# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.71356536
_cell_length_b   19.27721338
_cell_length_c   49.75970774
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Ni5
_chemical_formula_sum   'Al108 Ni180'
_cell_volume   7399.07175934
_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
  Al  Al1  1  0.488622  0.993908  0.330928  1
  Al  Al2  1  0.488622  0.616474  0.301531  1
  Al  Al3  1  0.488622  0.262143  0.280927  1
  Al  Al4  1  0.774756  0.962107  0.293265  1
  Al  Al5  1  0.760165  0.676418  0.342665  1
  Al  Al6  1  0.763003  0.316692  0.316441  1
  Al  Al7  1  0.202489  0.962107  0.293265  1
  Al  Al8  1  0.217079  0.676418  0.342665  1
  Al  Al9  1  0.214241  0.316692  0.316441  1
  Al  Al10  1  -0.011378  0.762143  0.280927  1
  Al  Al11  1  -0.011378  0.493908  0.330928  1
  Al  Al12  1  -0.011378  0.116474  0.301531  1
  Al  Al13  1  0.263003  0.816692  0.316441  1
  Al  Al14  1  0.274756  0.462107  0.293265  1
  Al  Al15  1  0.260165  0.176418  0.342665  1
  Al  Al16  1  0.714241  0.816692  0.316441  1
  Al  Al17  1  0.702489  0.462107  0.293265  1
  Al  Al18  1  0.717079  0.176418  0.342665  1
  Al  Al19  1  0.488622  0.074548  0.401569  1
  Al  Al20  1  0.488622  0.715009  0.376925  1
  Al  Al21  1  0.488622  0.355820  0.353664  1
  Al  Al22  1  0.760159  0.035274  0.365752  1
  Al  Al23  1  0.758808  0.755886  0.412498  1
  Al  Al24  1  0.758695  0.395716  0.388835  1
  Al  Al25  1  0.217086  0.035274  0.365752  1
  Al  Al26  1  0.218437  0.755886  0.412498  1
  Al  Al27  1  0.218549  0.395716  0.388835  1
  Al  Al28  1  -0.011378  0.855820  0.353664  1
  Al  Al29  1  -0.011378  0.574548  0.401569  1
  Al  Al30  1  -0.011378  0.215009  0.376925  1
  Al  Al31  1  0.258695  0.895716  0.388835  1
  Al  Al32  1  0.260159  0.535274  0.365752  1
  Al  Al33  1  0.258808  0.255886  0.412498  1
  Al  Al34  1  0.718549  0.895716  0.388835  1
  Al  Al35  1  0.717086  0.535274  0.365752  1
  Al  Al36  1  0.718437  0.255886  0.412498  1
  Al  Al37  1  0.488622  0.156056  0.472309  1
  Al  Al38  1  0.488622  0.796195  0.448142  1
  Al  Al39  1  0.488622  0.435607  0.424844  1
  Al  Al40  1  0.759743  0.115468  0.436815  1
  Al  Al41  1  0.759601  0.835149  0.484465  1
  Al  Al42  1  0.759534  0.475129  0.460680  1
  Al  Al43  1  0.217502  0.115468  0.436815  1
  Al  Al44  1  0.217644  0.835149  0.484465  1
  Al  Al45  1  0.217710  0.475129  0.460680  1
  Al  Al46  1  -0.011378  0.935607  0.424844  1
  Al  Al47  1  -0.011378  0.656056  0.472309  1
  Al  Al48  1  -0.011378  0.296195  0.448142  1
  Al  Al49  1  0.259534  0.975129  0.460680  1
  Al  Al50  1  0.259743  0.615468  0.436815  1
  Al  Al51  1  0.259601  0.335149  0.484465  1
  Al  Al52  1  0.717710  0.975129  0.460680  1
  Al  Al53  1  0.717502  0.615468  0.436815  1
  Al  Al54  1  0.717644  0.335149  0.484465  1
