# generated using pymatgen
data_AlNi3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.01709532
_cell_length_b   20.69109488
_cell_length_c   55.45376240
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlNi3
_chemical_formula_sum   'Al60 Ni180'
_cell_volume   5756.61045377
_cell_formula_units_Z   60
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  0.552360  0.554681  0.311624  1
  Al  Al2  1  0.552360  0.320299  0.251313  1
  Al  Al3  1  0.552360  0.937506  0.281163  1
  Al  Al4  1  1.052360  0.813423  0.238623  1
  Al  Al5  1  1.052360  0.429687  0.268551  1
  Al  Al6  1  1.052360  0.047432  0.298386  1
  Al  Al7  1  1.052360  0.619837  0.252724  1
  Al  Al8  1  1.052360  0.238661  0.283464  1
  Al  Al9  1  1.052360  0.856213  0.313953  1
  Al  Al10  1  0.552360  0.746034  0.296071  1
  Al  Al11  1  0.552360  0.512663  0.236082  1
  Al  Al12  1  0.552360  0.129096  0.266194  1
  Al  Al13  1  0.552360  0.406085  0.402971  1
  Al  Al14  1  0.552360  0.171629  0.342021  1
  Al  Al15  1  0.552360  0.788946  0.372410  1
  Al  Al16  1  1.052360  0.664640  0.329129  1
  Al  Al17  1  1.052360  0.281583  0.359697  1
  Al  Al18  1  1.052360  0.898819  0.390035  1
  Al  Al19  1  1.052360  0.473175  0.344566  1
  Al  Al20  1  1.052360  0.090140  0.374778  1
  Al  Al21  1  1.052360  0.707463  0.405255  1
  Al  Al22  1  0.552360  0.597592  0.387729  1
  Al  Al23  1  0.552360  0.363048  0.326918  1
  Al  Al24  1  0.552360  0.980300  0.357175  1
  Al  Al25  1  0.552360  0.257445  0.494223  1
  Al  Al26  1  0.552360  0.023166  0.433372  1
  Al  Al27  1  0.552360  0.640452  0.463849  1
  Al  Al28  1  1.052360  0.516060  0.420556  1
  Al  Al29  1  1.052360  0.133052  0.450929  1
  Al  Al30  1  1.052360  0.750339  0.481407  1
  Al  Al31  1  1.052360  0.324528  0.435747  1
  Al  Al32  1  1.052360  0.941691  0.466176  1
  Al  Al33  1  1.052360  0.558937  0.496627  1
  Al  Al34  1  0.552360  0.448976  0.479031  1
  Al  Al35  1  0.552360  0.214568  0.418151  1
  Al  Al36  1  0.552360  0.831814  0.448602  1
  Al  Al37  1  0.552360  0.108865  0.585649  1
  Al  Al38  1  0.552360  0.874685  0.524743  1
  Al  Al39  1  0.552360  0.491921  0.555081  1
  Al  Al40  1  1.052360  0.367419  0.511807  1
  Al  Al41  1  1.052360  -0.015441  0.542368  1
  Al  Al42  1  1.052360  0.601876  0.572757  1
  Al  Al43  1  1.052360  0.175912  0.527049  1
  Al  Al44  1  1.052360  0.793204  0.557603  1
  Al  Al45  1  1.052360  0.410456  0.587860  1
  Al  Al46  1  0.552360  0.300329  0.570212  1
  Al  Al47  1  0.552360  0.066042  0.509523  1
  Al  Al48  1  0.552360  0.683364  0.540000  1
  Al  Al49  1  0.552360  0.960082  0.676156  1
  Al  Al50  1  0.552360  0.726072  0.616392  1
  Al  Al51  1  0.552360  0.343817  0.646227  1
  Al  Al52  1  1.052360  0.218823  0.603154  1
  Al  Al53  1  1.052360  0.835999  0.633615  1
  Al  Al54  1  1.052360  0.453206  0.663465  1
  Al  Al55  1  1.052360  0.027471  0.618707  1
