
  Al  Al91  1  1.086095  0.411374  0.141059  1
  Al  Al92  1  1.086185  0.411821  0.475109  1
  Al  Al93  1  1.086665  0.411610  0.808302  1
  Al  Al94  1  1.080459  0.661001  0.140428  1
  Al  Al95  1  1.077022  0.662423  0.471904  1
  Al  Al96  1  1.082165  0.662822  0.806579  1
  Al  Al97  1  0.602503  -0.089519  0.252197  1
  Al  Al98  1  0.589074  -0.092507  0.586659  1
  Al  Al99  1  0.588994  -0.092154  0.919025  1
  Al  Al100  1  0.586643  0.159870  0.252543  1
  Al  Al101  1  0.583291  0.159534  0.586217  1
  Al  Al102  1  0.583315  0.159519  0.919098  1
  Al  Al103  1  0.584887  0.411539  0.252554  1
  Al  Al104  1  0.585610  0.411296  0.585409  1
  Al  Al105  1  0.585368  0.411257  0.919028  1
  Al  Al106  1  0.593158  0.659362  0.251772  1
  Al  Al107  1  0.573250  0.662705  0.584451  1
  Al  Al108  1  0.577427  0.663159  0.918578  1
  Al  Al109  1  1.100073  -0.089085  0.252597  1
  Al  Al110  1  1.089606  -0.092737  0.586093  1
  Al  Al111  1  1.089269  -0.092488  0.918721  1
  Al  Al112  1  1.087074  0.160070  0.252610  1
  Al  Al113  1  1.083036  0.159573  0.585662  1
  Al  Al114  1  1.084454  0.159712  0.919355  1
  Al  Al115  1  1.085228  0.411179  0.252271  1
  Al  Al116  1  1.084924  0.411593  0.586017  1
  Al  Al117  1  1.085026  0.411382  0.919157  1
  Al  Al118  1  1.094349  0.658699  0.250627  1
  Al  Al119  1  1.073385  0.662560  0.583299  1
  Al  Al120  1  1.077335  0.663278  0.918322  1
  Al  Al121  1  0.353367  -0.137373  0.307898  1
  Al  Al122  1  0.342727  -0.141640  0.641941  1
  Al  Al123  1  0.345109  -0.140834  0.975043  1
  Al  Al124  1  0.340365  0.111069  0.308164  1
  Al  Al125  1  0.338121  0.110709  0.641438  1
  Al  Al126  1  0.338545  0.110782  0.974846  1
  Al  Al127  1  0.338915  0.362467  0.308043  1
  Al  Al128  1  0.339887  0.362529  0.641296  1
  Al  Al129  1  0.338933  0.362489  0.974706  1
  Al  Al130  1  0.328868  0.611059  0.307157  1
  Al  Al131  1  0.331540  0.613861  0.639897  1
  Al  Al132  1  0.332808  0.613886  0.973031  1
  Al  Al133  1  0.854549  -0.138605  0.307734  1
  Al  Al134  1  0.842146  -0.141712  0.641850  1
  Al  Al135  1  0.845268  -0.140861  0.975142  1
  Al  Al136  1  0.840330  0.110958  0.308181  1
  Al  Al137  1  0.838469  0.110758  0.641380  1
  Al  Al138  1  0.838702  0.110927  0.974768  1
  Al  Al139  1  0.838446  0.362485  0.308023  1
  Al  Al140  1  0.840430  0.362502  0.641343  1
  Al  Al141  1  0.838886  0.362470  0.974715  1
  Al  Al142  1  0.829224  0.611222  0.307107  1
  Al  Al143  1  0.831938  0.613880  0.639926  1
  Al  Al144  1  0.832961  0.613859  0.973097  1
  H  H145  1  0.433098  0.776294  0.108510  1
  H  H146  1  0.359515  -0.196057  0.403198  1
  H  H147  1  0.442654  0.777004  0.759009  1
  H  H148  1  0.416017  0.034893  0.089136  1
  H  H149  1  0.449027  0.029010  0.424736  1
  H  H150  1  0.422328  0.031492  0.759831  1
  H  H151  1  0.423286  0.283003  0.091947  1
  H  H152  1  0.427216  0.285059  0.422201  1
  H  H153  1  0.441487  0.281901  0.756147  1
  H  H154  1  0.437346  0.530373  0.088602  1
  H  H155  1  0.417497  0.535350  0.424740  1