  Al  Al55  1  0.488622  0.234236  0.544427  1
  Al  Al56  1  0.488622  0.873991  0.520416  1
  Al  Al57  1  0.488622  0.515054  0.496290  1
  Al  Al58  1  0.759527  0.195367  0.508060  1
  Al  Al59  1  0.759494  0.914938  0.555788  1
  Al  Al60  1  0.759302  0.555380  0.531755  1
  Al  Al61  1  0.217717  0.195367  0.508060  1
  Al  Al62  1  0.217750  0.914938  0.555788  1
  Al  Al63  1  0.217943  0.555380  0.531755  1
  Al  Al64  1  -0.011378  1.015054  0.496290  1
  Al  Al65  1  -0.011378  0.734236  0.544427  1
  Al  Al66  1  -0.011378  0.373991  0.520416  1
  Al  Al67  1  0.259302  0.055380  0.531755  1
  Al  Al68  1  0.259527  0.695367  0.508060  1
  Al  Al69  1  0.259494  0.414938  0.555788  1
  Al  Al70  1  0.717943  0.055380  0.531755  1
  Al  Al71  1  0.717717  0.695367  0.508060  1
  Al  Al72  1  0.717750  0.414938  0.555788  1
  Al  Al73  1  0.488622  0.315444  0.615753  1
  Al  Al74  1  0.488622  0.956688  0.590616  1
  Al  Al75  1  0.488622  0.595309  0.567500  1
  Al  Al76  1  0.758599  0.274476  0.580156  1
  Al  Al77  1  0.761022  0.995185  0.626385  1
  Al  Al78  1  0.758635  0.634981  0.603582  1
  Al  Al79  1  0.218646  0.274476  0.580156  1
  Al  Al80  1  0.216223  0.995185  0.626385  1
  Al  Al81  1  0.218610  0.634981  0.603582  1
  Al  Al82  1  -0.011378  0.095309  0.567500  1
  Al  Al83  1  -0.011378  0.815444  0.615753  1
  Al  Al84  1  -0.011378  0.456688  0.590616  1
  Al  Al85  1  0.258635  0.134981  0.603582  1
  Al  Al86  1  0.258599  0.774476  0.580156  1
  Al  Al87  1  0.261022  0.495185  0.626385  1
  Al  Al88  1  0.718610  0.134981  0.603582  1
  Al  Al89  1  0.718646  0.774476  0.580156  1
  Al  Al90  1  0.716223  0.495185  0.626385  1
  Al  Al91  1  0.488622  0.417623  0.690849  1
  Al  Al92  1  0.488622  0.036943  0.661306  1
  Al  Al93  1  0.488622  0.677142  0.638847  1
  Al  Al94  1  0.762245  0.353349  0.649901  1
  Al  Al95  1  0.775936  0.067258  0.698874  1
  Al  Al96  1  0.766761  0.713062  0.676287  1
  Al  Al97  1  0.215000  0.353349  0.649901  1
  Al  Al98  1  0.201309  0.067258  0.698874  1
  Al  Al99  1  0.210483  0.713062  0.676287  1
  Al  Al100  1  -0.011378  0.177142  0.638847  1
  Al  Al101  1  -0.011378  0.917623  0.690849  1
  Al  Al102  1  -0.011378  0.536943  0.661306  1
  Al  Al103  1  0.266761  0.213062  0.676287  1
  Al  Al104  1  0.262245  0.853349  0.649901  1
  Al  Al105  1  0.275936  0.567258  0.698874  1
  Al  Al106  1  0.710483  0.213062  0.676287  1
  Al  Al107  1  0.715000  0.853349  0.649901  1
  Al  Al108  1  0.701309  0.567258  0.698874  1
  Ni  Ni109  1  0.488622  0.779126  0.283060  1
  Ni  Ni110  1  0.488622  0.497759  0.329185  1
  Ni  Ni111  1  0.488622  0.140711  0.307622  1
  Ni  Ni112  1  0.251505  0.698882  0.295478  1
  Ni  Ni113  1  0.241070  0.425619  0.340928  1