  Al  Al56  1  1.052360  0.644408  0.648584  1
  Al  Al57  1  1.052360  0.260842  0.678696  1
  Al  Al58  1  0.552360  0.153668  0.662054  1
  Al  Al59  1  0.552360  0.917292  0.600825  1
  Al  Al60  1  0.552360  0.534843  0.631314  1
  Ni  Ni61  1  0.803053  0.451698  0.306891  1
  Ni  Ni62  1  0.800859  0.217163  0.245005  1
  Ni  Ni63  1  0.802556  0.835258  0.276577  1
  Ni  Ni64  1  1.052360  0.554486  0.311397  1
  Ni  Ni65  1  1.052360  0.319765  0.250387  1
  Ni  Ni66  1  1.052360  0.937968  0.280739  1
  Ni  Ni67  1  0.301667  0.451698  0.306891  1
  Ni  Ni68  1  0.303861  0.217163  0.245005  1
  Ni  Ni69  1  0.302164  0.835258  0.276577  1
  Ni  Ni70  1  0.301241  0.723731  0.257731  1
  Ni  Ni71  1  0.302138  0.341365  0.288690  1
  Ni  Ni72  1  0.302420  0.958775  0.318830  1
  Ni  Ni73  1  0.552360  0.813510  0.238911  1
  Ni  Ni74  1  0.552360  0.430391  0.269136  1
  Ni  Ni75  1  0.552360  0.047181  0.298992  1
  Ni  Ni76  1  0.803479  0.723731  0.257731  1
  Ni  Ni77  1  0.802581  0.341365  0.288690  1
  Ni  Ni78  1  0.802300  0.958775  0.318830  1
  Ni  Ni79  1  0.302094  0.532508  0.273607  1
  Ni  Ni80  1  0.302252  0.150021  0.303715  1
  Ni  Ni81  1  0.303120  0.917329  0.242505  1
  Ni  Ni82  1  0.552360  0.622250  0.253338  1
  Ni  Ni83  1  0.552360  0.238851  0.284125  1
  Ni  Ni84  1  0.552360  0.856194  0.314411  1
  Ni  Ni85  1  0.802626  0.532508  0.273607  1
  Ni  Ni86  1  0.802468  0.150021  0.303715  1
  Ni  Ni87  1  0.801600  0.917329  0.242505  1
  Ni  Ni88  1  0.803157  0.643137  0.291424  1
  Ni  Ni89  1  0.800836  0.408153  0.230296  1
  Ni  Ni90  1  0.801275  0.027037  0.259947  1
  Ni  Ni91  1  1.052360  0.745967  0.295945  1
  Ni  Ni92  1  1.052360  0.511321  0.235016  1
  Ni  Ni93  1  1.052360  0.129217  0.265364  1
  Ni  Ni94  1  0.301563  0.643137  0.291424  1
  Ni  Ni95  1  0.303884  0.408153  0.230296  1
  Ni  Ni96  1  0.303445  0.027037  0.259947  1
  Ni  Ni97  1  0.802698  0.303234  0.397991  1
  Ni  Ni98  1  0.802932  0.068847  0.336936  1
  Ni  Ni99  1  0.802675  0.686215  0.367456  1
  Ni  Ni100  1  1.052360  0.405913  0.402643  1
  Ni  Ni101  1  1.052360  0.171444  0.341732  1
  Ni  Ni102  1  1.052360  0.788757  0.372091  1
  Ni  Ni103  1  0.302022  0.303234  0.397991  1
  Ni  Ni104  1  0.301788  0.068847  0.336936  1
  Ni  Ni105  1  0.302045  0.686215  0.367456  1
  Ni  Ni106  1  0.302831  0.576019  0.349413  1
  Ni  Ni107  1  0.302774  0.192947  0.379823  1
  Ni  Ni108  1  0.302713  0.810210  0.410235  1
  Ni  Ni109  1  0.552360  0.664838  0.329434  1
  Ni  Ni110  1  0.552360  0.281773  0.360003  1
  Ni  Ni111  1  0.552360  0.898990  0.390365  1
  Ni  Ni112  1  0.801889  0.576019  0.349413  1
  Ni  Ni113  1  0.801946  0.192947  0.379823  1
  Ni  Ni114  1  0.802007  0.810210  0.410235  1
  Ni  Ni115  1  0.302789  0.384464  0.364677  1
  Ni  Ni116  1  0.302743  0.001570  0.395008  1
  Ni  Ni117  1  0.302720  0.767357  0.334024  1
