# generated using pymatgen
data_Al4Ni3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.30953831
_cell_length_b   11.27713849
_cell_length_c   57.01345672
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al4Ni3
_chemical_formula_sum   'Al128 Ni96'
_cell_volume   7271.45235647
_cell_formula_units_Z   32
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  0.008351  0.507999  0.309260  1
  Al  Al2  1  0.252790  0.253373  0.459493  1
  Al  Al3  1  0.752991  0.253202  0.459452  1
  Al  Al4  1  0.252240  0.253045  0.359118  1
  Al  Al5  1  0.508353  0.498627  0.309257  1
  Al  Al6  1  0.502851  0.502956  0.409192  1
  Al  Al7  1  0.497448  0.007999  0.309260  1
  Al  Al8  1  0.253009  0.753373  0.459493  1
  Al  Al9  1  0.499289  1.003277  0.459500  1
  Al  Al10  1  0.753114  0.750075  0.409197  1
  Al  Al11  1  0.252701  0.756558  0.409200  1
  Al  Al12  1  0.502845  0.753382  0.458654  1
  Al  Al13  1  0.502893  0.253381  0.460350  1
  Al  Al14  1  0.749166  0.503206  0.459513  1
  Al  Al15  1  0.502600  0.253166  0.508862  1
  Al  Al16  1  0.752812  0.506970  0.409315  1
  Al  Al17  1  0.502911  0.753300  0.410119  1
  Al  Al18  1  0.253015  0.999669  0.409322  1
  Al  Al19  1  0.506302  0.503373  0.459457  1
  Al  Al20  1  0.256565  1.003447  0.459538  1
  Al  Al21  1  0.006510  0.503277  0.459500  1
  Al  Al22  1  0.754729  0.752821  0.309602  1
  Al  Al23  1  0.251075  0.753807  0.309603  1
  Al  Al24  1  0.002905  0.753381  0.460350  1
  Al  Al25  1  0.002954  0.253382  0.458654  1
  Al  Al26  1  0.756632  1.003206  0.459513  1
  Al  Al27  1  1.002888  0.253300  0.410119  1
  Al  Al28  1  0.744771  0.999000  0.310845  1
  Al  Al29  1  0.003199  0.753166  0.508862  1
  Al  Al30  1  0.261029  0.507629  0.310847  1
  Al  Al31  1  0.999497  1.003373  0.459457  1
  Al  Al32  1  0.249234  0.503447  0.459538  1
  Al  Al33  1  0.502882  1.003646  0.409204  1
  Al  Al34  1  0.752236  0.753586  0.359118  1
  Al  Al35  1  0.253559  0.753045  0.359118  1
  Al  Al36  1  0.752807  0.753202  0.459452  1
  Al  Al37  1  0.002948  1.002956  0.409192  1
  Al  Al38  1  0.997446  0.998627  0.309257  1
  Al  Al39  1  0.002917  0.503646  0.409204  1
  Al  Al40  1  0.753563  0.253586  0.359118  1
  Al  Al41  1  1.000328  0.503121  0.359039  1
  Al  Al42  1  0.254724  0.253807  0.309603  1
  Al  Al43  1  0.751070  0.252821  0.309602  1
  Al  Al44  1  1.002898  0.253314  0.358346  1
  Al  Al45  1  1.002899  0.753317  0.360549  1
  Al  Al46  1  0.247420  1.002205  0.359401  1
  Al  Al47  1  0.002910  0.753299  0.408557  1
  Al  Al48  1  0.244770  0.007629  0.310847  1
  Al  Al49  1  1.002898  0.253314  0.310569  1
  Al  Al50  1  0.761028  0.499000  0.310845  1
  Al  Al51  1  0.005474  1.003516  0.359034  1
