# generated using pymatgen
data_Al144H431
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.59190605
_cell_length_b   44.18490109
_cell_length_c   24.05222018
_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   5942.77002997
_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  0.336972  -0.137439  0.192381  1
  Al  Al2  1  0.334258  -0.135230  0.526242  1
  Al  Al3  1  0.334105  -0.134953  0.859225  1
  Al  Al4  1  0.334991  0.111000  0.199550  1
  Al  Al5  1  0.331578  0.111604  0.532722  1
  Al  Al6  1  0.333114  0.110678  0.865967  1
  Al  Al7  1  0.331733  0.361888  0.198230  1
  Al  Al8  1  0.332804  0.361804  0.531606  1
  Al  Al9  1  0.333935  0.361998  0.865074  1
  Al  Al10  1  0.332311  0.612498  0.198457  1
  Al  Al11  1  0.334536  0.612397  0.532028  1
  Al  Al12  1  0.331599  0.612630  0.865202  1
  Al  Al13  1  0.836329  -0.137408  0.192463  1
  Al  Al14  1  0.832099  -0.135136  0.526054  1
  Al  Al15  1  0.835059  -0.134959  0.859305  1
  Al  Al16  1  0.835372  0.111087  0.199502  1
  Al  Al17  1  0.832445  0.111904  0.532790  1
  Al  Al18  1  0.831889  0.110804  0.866017  1
  Al  Al19  1  0.833926  0.361817  0.198348  1
  Al  Al20  1  0.832359  0.361736  0.531606  1
  Al  Al21  1  0.833317  0.362058  0.864930  1
  Al  Al22  1  0.833176  0.612355  0.198470  1
  Al  Al23  1  0.832282  0.612436  0.531853  1
  Al  Al24  1  0.833619  0.612625  0.865315  1
  Al  Al25  1  0.338619  -0.136440  0.081016  1
  Al  Al26  1  0.337446  -0.137207  0.415154  1
  Al  Al27  1  0.336246  -0.135024  0.747778  1
  Al  Al28  1  0.337081  0.110666  0.088255  1
  Al  Al29  1  0.335264  0.111706  0.421543  1
  Al  Al30  1  0.334145  0.111054  0.754605  1
  Al  Al31  1  0.334395  0.362049  0.086831  1
  Al  Al32  1  0.334457  0.361878  0.420237  1
  Al  Al33  1  0.335580  0.362076  0.753732  1
  Al  Al34  1  0.333846  0.612735  0.087034  1
  Al  Al35  1  0.336211  0.612586  0.420642  1
  Al  Al36  1  0.334266  0.612556  0.753855  1
  Al  Al37  1  0.838458  -0.136401  0.081120  1
  Al  Al38  1  0.835570  -0.137367  0.415039  1
  Al  Al39  1  0.837622  -0.134891  0.747880  1
  Al  Al40  1  0.837578  0.110733  0.088249  1
  Al  Al41  1  0.835901  0.111975  0.421362  1
  Al  Al42  1  0.834005  0.111143  0.754625  1
  Al  Al43  1  0.836169  0.362159  0.086992  1
  Al  Al44  1  0.833681  0.361821  0.420256  1
  Al  Al45  1  0.834663  0.362006  0.753567  1
  Al  Al46  1  0.833866  0.612661  0.087148  1
  Al  Al47  1  0.834805  0.612484  0.420441  1
  Al  Al48  1  0.835606  0.612704  0.753988  1
  Al  Al49  1  0.593641  -0.089356  0.358612  1
  Al  Al50  1  0.596494  -0.086221  0.692697  1
  Al  Al51  1  0.599516  -0.087232  1.026842  1
  Al  Al52  1  0.592876  0.160581  0.365745  1
  Al  Al53  1  0.589180  0.160087  0.699786  1
  Al  Al54  1  0.593298  0.159655  1.032658  1
  Al  Al55  1  0.591295  0.410637  0.365222  1
  Al  Al56  1  0.593118  0.410967  0.698178  1
  Al  Al57  1  0.592193  0.410954  1.031470  1
  Al  Al58  1  0.591460  0.661315  0.365483  1
  Al  Al59  1  0.590922  0.661481  0.698478  1
  Al  Al60  1  0.589699  0.661588  1.031655  1
  Al  Al61  1  1.090494  -0.089728  0.358508  1
  Al  Al62  1  1.097587  -0.086053  0.691865  1
  Al  Al63  1  1.100562  -0.087010  1.026926  1
  Al  Al64  1  1.093679  0.160628  0.366319  1
  Al  Al65  1  1.090261  0.160263  0.699411  1
  Al  Al66  1  1.092706  0.159414  1.032989  1
  Al  Al67  1  1.092108  0.410787  0.364871  1