  Ni  Ni114  1  0.248103  0.067257  0.318992  1
  Ni  Ni115  1  0.725739  0.698882  0.295478  1
  Ni  Ni116  1  0.736175  0.425619  0.340928  1
  Ni  Ni117  1  0.729142  0.067257  0.318992  1
  Ni  Ni118  1  0.488622  0.734161  0.329869  1
  Ni  Ni119  1  0.488622  0.376565  0.306818  1
  Ni  Ni120  1  0.488622  0.026278  0.284768  1
  Ni  Ni121  1  0.488622  0.898216  0.302478  1
  Ni  Ni122  1  0.488622  0.611496  0.351537  1
  Ni  Ni123  1  0.488622  0.253921  0.328827  1
  Ni  Ni124  1  -0.011378  0.997759  0.329185  1
  Ni  Ni125  1  -0.011378  0.640711  0.307622  1
  Ni  Ni126  1  -0.011378  0.279126  0.283060  1
  Ni  Ni127  1  0.741070  0.925619  0.340928  1
  Ni  Ni128  1  0.748103  0.567257  0.318992  1
  Ni  Ni129  1  0.751505  0.198882  0.295478  1
  Ni  Ni130  1  0.236175  0.925619  0.340928  1
  Ni  Ni131  1  0.229142  0.567257  0.318992  1
  Ni  Ni132  1  0.225739  0.198882  0.295478  1
  Ni  Ni133  1  -0.011378  0.876565  0.306818  1
  Ni  Ni134  1  -0.011378  0.526278  0.284768  1
  Ni  Ni135  1  -0.011378  0.234161  0.329869  1
  Ni  Ni136  1  -0.011378  0.753921  0.328827  1
  Ni  Ni137  1  -0.011378  0.398216  0.302478  1
  Ni  Ni138  1  -0.011378  0.111496  0.351537  1
  Ni  Ni139  1  0.488622  0.856330  0.351724  1
  Ni  Ni140  1  0.488622  0.575479  0.400847  1
  Ni  Ni141  1  0.488622  0.217137  0.377245  1
  Ni  Ni142  1  0.240765  0.786961  0.364595  1
  Ni  Ni143  1  0.239016  0.505111  0.413179  1
  Ni  Ni144  1  0.239603  0.145151  0.389508  1
  Ni  Ni145  1  0.736479  0.786961  0.364595  1
  Ni  Ni146  1  0.738228  0.505111  0.413179  1
  Ni  Ni147  1  0.737641  0.145151  0.389508  1
  Ni  Ni148  1  0.488622  0.820452  0.401154  1
  Ni  Ni149  1  0.488622  0.459831  0.377997  1
  Ni  Ni150  1  0.488622  0.099390  0.355397  1
  Ni  Ni151  1  0.488622  0.970243  0.376768  1
  Ni  Ni152  1  0.488622  0.691489  0.423629  1
  Ni  Ni153  1  0.488622  0.331703  0.400166  1
  Ni  Ni154  1  -0.011378  0.075479  0.400847  1
  Ni  Ni155  1  -0.011378  0.717137  0.377245  1
  Ni  Ni156  1  -0.011378  0.356330  0.351724  1
  Ni  Ni157  1  0.739016  1.005111  0.413179  1
  Ni  Ni158  1  0.739603  0.645151  0.389508  1
  Ni  Ni159  1  0.740765  0.286961  0.364595  1
  Ni  Ni160  1  0.238228  1.005111  0.413179  1
  Ni  Ni161  1  0.237641  0.645151  0.389508  1
  Ni  Ni162  1  0.236479  0.286961  0.364595  1
  Ni  Ni163  1  -0.011378  0.959831  0.377997  1
  Ni  Ni164  1  -0.011378  0.599390  0.355397  1
  Ni  Ni165  1  -0.011378  0.320452  0.401154  1
  Ni  Ni166  1  -0.011378  0.831703  0.400166  1
  Ni  Ni167  1  -0.011378  0.470243  0.376768  1
  Ni  Ni168  1  -0.011378  0.191489  0.423629  1
  Ni  Ni169  1  0.488622  0.934882  0.425063  1
  Ni  Ni170  1  0.488622  0.655349  0.472259  1
  Ni  Ni171  1  0.488622  0.295214  0.448753  1