  Al  Al52  1  0.758380  0.504417  0.359398  1
  Al  Al53  1  0.505471  1.003121  0.359039  1
  Al  Al54  1  0.253098  0.256558  0.409200  1
  Al  Al55  1  0.752684  0.250075  0.409197  1
  Al  Al56  1  0.502900  0.253317  0.360549  1
  Al  Al57  1  0.502901  0.753314  0.358346  1
  Al  Al58  1  0.258379  0.502205  0.359401  1
  Al  Al59  1  0.502900  0.753314  0.310569  1
  Al  Al60  1  0.252784  0.499669  0.409322  1
  Al  Al61  1  0.502889  0.253299  0.408557  1
  Al  Al62  1  0.752986  0.006970  0.409315  1
  Al  Al63  1  0.500325  0.503516  0.359034  1
  Al  Al64  1  0.747419  0.004417  0.359398  1
  Al  Al65  1  0.002926  0.503149  0.509835  1
  Al  Al66  1  0.255955  0.253281  0.663008  1
  Al  Al67  1  0.758497  0.248864  0.656555  1
  Al  Al68  1  0.254313  0.254397  0.560308  1
  Al  Al69  1  0.502850  0.503101  0.509593  1
  Al  Al70  1  0.499230  0.502515  0.609701  1
  Al  Al71  1  0.502872  1.003149  0.509835  1
  Al  Al72  1  0.249844  0.753281  0.663008  1
  Al  Al73  1  0.505523  1.003351  0.661861  1
  Al  Al74  1  0.755274  0.749714  0.608704  1
  Al  Al75  1  0.254962  0.756194  0.611861  1
  Al  Al76  1  0.504606  0.754034  0.656353  1
  Al  Al77  1  0.505742  0.251717  0.660757  1
  Al  Al78  1  0.754778  0.503091  0.659078  1
  Al  Al79  1  0.642997  0.372433  0.692854  1
  Al  Al80  1  0.751505  0.507650  0.609782  1
  Al  Al81  1  0.503391  0.750363  0.609794  1
  Al  Al82  1  0.253588  0.998850  0.611213  1
  Al  Al83  1  0.518727  0.509716  0.657532  1
  Al  Al84  1  0.261836  1.000783  0.662718  1
  Al  Al85  1  1.000276  0.503351  0.661861  1
  Al  Al86  1  0.753309  0.756654  0.509604  1
  Al  Al87  1  0.253196  0.749884  0.509813  1
  Al  Al88  1  1.000057  0.751717  0.660757  1
  Al  Al89  1  1.001193  0.254034  0.656353  1
  Al  Al90  1  0.751020  1.003091  0.659078  1
  Al  Al91  1  1.002407  0.250363  0.609794  1
  Al  Al92  1  0.752946  0.999795  0.509694  1
  Al  Al93  1  0.862802  0.872433  0.692854  1
  Al  Al94  1  0.252981  0.506943  0.509797  1
  Al  Al95  1  0.987071  0.009716  0.657532  1
  Al  Al96  1  0.243963  0.500783  0.662718  1
  Al  Al97  1  0.499871  1.002973  0.610482  1
  Al  Al98  1  0.751751  0.754530  0.559502  1
  Al  Al99  1  0.251486  0.754397  0.560308  1
  Al  Al100  1  0.747302  0.748864  0.656555  1
  Al  Al101  1  0.006568  1.002515  0.609701  1
  Al  Al102  1  0.002949  1.003101  0.509593  1
  Al  Al103  1  0.005928  0.502973  0.610482  1
  Al  Al104  1  0.754048  0.254530  0.559502  1
  Al  Al105  1  1.000814  0.503937  0.560232  1
  Al  Al106  1  0.252603  0.249884  0.509813  1
  Al  Al107  1  0.752490  0.256654  0.509604  1
  Al  Al108  1  0.004340  0.253454  0.559114  1
  Al  Al109  1  1.002789  0.752906  0.561063  1