  Al  Al68  1  1.091981  0.410688  0.698530  1
  Al  Al69  1  1.092754  0.411121  1.032026  1
  Al  Al70  1  1.091840  0.661465  0.365118  1
  Al  Al71  1  1.090703  0.661346  0.698693  1
  Al  Al72  1  1.089741  0.661654  1.032201  1
  Al  Al73  1  0.583412  -0.087825  0.137595  1
  Al  Al74  1  0.583750  -0.086686  0.469179  1
  Al  Al75  1  0.585124  -0.086180  0.803959  1
  Al  Al76  1  0.585022  0.159762  0.143181  1
  Al  Al77  1  0.583065  0.160613  0.476590  1
  Al  Al78  1  0.583087  0.160087  0.810735  1
  Al  Al79  1  0.583727  0.410740  0.142222  1
  Al  Al80  1  0.582999  0.411000  0.476232  1
  Al  Al81  1  0.583197  0.410959  0.808869  1
  Al  Al82  1  0.583654  0.661385  0.142454  1
  Al  Al83  1  0.584304  0.661697  0.476518  1
  Al  Al84  1  0.583201  0.661491  0.809128  1
  Al  Al85  1  1.083459  -0.087823  0.137718  1
  Al  Al86  1  1.085247  -0.087066  0.468735  1
  Al  Al87  1  1.085478  -0.086208  0.803275  1
  Al  Al88  1  1.085337  0.160068  0.143910  1
  Al  Al89  1  1.083493  0.160996  0.477337  1
  Al  Al90  1  1.083331  0.159733  0.810036  1
  Al  Al91  1  1.083569  0.411211  0.143011  1
  Al  Al92  1  1.082740  0.410690  0.475516  1
  Al  Al93  1  1.083351  0.411162  0.809621  1
  Al  Al94  1  1.083286  0.661735  0.143168  1
  Al  Al95  1  1.084182  0.661269  0.475767  1
  Al  Al96  1  1.083490  0.661833  0.809753  1
  Al  Al97  1  0.587273  -0.088520  0.248164  1
  Al  Al98  1  0.575426  -0.085744  0.580896  1
  Al  Al99  1  0.579122  -0.086020  0.915492  1
  Al  Al100  1  0.582972  0.160071  0.254203  1
  Al  Al101  1  0.581204  0.160305  0.587991  1
  Al  Al102  1  0.582048  0.159741  0.921548  1
  Al  Al103  1  0.581636  0.410456  0.253477  1
  Al  Al104  1  0.583959  0.410882  0.587077  1
  Al  Al105  1  0.585163  0.410877  0.919973  1
  Al  Al106  1  0.583735  0.661096  0.253733  1
  Al  Al107  1  0.582658  0.661571  0.587383  1
  Al  Al108  1  0.582736  0.661435  0.920197  1
  Al  Al109  1  1.089375  -0.089166  0.248221  1
  Al  Al110  1  1.075893  -0.085983  0.579813  1
  Al  Al111  1  1.079428  -0.086354  0.915087  1
  Al  Al112  1  1.082583  0.160328  0.254844  1
  Al  Al113  1  1.081453  0.160708  0.588273  1
  Al  Al114  1  1.082554  0.159311  0.921225  1
  Al  Al115  1  1.081261  0.410936  0.253849  1
  Al  Al116  1  1.083917  0.410550  0.586720  1
  Al  Al117  1  1.084892  0.411114  0.920611  1
  Al  Al118  1  1.083149  0.661498  0.254011  1
  Al  Al119  1  1.083174  0.661110  0.586957  1
  Al  Al120  1  1.082075  0.661740  0.920792  1
  Al  Al121  1  0.339184  -0.138424  0.303545  1
  Al  Al122  1  0.336914  -0.134978  0.636912  1
  Al  Al123  1  0.338210  -0.135604  0.970118  1
  Al  Al124  1  0.337054  0.111427  0.310562  1
  Al  Al125  1  0.333948  0.111296  0.643543  1
  Al  Al126  1  0.337165  0.110595  0.977208  1
  Al  Al127  1  0.335122  0.361703  0.309247  1
  Al  Al128  1  0.336364  0.361867  0.642611  1
  Al  Al129  1  0.336595  0.361952  0.975949  1
  Al  Al130  1  0.336143  0.612449  0.309493  1
  Al  Al131  1  0.336505  0.612296  0.642954  1
  Al  Al132  1  0.334764  0.612617  0.976091  1
  Al  Al133  1  0.838180  -0.138596  0.303535  1
  Al  Al134  1  0.836956  -0.134770  0.636823  1
  Al  Al135  1  0.838328  -0.135566  0.970114  1
  Al  Al136  1  0.837322  0.111519  0.310474  1
  Al  Al137  1  0.834504  0.111482  0.643741  1
  Al  Al138  1  0.836197  0.110663  0.977258  1
  Al  Al139  1  0.835747  0.361667  0.309277  1
