# generated using pymatgen
data_SmAl4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.35105911
_cell_length_b   11.88224959
_cell_length_c   49.77877673
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   83.62044108
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SmAl4
_chemical_formula_sum   'Sm36 Al144'
_cell_volume   7848.03503938
_cell_formula_units_Z   36
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
  Sm  Sm1  1  0.793908  0.558387  0.317726  1
  Sm  Sm2  1  0.110376  0.515179  0.343170  1
  Sm  Sm3  1  0.502032  0.593661  0.288725  1
  Sm  Sm4  1  0.659837  0.080926  0.303186  1
  Sm  Sm5  1  0.954717  0.023587  0.326001  1
  Sm  Sm6  1  0.342348  0.121056  0.279467  1
  Sm  Sm7  1  0.710251  0.435328  0.391043  1
  Sm  Sm8  1  0.015646  0.399080  0.417118  1
  Sm  Sm9  1  0.406566  0.465626  0.365588  1
  Sm  Sm10  1  0.563619  0.954911  0.378907  1
  Sm  Sm11  1  0.864403  0.907261  0.404829  1
  Sm  Sm12  1  0.251265  0.995331  0.351123  1
  Sm  Sm13  1  0.622787  0.315601  0.467488  1
  Sm  Sm14  1  0.926017  0.277292  0.493184  1
  Sm  Sm15  1  0.319234  0.351413  0.442244  1
  Sm  Sm16  1  0.469240  0.837905  0.454858  1
  Sm  Sm17  1  0.773277  0.797589  0.481025  1
  Sm  Sm18  1  0.167318  0.874083  0.428803  1
  Sm  Sm19  1  0.533940  0.202824  0.544520  1
  Sm  Sm20  1  0.836357  0.161937  0.569887  1
  Sm  Sm21  1  0.229628  0.239015  0.518865  1
  Sm  Sm22  1  0.381197  0.721292  0.532319  1
  Sm  Sm23  1  0.683274  0.683034  0.557975  1
  Sm  Sm24  1  0.077945  0.761195  0.506829  1
  Sm  Sm25  1  0.444001  0.093099  0.620807  1
  Sm  Sm26  1  0.746358  0.048015  0.646733  1
  Sm  Sm27  1  0.141318  0.126099  0.596032  1
  Sm  Sm28  1  0.290371  0.599554  0.608050  1
  Sm  Sm29  1  0.597705  0.563007  0.635471  1
  Sm  Sm30  1  0.986982  0.646855  0.583429  1
  Sm  Sm31  1  0.352305  0.962716  0.698644  1
  Sm  Sm32  1  0.655921  0.926301  0.718732  1
  Sm  Sm33  1  0.052824  0.008724  0.670711  1
  Sm  Sm34  1  0.197936  0.476544  0.683918  1
  Sm  Sm35  1  0.507851  0.442071  0.708575  1
  Sm  Sm36  1  0.899486  0.530843  0.660332  1
  Al  Al37  1  0.592825  0.384582  0.325909  1
  Al  Al38  1  0.879060  0.438119  0.265499  1
  Al  Al39  1  0.353442  0.404706  0.303530  1
  Al  Al40  1  0.785661  0.275882  0.333950  1
  Al  Al41  1  0.162904  0.377429  0.287364  1
  Al  Al42  1  0.515786  0.297924  0.277706  1
  Al  Al43  1  0.699694  0.369791  0.281340  1
  Al  Al44  1  0.977686  0.347076  0.310866  1
  Al  Al45  1  0.258092  0.264181  0.333575  1
  Al  Al46  1  0.865229  0.212498  0.284246  1
  Al  Al47  1  0.117386  0.168546  0.304342  1
  Al  Al48  1  0.454899  0.206884  0.327806  1
  Al  Al49  1  0.859749  1.003391  0.266591  1
  Al  Al50  1  0.159864  0.960757  0.287235  1
  Al  Al51  1  0.463127  0.971458  0.323416  1
  Al  Al52  1  0.620877  0.793969  0.321372  1
  Al  Al53  1  0.006767  0.825117  0.277386  1
  Al  Al54  1  0.339528  0.834749  0.297141  1
  Al  Al55  1  0.804456  0.827869  0.293060  1