  Al  Al110  1  0.250069  1.003499  0.560100  1
  Al  Al111  1  0.007324  0.754454  0.609895  1
  Al  Al112  1  0.252818  0.006943  0.509797  1
  Al  Al113  1  1.002800  0.253385  0.510563  1
  Al  Al114  1  0.752853  0.499795  0.509694  1
  Al  Al115  1  0.008080  1.003840  0.559651  1
  Al  Al116  1  0.757143  0.503421  0.559667  1
  Al  Al117  1  0.504985  1.003937  0.560232  1
  Al  Al118  1  0.250837  0.256194  0.611861  1
  Al  Al119  1  0.750524  0.249714  0.608704  1
  Al  Al120  1  0.503009  0.252906  0.561063  1
  Al  Al121  1  0.501459  0.753454  0.559114  1
  Al  Al122  1  0.255730  0.503499  0.560100  1
  Al  Al123  1  0.502999  0.753385  0.510563  1
  Al  Al124  1  0.252211  0.498850  0.611213  1
  Al  Al125  1  0.498475  0.254454  0.609895  1
  Al  Al126  1  0.754293  0.007650  0.609782  1
  Al  Al127  1  0.497719  0.503840  0.559651  1
  Al  Al128  1  0.748656  1.003421  0.559667  1
  Ni  Ni129  1  0.385489  0.367750  0.333518  1
  Ni  Ni130  1  0.383348  0.628701  0.483600  1
  Ni  Ni131  1  0.622366  0.878108  0.483594  1
  Ni  Ni132  1  0.133300  0.122841  0.434365  1
  Ni  Ni133  1  0.372032  0.122450  0.383995  1
  Ni  Ni134  1  0.627220  0.872970  0.385180  1
  Ni  Ni135  1  0.127702  0.633790  0.433407  1
  Ni  Ni136  1  0.133611  0.883631  0.484607  1
  Ni  Ni137  1  0.123319  0.630429  0.335201  1
  Ni  Ni138  1  0.383199  0.378075  0.435412  1
  Ni  Ni139  1  0.872578  0.383860  0.434372  1
  Ni  Ni140  1  0.378561  0.633668  0.385179  1
  Ni  Ni141  1  0.127238  0.133668  0.385179  1
  Ni  Ni142  1  0.122599  0.878075  0.435412  1
  Ni  Ni143  1  0.883339  0.628470  0.435421  1
  Ni  Ni144  1  0.372188  0.383631  0.484607  1
  Ni  Ni145  1  0.133559  0.384986  0.334525  1
  Ni  Ni146  1  0.885486  0.638877  0.333518  1
  Ni  Ni147  1  0.378140  0.872889  0.485654  1
  Ni  Ni148  1  0.372499  0.622841  0.434365  1
  Ni  Ni149  1  0.383208  0.878124  0.383164  1
  Ni  Ni150  1  0.122451  0.128701  0.483600  1
  Ni  Ni151  1  0.633044  0.122637  0.484575  1
  Ni  Ni152  1  0.120310  0.867750  0.333518  1
  Ni  Ni153  1  0.878135  0.872878  0.433390  1
  Ni  Ni154  1  0.883206  0.128489  0.383163  1
  Ni  Ni155  1  0.122590  0.378124  0.383164  1
  Ni  Ni156  1  0.633564  0.621644  0.334523  1
  Ni  Ni157  1  0.872754  0.622637  0.484575  1
  Ni  Ni158  1  0.127658  0.372889  0.485654  1
  Ni  Ni159  1  0.620313  0.138877  0.333518  1
  Ni  Ni160  1  0.633757  0.384185  0.383994  1
  Ni  Ni161  1  0.622460  0.128470  0.435421  1
  Ni  Ni162  1  0.882481  0.876197  0.335199  1
  Ni  Ni163  1  0.372239  0.884986  0.334525  1
  Ni  Ni164  1  0.878290  0.133873  0.485598  1
  Ni  Ni165  1  0.627509  0.633873  0.485598  1
  Ni  Ni166  1  0.623318  0.376197  0.335199  1
  Ni  Ni167  1  0.382480  0.130429  0.335201  1