  H  H156  1  0.455310  0.534089  0.753480  1
  H  H157  1  0.912569  0.776234  0.118846  1
  H  H158  1  0.863687  -0.195451  0.400661  1
  H  H159  1  0.925828  0.775360  0.766778  1
  H  H160  1  0.945624  0.031153  0.088766  1
  H  H161  1  0.925106  0.034021  0.425081  1
  H  H162  1  0.953150  0.030938  0.753218  1
  H  H163  1  0.954532  0.282665  0.085254  1
  H  H164  1  0.949501  0.281510  0.421364  1
  H  H165  1  0.936099  0.284612  0.754415  1
  H  H166  1  0.914624  0.535473  0.089979  1
  H  H167  1  0.939739  0.530585  0.423859  1
  H  H168  1  0.922473  0.533966  0.760647  1
  H  H169  1  0.350804  -0.050474  0.108952  1
  H  H170  1  0.340918  -0.051825  0.453319  1
  H  H171  1  0.339077  -0.052024  0.784016  1
  H  H172  1  0.336590  0.200756  0.116932  1
  H  H173  1  0.335814  0.199724  0.444287  1
  H  H174  1  0.333748  0.200554  0.785653  1
  H  H175  1  0.334827  0.452262  0.118867  1
  H  H176  1  0.335661  0.451054  0.443383  1
  H  H177  1  0.336828  0.451084  0.778715  1
  H  H178  1  0.333854  0.701847  0.118586  1
  H  H179  1  0.326751  0.701961  0.442924  1
  H  H180  1  0.333671  0.702567  0.778566  1
  H  H181  1  0.849980  -0.049022  0.117995  1
  H  H182  1  0.842397  -0.053030  0.444616  1
  H  H183  1  0.841543  -0.053121  0.779000  1
  H  H184  1  0.837742  0.199814  0.112718  1
  H  H185  1  0.834043  0.200909  0.452014  1
  H  H186  1  0.836193  0.199310  0.777658  1
  H  H187  1  0.836114  0.450967  0.110084  1
  H  H188  1  0.834410  0.452311  0.452008  1
  H  H189  1  0.835313  0.452160  0.783621  1
  H  H190  1  0.827926  0.700247  0.110650  1
  H  H191  1  0.827840  0.703048  0.450578  1
  H  H192  1  0.832122  0.703042  0.781809  1
  H  H193  1  0.592540  -0.172115  0.477205  1
  H  H194  1  0.587835  -0.173058  0.808452  1
  H  H195  1  0.584700  0.080472  0.141436  1
  H  H196  1  0.583349  0.079891  0.474051  1
  H  H197  1  0.583563  0.080022  0.807439  1
  H  H198  1  0.582629  0.331647  0.140821  1
  H  H199  1  0.582413  0.331877  0.474522  1
  H  H200  1  0.583559  0.331521  0.807408  1
  H  H201  1  0.579494  0.580666  0.137510  1
  H  H202  1  0.569784  0.582755  0.473751  1
  H  H203  1  0.577260  0.583223  0.806451  1
  H  H204  1  1.105172  -0.170742  0.141605  1
  H  H205  1  1.092791  -0.172555  0.477762  1
  H  H206  1  1.088534  -0.173033  0.808240  1
  H  H207  1  1.085678  0.080112  0.141221  1
  H  H208  1  1.084079  0.080443  0.474554  1
  H  H209  1  1.080843  0.079814  0.807498  1
  H  H210  1  1.080488  0.331502  0.140899  1
  H  H211  1  1.082823  0.331538  0.474048  1
  H  H212  1  1.082723  0.331706  0.807780  1
  H  H213  1  1.079633  0.581380  0.138088  1
  H  H214  1  1.068833  0.582144  0.473388  1
  H  H215  1  1.078619  0.583359  0.806217  1
  H  H216  1  0.365889  0.013420  0.188237  1
  H  H217  1  0.309469  0.013467  0.525875  1
  H  H218  1  0.307807  0.012570  0.859302  1
  H  H219  1  0.312942  0.264666  0.191647  1
  H  H220  1  0.364545  0.265793  0.520894  1
  H  H221  1  0.314667  0.265089  0.857282  1