  Ni  Ni118  1  0.552360  0.473360  0.344866  1
  Ni  Ni119  1  0.552360  0.090303  0.375091  1
  Ni  Ni120  1  0.552360  0.707626  0.405587  1
  Ni  Ni121  1  0.801931  0.384464  0.364677  1
  Ni  Ni122  1  0.801977  0.001570  0.395008  1
  Ni  Ni123  1  0.802000  0.767357  0.334024  1
  Ni  Ni124  1  0.802699  0.494792  0.382818  1
  Ni  Ni125  1  0.803068  0.260227  0.321930  1
  Ni  Ni126  1  0.802821  0.877587  0.352273  1
  Ni  Ni127  1  1.052360  0.597433  0.387398  1
  Ni  Ni128  1  1.052360  0.362895  0.326647  1
  Ni  Ni129  1  1.052360  0.980149  0.356880  1
  Ni  Ni130  1  0.302021  0.494792  0.382818  1
  Ni  Ni131  1  0.301651  0.260227  0.321930  1
  Ni  Ni132  1  0.301899  0.877587  0.352273  1
  Ni  Ni133  1  0.802711  0.154650  0.489270  1
  Ni  Ni134  1  0.802696  0.920408  0.428379  1
  Ni  Ni135  1  0.802717  0.537649  0.458867  1
  Ni  Ni136  1  1.052360  0.257281  0.493888  1
  Ni  Ni137  1  1.052360  0.023008  0.433033  1
  Ni  Ni138  1  1.052360  0.640289  0.463517  1
  Ni  Ni139  1  0.302009  0.154650  0.489270  1
  Ni  Ni140  1  0.302024  0.920408  0.428379  1
  Ni  Ni141  1  0.302003  0.537649  0.458867  1
  Ni  Ni142  1  0.302714  0.427371  0.440724  1
  Ni  Ni143  1  0.302699  0.044451  0.471169  1
  Ni  Ni144  1  0.302683  0.661749  0.501645  1
  Ni  Ni145  1  0.552360  0.516224  0.420890  1
  Ni  Ni146  1  0.552360  0.133215  0.451261  1
  Ni  Ni147  1  0.552360  0.750497  0.481745  1
  Ni  Ni148  1  0.802006  0.427371  0.440724  1
  Ni  Ni149  1  0.802021  0.044451  0.471169  1
  Ni  Ni150  1  0.802037  0.661749  0.501645  1
  Ni  Ni151  1  0.302717  0.235856  0.455911  1
  Ni  Ni152  1  0.302696  0.853097  0.486400  1
  Ni  Ni153  1  0.302711  0.618855  0.425508  1
  Ni  Ni154  1  0.552360  0.324705  0.436076  1
  Ni  Ni155  1  0.552360  0.941855  0.466513  1
  Ni  Ni156  1  0.552360  0.559109  0.496964  1
  Ni  Ni157  1  0.802003  0.235856  0.455911  1
  Ni  Ni158  1  0.802024  0.853097  0.486400  1
  Ni  Ni159  1  0.802009  0.618855  0.425508  1
  Ni  Ni160  1  0.802714  0.346134  0.474055  1
  Ni  Ni161  1  0.802683  0.111756  0.413133  1
  Ni  Ni162  1  0.802699  0.729053  0.443609  1
  Ni  Ni163  1  1.052360  0.448800  0.478702  1
  Ni  Ni164  1  1.052360  0.214396  0.417814  1
  Ni  Ni165  1  1.052360  0.831649  0.448265  1
  Ni  Ni166  1  0.302006  0.346134  0.474055  1
  Ni  Ni167  1  0.302037  0.111756  0.413133  1
  Ni  Ni168  1  0.302021  0.729053  0.443609  1
  Ni  Ni169  1  0.802720  0.006148  0.580754  1
  Ni  Ni170  1  0.802743  0.771935  0.519770  1
  Ni  Ni171  1  0.802789  0.389040  0.550101  1
  Ni  Ni172  1  1.052360  0.108666  0.585344  1
  Ni  Ni173  1  1.052360  0.874515  0.524413  1
  Ni  Ni174  1  1.052360  0.491732  0.554775  1
  Ni  Ni175  1  0.302000  0.006148  0.580754  1
  Ni  Ni176  1  0.301977  0.771935  0.519770  1
  Ni  Ni177  1  0.301931  0.389040  0.550101  1
  Ni  Ni178  1  0.302699  0.278712  0.531961  1
  Ni  Ni179  1  0.302821  0.895917  0.562505  1