  Ni  Ni172  1  0.237809  0.865409  0.436668  1
  Ni  Ni173  1  0.238605  0.585459  0.484285  1
  Ni  Ni174  1  0.237848  0.225829  0.460324  1
  Ni  Ni175  1  0.739436  0.865409  0.436668  1
  Ni  Ni176  1  0.738640  0.585459  0.484285  1
  Ni  Ni177  1  0.739396  0.225829  0.460324  1
  Ni  Ni178  1  0.488622  0.899226  0.473685  1
  Ni  Ni179  1  0.488622  0.539467  0.449675  1
  Ni  Ni180  1  0.488622  0.180080  0.425712  1
  Ni  Ni181  1  0.488622  0.051135  0.447885  1
  Ni  Ni182  1  0.488622  0.770960  0.494997  1
  Ni  Ni183  1  0.488622  0.410902  0.471517  1
  Ni  Ni184  1  -0.011378  0.155349  0.472259  1
  Ni  Ni185  1  -0.011378  0.795214  0.448753  1
  Ni  Ni186  1  -0.011378  0.434882  0.425063  1
  Ni  Ni187  1  0.738605  0.085459  0.484285  1
  Ni  Ni188  1  0.737848  0.725829  0.460324  1
  Ni  Ni189  1  0.737809  0.365409  0.436668  1
  Ni  Ni190  1  0.238640  0.085459  0.484285  1
  Ni  Ni191  1  0.239396  0.725829  0.460324  1
  Ni  Ni192  1  0.239436  0.365409  0.436668  1
  Ni  Ni193  1  -0.011378  0.039467  0.449675  1
  Ni  Ni194  1  -0.011378  0.680080  0.425712  1
  Ni  Ni195  1  -0.011378  0.399226  0.473685  1
  Ni  Ni196  1  -0.011378  0.910902  0.471517  1
  Ni  Ni197  1  -0.011378  0.551135  0.447885  1
  Ni  Ni198  1  -0.011378  0.270960  0.494997  1
  Ni  Ni199  1  0.488622  1.015398  0.496172  1
  Ni  Ni200  1  0.488622  0.735375  0.543773  1
  Ni  Ni201  1  0.488622  0.375297  0.520244  1
  Ni  Ni202  1  0.239215  0.944938  0.508231  1
  Ni  Ni203  1  0.239326  0.665177  0.555795  1
  Ni  Ni204  1  0.239760  0.304587  0.532263  1
  Ni  Ni205  1  0.738030  0.944938  0.508231  1
  Ni  Ni206  1  0.737918  0.665177  0.555795  1
  Ni  Ni207  1  0.737485  0.304587  0.532263  1
  Ni  Ni208  1  0.488622  0.979457  0.544416  1
  Ni  Ni209  1  0.488622  0.619632  0.520892  1
  Ni  Ni210  1  0.488622  0.259518  0.497549  1
  Ni  Ni211  1  0.488622  0.131211  0.518901  1
  Ni  Ni212  1  0.488622  0.850022  0.567211  1
  Ni  Ni213  1  0.488622  0.490951  0.542906  1
  Ni  Ni214  1  -0.011378  0.235375  0.543773  1
  Ni  Ni215  1  -0.011378  0.875297  0.520244  1
  Ni  Ni216  1  -0.011378  0.515398  0.496172  1
  Ni  Ni217  1  0.739326  0.165177  0.555795  1
  Ni  Ni218  1  0.739760  0.804587  0.532263  1
  Ni  Ni219  1  0.739215  0.444938  0.508231  1
  Ni  Ni220  1  0.237918  0.165177  0.555795  1
  Ni  Ni221  1  0.237485  0.804587  0.532263  1
  Ni  Ni222  1  0.238030  0.444938  0.508231  1
  Ni  Ni223  1  -0.011378  0.119632  0.520892  1
  Ni  Ni224  1  -0.011378  0.759518  0.497549  1
  Ni  Ni225  1  -0.011378  0.479457  0.544416  1
  Ni  Ni226  1  -0.011378  0.990951  0.542906  1
  Ni  Ni227  1  -0.011378  0.631211  0.518901  1
  Ni  Ni228  1  -0.011378  0.350022  0.567211  1
  Ni  Ni229  1  0.488622  0.095629  0.567388  1
  Ni  Ni230  1  0.488622  0.811790  0.616241  1