  Al  Al56  1  0.145831  0.782407  0.318730  1
  Al  Al57  1  0.528250  0.880118  0.275444  1
  Al  Al58  1  0.689940  0.691899  0.268390  1
  Al  Al59  1  0.012774  0.578017  0.286860  1
  Al  Al60  1  0.297810  0.618840  0.318020  1
  Al  Al61  1  0.522472  0.287562  0.408099  1
  Al  Al62  1  0.915678  0.397409  0.360700  1
  Al  Al63  1  0.222132  0.325601  0.383374  1
  Al  Al64  1  0.695023  0.150463  0.409383  1
  Al  Al65  1  0.074138  0.230396  0.357884  1
  Al  Al66  1  0.391658  0.183658  0.379205  1
  Al  Al67  1  0.600167  0.223091  0.361877  1
  Al  Al68  1  0.889915  0.195979  0.383401  1
  Al  Al69  1  0.180592  0.148083  0.409400  1
  Al  Al70  1  0.759896  0.072603  0.360268  1
  Al  Al71  1  0.048349  0.033969  0.384061  1
  Al  Al72  1  0.352673  0.019594  0.411426  1
  Al  Al73  1  0.787397  0.862825  0.345114  1
  Al  Al74  1  0.056028  0.829049  0.365816  1
  Al  Al75  1  0.372030  0.818803  0.393789  1
  Al  Al76  1  0.533165  0.671085  0.395993  1
  Al  Al77  1  0.953772  0.733543  0.326352  1
  Al  Al78  1  0.239613  0.708811  0.368985  1
  Al  Al79  1  0.715071  0.705331  0.372702  1
  Al  Al80  1  0.048097  0.671540  0.401554  1
  Al  Al81  1  0.429692  0.754913  0.344287  1
  Al  Al82  1  0.586142  0.590179  0.346410  1
  Al  Al83  1  0.903684  0.618154  0.371173  1
  Al  Al84  1  0.210428  0.528993  0.400442  1
  Al  Al85  1  0.435703  0.176631  0.485153  1
  Al  Al86  1  0.831643  0.256814  0.432917  1
  Al  Al87  1  0.129866  0.216041  0.458289  1
  Al  Al88  1  0.600576  0.035810  0.486844  1
  Al  Al89  1  0.993450  0.110665  0.433375  1
  Al  Al90  1  0.295823  0.075789  0.460697  1
  Al  Al91  1  0.493991  0.112206  0.436731  1
  Al  Al92  1  0.797623  0.078653  0.461344  1
  Al  Al93  1  0.099734  0.039795  0.487137  1
  Al  Al94  1  0.659582  0.973099  0.438130  1
  Al  Al95  1  0.961713  0.936660  0.463538  1
  Al  Al96  1  0.263719  0.899223  0.489343  1
  Al  Al97  1  0.674277  0.771805  0.421717  1
  Al  Al98  1  0.978305  0.733949  0.448578  1
  Al  Al99  1  0.284924  0.699812  0.472497  1
  Al  Al100  1  0.448318  0.556196  0.473581  1
  Al  Al101  1  0.842180  0.630714  0.422061  1
  Al  Al102  1  0.147129  0.594246  0.449330  1
  Al  Al103  1  0.641522  0.593953  0.449036  1
  Al  Al104  1  0.947983  0.554394  0.475391  1
  Al  Al105  1  0.343465  0.640363  0.423348  1
  Al  Al106  1  0.503674  0.489762  0.424585  1
  Al  Al107  1  0.807614  0.455274  0.451090  1
  Al  Al108  1  0.113967  0.413623  0.476730  1
  Al  Al109  1  0.346095  0.065812  0.562290  1
  Al  Al110  1  0.739424  0.139301  0.510169  1
  Al  Al111  1  0.044098  0.099645  0.536116  1
  Al  Al112  1  0.509673  0.921176  0.564468  1
  Al  Al113  1  0.903906  0.998696  0.512310  1
  Al  Al114  1  0.209109  0.959432  0.538566  1
  Al  Al115  1  0.402865  1.000211  0.513526  1
  Al  Al116  1  0.705089  0.963257  0.538935  1
  Al  Al117  1  0.011709  0.921965  0.564165  1
  Al  Al118  1  0.566881  0.859114  0.515411  1