  Al  Al140  1  0.835952  0.361711  0.642594  1
  Al  Al141  1  0.837048  0.362109  0.975928  1
  Al  Al142  1  0.836739  0.612300  0.309479  1
  Al  Al143  1  0.835988  0.612456  0.642841  1
  Al  Al144  1  0.835289  0.612582  0.976197  1
  H  H145  1  0.454199  0.782294  0.086492  1
  H  H146  1  0.446777  0.780683  0.424691  1
  H  H147  1  0.414274  0.788913  0.756581  1
  H  H148  1  0.425498  0.028637  0.107352  1
  H  H149  1  0.416708  0.034607  0.428988  1
  H  H150  1  0.418946  0.029431  0.768218  1
  H  H151  1  0.419788  0.285265  0.092692  1
  H  H152  1  0.456139  0.281141  0.422637  1
  H  H153  1  0.443213  0.279018  0.759184  1
  H  H154  1  0.458045  0.531701  0.089144  1
  H  H155  1  0.445030  0.529606  0.424572  1
  H  H156  1  0.424547  0.535670  0.759946  1
  H  H157  1  0.916789  0.782748  0.094853  1
  H  H158  1  0.922314  0.786319  0.425486  1
  H  H159  1  0.946204  0.781806  0.756274  1
  H  H160  1  0.966318  0.027619  0.102390  1
  H  H161  1  0.946661  0.031300  0.424904  1
  H  H162  1  0.953441  0.028609  0.763716  1
  H  H163  1  0.944827  0.279029  0.091164  1
  H  H164  1  0.921447  0.281045  0.430425  1
  H  H165  1  0.918216  0.285029  0.760463  1
  H  H166  1  0.921818  0.532157  0.097052  1
  H  H167  1  0.925118  0.535639  0.426516  1
  H  H168  1  0.948752  0.528961  0.757376  1
  H  H169  1  0.329749  -0.047167  0.114528  1
  H  H170  1  0.331578  -0.046795  0.440034  1
  H  H171  1  0.334532  -0.046174  0.775964  1
  H  H172  1  0.334849  0.199191  0.111664  1
  H  H173  1  0.333262  0.200298  0.447101  1
  H  H174  1  0.331886  0.200670  0.787737  1
  H  H175  1  0.333771  0.450504  0.112876  1
  H  H176  1  0.332384  0.451525  0.453433  1
  H  H177  1  0.332222  0.450337  0.777533  1
  H  H178  1  0.333553  0.701047  0.112947  1
  H  H179  1  0.332835  0.702173  0.453444  1
  H  H180  1  0.333452  0.700960  0.777427  1
  H  H181  1  0.833558  -0.047867  0.110520  1
  H  H182  1  0.839154  -0.045947  0.479182  1
  H  H183  1  0.835219  -0.046365  0.776604  1
  H  H184  1  0.833261  0.200516  0.120638  1
  H  H185  1  0.831764  0.201416  0.452400  1
  H  H186  1  0.832982  0.199236  0.778594  1
  H  H187  1  0.831870  0.451690  0.118402  1
  H  H188  1  0.832146  0.450146  0.444012  1
  H  H189  1  0.832548  0.451702  0.786614  1
  H  H190  1  0.832400  0.702282  0.118446  1
  H  H191  1  0.834182  0.700780  0.444294  1
  H  H192  1  0.831736  0.702277  0.786532  1
  H  H193  1  0.584572  -0.167955  0.135606  1
  H  H194  1  0.582356  -0.167667  0.471785  1
  H  H195  1  0.584103  -0.165490  0.803535  1
  H  H196  1  0.585468  0.079828  0.143876  1
  H  H197  1  0.585672  0.080891  0.477326  1
  H  H198  1  0.582146  0.079800  0.809640  1
  H  H199  1  0.581112  0.331436  0.142510  1
  H  H200  1  0.578499  0.330745  0.475602  1
  H  H201  1  0.581472  0.330654  0.808863  1
  H  H202  1  0.577992  0.581525  0.142262  1
  H  H203  1  0.581386  0.581074  0.475637  1
  H  H204  1  0.581315  0.582054  0.809778  1
  H  H205  1  1.086262  -0.167785  0.135570  1
  H  H206  1  1.082476  -0.166808  0.472292  1
  H  H207  1  1.082836  -0.166344  0.803037  1
  H  H208  1  1.083239  0.079774  0.143952  1
  H  H209  1  1.077204  0.080836  0.476677  1
  H  H210  1  1.078604  0.079951  0.809740  1
  H  H211  1  1.081120  0.330568  0.141930  1
  H  H212  1  1.080728  0.330873  0.475466  1
  H  H213  1  1.081208  0.331409  0.809297  1