  Ni  Ni168  1  0.872042  0.884185  0.383994  1
  Ni  Ni169  1  0.633221  0.883860  0.434372  1
  Ni  Ni170  1  0.378097  0.133790  0.433407  1
  Ni  Ni171  1  0.878579  0.372970  0.385180  1
  Ni  Ni172  1  0.872234  0.121644  0.334523  1
  Ni  Ni173  1  0.883432  0.378108  0.483594  1
  Ni  Ni174  1  0.622593  0.628489  0.383163  1
  Ni  Ni175  1  0.133767  0.622450  0.383995  1
  Ni  Ni176  1  0.627664  0.372878  0.433390  1
  Ni  Ni177  1  0.378177  0.372564  0.533834  1
  Ni  Ni178  1  0.398849  0.626485  0.682174  1
  Ni  Ni179  1  0.630053  0.863802  0.682951  1
  Ni  Ni180  1  0.138937  0.119760  0.637136  1
  Ni  Ni181  1  0.369865  0.123650  0.585682  1
  Ni  Ni182  1  0.626854  0.874904  0.585971  1
  Ni  Ni183  1  0.128745  0.631928  0.635757  1
  Ni  Ni184  1  0.107223  0.899589  0.682940  1
  Ni  Ni185  1  0.122522  0.629170  0.535864  1
  Ni  Ni186  1  0.381109  0.381347  0.638087  1
  Ni  Ni187  1  0.874438  0.385206  0.633862  1
  Ni  Ni188  1  0.373601  0.633157  0.586070  1
  Ni  Ni189  1  0.132198  0.133157  0.586070  1
  Ni  Ni190  1  0.124689  0.881347  0.638087  1
  Ni  Ni191  1  0.886027  0.626774  0.635477  1
  Ni  Ni192  1  0.398576  0.399589  0.682940  1
  Ni  Ni193  1  0.133699  0.383646  0.534906  1
  Ni  Ni194  1  0.878788  0.634079  0.533865  1
  Ni  Ni195  1  0.404562  0.851674  0.686153  1
  Ni  Ni196  1  0.366862  0.619760  0.637136  1
  Ni  Ni197  1  0.381413  0.877825  0.584346  1
  Ni  Ni198  1  0.106950  0.126485  0.682174  1
  Ni  Ni199  1  0.649842  0.136525  0.684167  1
  Ni  Ni200  1  0.127621  0.872564  0.533834  1
  Ni  Ni201  1  0.876814  0.871967  0.633604  1
  Ni  Ni202  1  0.883241  0.126669  0.583427  1
  Ni  Ni203  1  0.124386  0.377825  0.584346  1
  Ni  Ni204  1  0.632697  0.622856  0.534763  1
  Ni  Ni205  1  0.855957  0.636525  0.684167  1
  Ni  Ni206  1  0.101237  0.351674  0.686153  1
  Ni  Ni207  1  0.627011  0.134079  0.533865  1
  Ni  Ni208  1  0.631226  0.384901  0.584677  1
  Ni  Ni209  1  0.619772  0.126774  0.635477  1
  Ni  Ni210  1  0.884286  0.878045  0.535845  1
  Ni  Ni211  1  0.372099  0.883646  0.534906  1
  Ni  Ni212  1  0.879028  0.141636  0.684288  1
  Ni  Ni213  1  0.626771  0.641636  0.684288  1
  Ni  Ni214  1  0.621512  0.378045  0.535845  1
  Ni  Ni215  1  0.383277  0.129170  0.535864  1
  Ni  Ni216  1  0.874573  0.884901  0.584677  1
  Ni  Ni217  1  0.631361  0.885206  0.633862  1
  Ni  Ni218  1  0.377054  0.131928  0.635757  1
  Ni  Ni219  1  0.878945  0.374904  0.585971  1
  Ni  Ni220  1  0.873102  0.122856  0.534763  1
  Ni  Ni221  1  0.875746  0.363802  0.682951  1
  Ni  Ni222  1  0.622558  0.626669  0.583427  1
  Ni  Ni223  1  0.135934  0.623650  0.585682  1
  Ni  Ni224  1  0.628985  0.371967  0.633604  1