  H  H222  1  0.300699  0.514572  0.190050  1
  H  H223  1  0.352134  0.515855  0.523117  1
  H  H224  1  0.346176  0.517315  0.853318  1
  H  H225  1  0.278911  0.773834  0.209487  1
  H  H226  1  0.338605  0.757772  0.513032  1
  H  H227  1  0.360395  0.760823  0.863019  1
  H  H228  1  0.819189  0.013994  0.191739  1
  H  H229  1  0.858894  0.013435  0.523371  1
  H  H230  1  0.853446  0.014156  0.854041  1
  H  H231  1  0.860290  0.266066  0.186048  1
  H  H232  1  0.819058  0.265220  0.523583  1
  H  H233  1  0.863940  0.265720  0.853763  1
  H  H234  1  0.848863  0.513582  0.187608  1
  H  H235  1  0.804150  0.516109  0.525325  1
  H  H236  1  0.801797  0.515582  0.858820  1
  H  H237  1  0.848080  -0.205243  0.208669  1
  H  H238  1  0.801698  0.760892  0.522900  1
  H  H239  1  0.827293  0.760830  0.867815  1
  H  H240  1  0.375220  0.782327  0.373787  1
  H  H241  1  0.342356  0.779365  0.720973  1
  H  H242  1  0.338054  0.781875  0.071060  1
  H  H243  1  0.341328  0.030874  0.387867  1
  H  H244  1  0.371650  0.030429  0.716503  1
  H  H245  1  0.364305  0.031643  1.046200  1
  H  H246  1  0.367442  0.282355  0.379886  1
  H  H247  1  0.348697  0.282173  0.716856  1
  H  H248  1  0.372891  0.281903  1.048621  1
  H  H249  1  0.357042  0.532834  0.382425  1
  H  H250  1  0.336147  0.533929  0.718342  1
  H  H251  1  0.331891  0.532844  1.051498  1
  H  H252  1  0.858334  0.784508  0.365930  1
  H  H253  1  0.869766  0.780026  0.724654  1
  H  H254  1  0.867825  0.781829  0.076525  1
  H  H255  1  0.867328  0.031426  0.382557  1
  H  H256  1  0.837111  0.030698  0.717462  1
  H  H257  1  0.835956  0.030061  0.052010  1
  H  H258  1  0.841960  0.282156  0.384233  1
  H  H259  1  0.859117  0.282363  0.713541  1
  H  H260  1  0.838378  0.282402  1.049555  1
  H  H261  1  0.831419  0.532077  0.387063  1
  H  H262  1  0.871852  0.533241  0.717436  1
  H  H263  1  0.857267  0.533798  1.047223  1
  H  H264  1  0.596859  -0.176920  0.321557  1
  H  H265  1  0.594144  -0.173323  0.697031  1
  H  H266  1  0.598981  -0.172189  1.031403  1
  H  H267  1  0.589859  0.079399  0.363650  1
  H  H268  1  0.590051  0.079609  0.696511  1
  H  H269  1  0.593582  0.079896  1.030122  1
  H  H270  1  0.591256  0.331364  0.363365  1
  H  H271  1  0.590840  0.331034  0.696758  1
  H  H272  1  0.589709  0.331337  1.029980  1
  H  H273  1  0.580219  0.581019  0.363580  1
  H  H274  1  0.584583  0.582357  0.695423  1
  H  H275  1  0.582776  0.581590  1.027402  1
  H  H276  1  1.117471  -0.177157  0.321580  1
  H  H277  1  1.093979  -0.172860  0.696671  1
  H  H278  1  1.097130  -0.172032  1.031142  1
  H  H279  1  1.093056  0.079843  0.363452  1
  H  H280  1  1.089608  0.079186  0.696716  1
  H  H281  1  1.087828  0.079368  1.030502  1
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  H  H570  1  1.099822  0.454333  0.088053  1
  H  H571  1  1.078536  0.454403  0.421493  1
  H  H572  1  1.080840  0.454377  0.755223  1
  H  H573  1  1.095444  0.704330  0.089125  1
  H  H574  1  1.059067  0.705103  0.418836  1
  H  H575  1  1.093523  0.705407  0.752723  1