  Ni  Ni231  1  0.488622  0.454778  0.591742  1
  Ni  Ni232  1  0.237508  1.025735  0.579157  1
  Ni  Ni233  1  0.234837  0.743282  0.628012  1
  Ni  Ni234  1  0.236435  0.384872  0.603126  1
  Ni  Ni235  1  0.739737  1.025735  0.579157  1
  Ni  Ni236  1  0.742408  0.743282  0.628012  1
  Ni  Ni237  1  0.740810  0.384872  0.603126  1
  Ni  Ni238  1  0.488622  0.060580  0.615584  1
  Ni  Ni239  1  0.488622  0.698993  0.592291  1
  Ni  Ni240  1  0.488622  0.338943  0.568945  1
  Ni  Ni241  1  0.488622  0.210017  0.591467  1
  Ni  Ni242  1  0.488622  0.931634  0.636618  1
  Ni  Ni243  1  0.488622  0.571773  0.614367  1
  Ni  Ni244  1  -0.011378  0.311790  0.616241  1
  Ni  Ni245  1  -0.011378  0.954778  0.591742  1
  Ni  Ni246  1  -0.011378  0.595629  0.567388  1
  Ni  Ni247  1  0.734837  0.243282  0.628012  1
  Ni  Ni248  1  0.736435  0.884872  0.603126  1
  Ni  Ni249  1  0.737508  0.525735  0.579157  1
  Ni  Ni250  1  0.242408  0.243282  0.628012  1
  Ni  Ni251  1  0.240810  0.884872  0.603126  1
  Ni  Ni252  1  0.239737  0.525735  0.579157  1
  Ni  Ni253  1  -0.011378  0.198993  0.592291  1
  Ni  Ni254  1  -0.011378  0.838943  0.568945  1
  Ni  Ni255  1  -0.011378  0.560580  0.615584  1
  Ni  Ni256  1  -0.011378  0.071773  0.614367  1
  Ni  Ni257  1  -0.011378  0.710017  0.591467  1
  Ni  Ni258  1  -0.011378  0.431634  0.636618  1
  Ni  Ni259  1  0.488622  0.173896  0.641039  1
  Ni  Ni260  1  0.488622  0.892160  0.684374  1
  Ni  Ni261  1  0.488622  0.532653  0.662732  1
  Ni  Ni262  1  0.235152  0.104828  0.651196  1
  Ni  Ni263  1  0.226839  0.830497  0.696888  1
  Ni  Ni264  1  0.229083  0.463560  0.672858  1
  Ni  Ni265  1  0.742093  0.104828  0.651196  1
  Ni  Ni266  1  0.750406  0.830497  0.696888  1
  Ni  Ni267  1  0.748162  0.463560  0.672858  1
  Ni  Ni268  1  0.488622  0.132057  0.690329  1
  Ni  Ni269  1  0.488622  0.775863  0.666584  1
  Ni  Ni270  1  0.488622  0.418325  0.640995  1
  Ni  Ni271  1  0.488622  0.296675  0.663307  1
  Ni  Ni272  1  0.488622  1.005029  0.707499  1
  Ni  Ni273  1  0.488622  0.652705  0.685225  1
  Ni  Ni274  1  -0.011378  0.392160  0.684374  1
  Ni  Ni275  1  -0.011378  0.032653  0.662732  1
  Ni  Ni276  1  -0.011378  0.673896  0.641039  1
  Ni  Ni277  1  0.726839  0.330497  0.696888  1
  Ni  Ni278  1  0.729083  0.963560  0.672858  1
  Ni  Ni279  1  0.735152  0.604828  0.651196  1
  Ni  Ni280  1  0.250406  0.330497  0.696888  1
  Ni  Ni281  1  0.248162  0.963560  0.672858  1
  Ni  Ni282  1  0.242093  0.604828  0.651196  1
  Ni  Ni283  1  -0.011378  0.275863  0.666584  1
  Ni  Ni284  1  -0.011378  0.918325  0.640995  1
  Ni  Ni285  1  -0.011378  0.632057  0.690329  1
  Ni  Ni286  1  -0.011378  0.152705  0.685225  1
  Ni  Ni287  1  -0.011378  0.796675  0.663307  1
  Ni  Ni288  1  -0.011378  0.505029  0.707499  1