  Ni  Ni180  1  0.303068  0.513278  0.592848  1
  Ni  Ni181  1  0.552360  0.367591  0.512136  1
  Ni  Ni182  1  0.552360  -0.015253  0.542687  1
  Ni  Ni183  1  0.552360  0.602061  0.573046  1
  Ni  Ni184  1  0.802021  0.278712  0.531961  1
  Ni  Ni185  1  0.801899  0.895917  0.562505  1
  Ni  Ni186  1  0.801651  0.513278  0.592848  1
  Ni  Ni187  1  0.302675  0.087290  0.547322  1
  Ni  Ni188  1  0.302932  0.704658  0.577842  1
  Ni  Ni189  1  0.302698  0.470271  0.516787  1
  Ni  Ni190  1  0.552360  0.176072  0.527381  1
  Ni  Ni191  1  0.552360  0.793356  0.557898  1
  Ni  Ni192  1  0.552360  0.410609  0.588131  1
  Ni  Ni193  1  0.802045  0.087290  0.547322  1
  Ni  Ni194  1  0.801788  0.704658  0.577842  1
  Ni  Ni195  1  0.802022  0.470271  0.516787  1
  Ni  Ni196  1  0.802831  0.197486  0.565365  1
  Ni  Ni197  1  0.802713  0.963294  0.504543  1
  Ni  Ni198  1  0.802774  0.580558  0.534955  1
  Ni  Ni199  1  1.052360  0.300145  0.569912  1
  Ni  Ni200  1  1.052360  0.065878  0.509191  1
  Ni  Ni201  1  1.052360  0.683201  0.539687  1
  Ni  Ni202  1  0.301889  0.197486  0.565365  1
  Ni  Ni203  1  0.302007  0.963294  0.504543  1
  Ni  Ni204  1  0.301946  0.580558  0.534955  1
  Ni  Ni205  1  0.803120  0.856175  0.672273  1
  Ni  Ni206  1  0.802252  0.623483  0.611063  1
  Ni  Ni207  1  0.802094  0.240996  0.641171  1
  Ni  Ni208  1  1.052360  0.959995  0.675867  1
  Ni  Ni209  1  1.052360  0.726324  0.615786  1
  Ni  Ni210  1  1.052360  0.343114  0.645642  1
  Ni  Ni211  1  0.301600  0.856175  0.672273  1
  Ni  Ni212  1  0.302468  0.623483  0.611063  1
  Ni  Ni213  1  0.302626  0.240996  0.641171  1
  Ni  Ni214  1  0.303157  0.130367  0.623355  1
  Ni  Ni215  1  0.301275  0.746468  0.654831  1
  Ni  Ni216  1  0.300836  0.365352  0.684482  1
  Ni  Ni217  1  0.552360  0.219019  0.603381  1
  Ni  Ni218  1  0.552360  0.835537  0.634039  1
  Ni  Ni219  1  0.552360  0.453740  0.664391  1
  Ni  Ni220  1  0.801563  0.130367  0.623355  1
  Ni  Ni221  1  0.803445  0.746468  0.654831  1
  Ni  Ni222  1  0.803884  0.365352  0.684482  1
  Ni  Ni223  1  0.302556  0.938247  0.638201  1
  Ni  Ni224  1  0.300859  0.556342  0.669773  1
  Ni  Ni225  1  0.303053  0.321806  0.607887  1
  Ni  Ni226  1  0.552360  0.027537  0.618833  1
  Ni  Ni227  1  0.552360  0.644287  0.649414  1
  Ni  Ni228  1  0.552360  0.262183  0.679763  1
  Ni  Ni229  1  0.802164  0.938247  0.638201  1
  Ni  Ni230  1  0.803861  0.556342  0.669773  1
  Ni  Ni231  1  0.801667  0.321806  0.607887  1
  Ni  Ni232  1  0.801241  0.049773  0.657048  1
  Ni  Ni233  1  0.802420  0.814729  0.595948  1
  Ni  Ni234  1  0.802138  0.432140  0.626088  1
  Ni  Ni235  1  1.052360  0.151254  0.661440  1
  Ni  Ni236  1  1.052360  0.917310  0.600367  1
  Ni  Ni237  1  1.052360  0.534654  0.630653  1
  Ni  Ni238  1  0.303479  0.049773  0.657048  1
  Ni  Ni239  1  0.302300  0.814729  0.595948  1
  Ni  Ni240  1  0.302581  0.432140  0.626088  1