  H  H214  1  1.081630  0.581608  0.142213  1
  H  H215  1  1.081710  0.581946  0.476337  1
  H  H216  1  1.080287  0.581234  0.809047  1
  H  H217  1  0.300128  0.012357  0.205057  1
  H  H218  1  0.289367  0.015564  0.526565  1
  H  H219  1  0.300408  0.013868  0.865871  1
  H  H220  1  0.355684  0.263650  0.190503  1
  H  H221  1  0.345398  0.264158  0.522996  1
  H  H222  1  0.299321  0.264780  0.860598  1
  H  H223  1  0.348397  0.514885  0.189302  1
  H  H224  1  0.298428  0.514986  0.526125  1
  H  H225  1  0.353572  0.514556  0.857933  1
  H  H226  1  0.343095  0.764747  0.186314  1
  H  H227  1  0.302475  0.766902  0.526411  1
  H  H228  1  0.354346  0.766539  0.854296  1
  H  H229  1  0.832918  0.011958  0.200774  1
  H  H230  1  0.830758  0.012295  0.527140  1
  H  H231  1  0.838004  0.012564  0.864702  1
  H  H232  1  0.798307  0.264624  0.192665  1
  H  H233  1  0.797252  0.263535  0.528778  1
  H  H234  1  0.856240  0.263725  0.858109  1
  H  H235  1  0.796680  0.514461  0.195323  1
  H  H236  1  0.855731  0.514317  0.524318  1
  H  H237  1  0.798627  0.514888  0.859446  1
  H  H238  1  0.799023  0.763844  0.192597  1
  H  H239  1  0.858984  0.765954  0.523774  1
  H  H240  1  0.800151  0.767468  0.857343  1
  H  H241  1  0.336186  0.782648  0.388251  1
  H  H242  1  0.363171  0.785907  0.713468  1
  H  H243  1  0.333245  0.784831  1.051962  1
  H  H244  1  0.364038  0.032004  0.385872  1
  H  H245  1  0.367453  0.032369  0.725145  1
  H  H246  1  0.378193  0.031434  0.064117  1
  H  H247  1  0.335335  0.281673  0.387849  1
  H  H248  1  0.332887  0.281530  0.722894  1
  H  H249  1  0.362228  0.282538  1.050030  1
  H  H250  1  0.336942  0.531872  0.387837  1
  H  H251  1  0.365928  0.533159  0.717306  1
  H  H252  1  0.334402  0.532611  0.054927  1
  H  H253  1  0.862159  0.783526  0.383024  1
  H  H254  1  0.832778  0.784832  0.720589  1
  H  H255  1  0.873470  0.783267  1.051073  1
  H  H256  1  0.835009  0.031509  0.388506  1
  H  H257  1  0.836552  0.032936  0.729245  1
  H  H258  1  0.845119  0.032909  0.069176  1
  H  H259  1  0.873283  0.280880  0.386987  1
  H  H260  1  0.859623  0.282647  0.717830  1
  H  H261  1  0.833954  0.281422  0.054948  1
  H  H262  1  0.862672  0.533133  0.384174  1
  H  H263  1  0.836678  0.531641  0.721480  1
  H  H264  1  0.874190  0.531870  0.053553  1
  H  H265  1  0.587282  -0.169466  0.360144  1
  H  H266  1  0.591189  -0.166196  0.692084  1
  H  H267  1  0.590873  -0.167768  1.024799  1
  H  H268  1  0.589564  0.080396  0.365972  1
  H  H269  1  0.586970  0.080001  0.698229  1
  H  H270  1  0.590207  0.079255  1.032372  1
  H  H271  1  0.586343  0.330058  0.364702  1
  H  H272  1  0.585086  0.330189  0.698208  1
  H  H273  1  0.590127  0.330830  1.031156  1
  H  H274  1  0.585845  0.580752  0.364955  1
  H  H275  1  0.590718  0.581264  0.698287  1
  H  H276  1  0.586080  0.580938  1.031570  1
  H  H277  1  1.091684  -0.168939  0.359887  1
  H  H278  1  1.086157  -0.166747  0.692326  1
  H  H279  1  1.088618  -0.167338  1.024418  1
  H  H280  1  1.087187  0.079924  0.366194  1
  H  H281  1  1.086253  0.079566  0.698757  1
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  H  H571  1  1.098160  0.453650  0.422371  1
  H  H572  1  1.075567  0.453809  0.755660  1
  H  H573  1  1.076330  0.704605  0.090082  1
  H  H574  1  1.099101  0.704372  0.422834  1
  H  H575  1  1.077384  0.704457  0.755839  1