  Al  Al119  1  0.869600  0.822657  0.540807  1
  Al  Al120  1  0.177634  0.783822  0.567809  1
  Al  Al121  1  0.585986  0.660811  0.497683  1
  Al  Al122  1  0.890713  0.623262  0.523767  1
  Al  Al123  1  0.191838  0.586694  0.548818  1
  Al  Al124  1  0.358052  0.446463  0.549466  1
  Al  Al125  1  0.751387  0.519981  0.499847  1
  Al  Al126  1  0.054980  0.480278  0.525248  1
  Al  Al127  1  0.555050  0.481666  0.525732  1
  Al  Al128  1  0.858250  0.443415  0.551322  1
  Al  Al129  1  0.251731  0.519966  0.500164  1
  Al  Al130  1  0.416901  0.377254  0.501403  1
  Al  Al131  1  0.720327  0.339226  0.526944  1
  Al  Al132  1  0.022629  0.299713  0.552528  1
  Al  Al133  1  0.259339  0.971211  0.641110  1
  Al  Al134  1  0.648369  0.027927  0.587734  1
  Al  Al135  1  0.953132  0.981863  0.612468  1
  Al  Al136  1  0.416988  0.802569  0.641823  1
  Al  Al137  1  0.811005  0.883148  0.589517  1
  Al  Al138  1  0.125230  0.851127  0.616713  1
  Al  Al139  1  0.315207  0.888920  0.592208  1
  Al  Al140  1  0.611900  0.849383  0.616630  1
  Al  Al141  1  0.920634  0.806748  0.641878  1
  Al  Al142  1  0.476890  0.740440  0.592472  1
  Al  Al143  1  0.777924  0.708147  0.618587  1
  Al  Al144  1  0.089307  0.666627  0.642105  1
  Al  Al145  1  0.498691  0.538997  0.575267  1
  Al  Al146  1  0.801307  0.509883  0.600421  1
  Al  Al147  1  0.095990  0.465095  0.625834  1
  Al  Al148  1  0.259644  0.326799  0.624600  1
  Al  Al149  1  0.666194  0.404080  0.575789  1
  Al  Al150  1  0.962348  0.364426  0.600881  1
  Al  Al151  1  0.461915  0.373358  0.607629  1
  Al  Al152  1  0.770698  0.331883  0.629705  1
  Al  Al153  1  0.160500  0.404854  0.576270  1
  Al  Al154  1  0.333046  0.269540  0.577637  1
  Al  Al155  1  0.629687  0.230805  0.604103  1
  Al  Al156  1  0.935266  0.184654  0.628235  1
  Al  Al157  1  0.162616  0.848610  0.716430  1
  Al  Al158  1  0.551058  0.933679  0.664154  1
  Al  Al159  1  0.865485  0.893191  0.689467  1
  Al  Al160  1  0.329565  0.678742  0.712272  1
  Al  Al161  1  0.718935  0.776584  0.666547  1
  Al  Al162  1  0.031196  0.736827  0.689766  1
  Al  Al163  1  0.231240  0.768374  0.666369  1
  Al  Al164  1  0.511542  0.734556  0.689647  1
  Al  Al165  1  0.842114  0.702391  0.714060  1
  Al  Al166  1  0.389342  0.590299  0.663919  1
  Al  Al167  1  0.681926  0.609728  0.699572  1
  Al  Al168  1  0.011080  0.560520  0.720578  1
  Al  Al169  1  0.399347  0.353710  0.659655  1
  Al  Al170  1  0.724302  0.404967  0.682194  1
  Al  Al171  1  0.998066  0.350892  0.704888  1
  Al  Al172  1  0.155641  0.186024  0.706902  1
  Al  Al173  1  0.592357  0.291015  0.654098  1
  Al  Al174  1  0.873558  0.241738  0.676349  1
  Al  Al175  1  0.343538  0.256887  0.709813  1
  Al  Al176  1  0.680691  0.200954  0.701885  1
  Al  Al177  1  0.074454  0.280520  0.655359  1
  Al  Al178  1  0.265851  0.173439  0.662525  1
  Al  Al179  1  0.504871  0.142412  0.684135  1
  Al  Al180  1  0.859441  0.086190  0.713628  1
