# generated using pymatgen
data_Ti144Al143
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   16.56454723
_cell_length_b   16.56454723
_cell_length_c   16.61678570
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti144Al143
_chemical_formula_sum   'Ti144 Al143'
_cell_volume   4559.38386466
_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
  Ti  Ti1  1  0.000886  0.000886  0.125093  1
  Ti  Ti2  1  1.000152  1.000152  0.375030  1
  Ti  Ti3  1  1.000152  1.000152  0.624470  1
  Ti  Ti4  1  0.000886  0.000886  0.874407  1
  Ti  Ti5  1  0.000886  0.166330  0.125093  1
  Ti  Ti6  1  1.000152  0.167064  0.375030  1
  Ti  Ti7  1  1.000152  0.167064  0.624470  1
  Ti  Ti8  1  0.000886  0.166330  0.874407  1
  Ti  Ti9  1  0.000518  0.333160  0.124535  1
  Ti  Ti10  1  1.000203  0.333736  0.374816  1
  Ti  Ti11  1  1.000203  0.333736  0.624684  1
  Ti  Ti12  1  0.000518  0.333160  0.874965  1
  Ti  Ti13  1  0.000335  0.500133  0.124620  1
  Ti  Ti14  1  0.000277  0.500303  0.374664  1
  Ti  Ti15  1  0.000277  0.500303  0.624836  1
  Ti  Ti16  1  0.000335  0.500133  0.874881  1
  Ti  Ti17  1  0.000335  0.667083  0.124620  1
  Ti  Ti18  1  0.000277  0.666913  0.374664  1
  Ti  Ti19  1  0.000277  0.666913  0.624836  1
  Ti  Ti20  1  0.000335  0.667083  0.874881  1
  Ti  Ti21  1  0.000518  0.834056  0.124535  1
  Ti  Ti22  1  1.000203  0.833480  0.374816  1
  Ti  Ti23  1  1.000203  0.833480  0.624684  1
  Ti  Ti24  1  0.000518  0.834056  0.874965  1
  Ti  Ti25  1  0.166330  0.000886  0.125093  1
  Ti  Ti26  1  0.167064  1.000152  0.375030  1
  Ti  Ti27  1  0.167064  1.000152  0.624470  1
  Ti  Ti28  1  0.166330  0.000886  0.874407  1
  Ti  Ti29  1  0.166330  0.166330  0.125093  1
  Ti  Ti30  1  0.167064  0.167064  0.375030  1
  Ti  Ti31  1  0.167064  0.167064  0.624470  1
  Ti  Ti32  1  0.166330  0.166330  0.874407  1
  Ti  Ti33  1  0.166698  0.333160  0.124535  1
  Ti  Ti34  1  0.167013  0.333736  0.374816  1
  Ti  Ti35  1  0.167013  0.333736  0.624684  1
  Ti  Ti36  1  0.166698  0.333160  0.874965  1
  Ti  Ti37  1  0.166881  0.500133  0.124620  1
  Ti  Ti38  1  0.166939  0.500303  0.374664  1
  Ti  Ti39  1  0.166939  0.500303  0.624836  1
  Ti  Ti40  1  0.166881  0.500133  0.874881  1
  Ti  Ti41  1  0.166881  0.667083  0.124620  1
  Ti  Ti42  1  0.166939  0.666913  0.374664  1
  Ti  Ti43  1  0.166939  0.666913  0.624836  1
  Ti  Ti44  1  0.166881  0.667083  0.874881  1
  Ti  Ti45  1  0.166698  0.834056  0.124535  1
  Ti  Ti46  1  0.167013  0.833480  0.374816  1
  Ti  Ti47  1  0.167013  0.833480  0.624684  1
  Ti  Ti48  1  0.166698  0.834056  0.874965  1
  Ti  Ti49  1  0.333160  0.000518  0.124535  1
  Ti  Ti50  1  0.333736  1.000203  0.374816  1
  Ti  Ti51  1  0.333736  1.000203  0.624684  1
  Ti  Ti52  1  0.333160  0.000518  0.874965  1
  Ti  Ti53  1  0.333160  0.166698  0.124535  1
  Ti  Ti54  1  0.333736  0.167013  0.374816  1
  Ti  Ti55  1  0.333736  0.167013  0.624684  1
  Ti  Ti56  1  0.333160  0.166698  0.874965  1
  Ti  Ti57  1  0.333457  0.333457  0.124686  1
  Ti  Ti58  1  0.333625  0.333625  0.374652  1
  Ti  Ti59  1  0.333625  0.333625  0.624849  1
  Ti  Ti60  1  0.333457  0.333457  0.874814  1
  Ti  Ti61  1  0.333557  0.500223  0.124688  1
  Ti  Ti62  1  0.333579  0.500272  0.374648  1
  Ti  Ti63  1  0.333579  0.500272  0.624852  1
  Ti  Ti64  1  0.333557  0.500223  0.874812  1
  Ti  Ti65  1  0.333557  0.666993  0.124688  1
  Ti  Ti66  1  0.333579  0.666944  0.374648  1
  Ti  Ti67  1  0.333579  0.666944  0.624852  1
  Ti  Ti68  1  0.333557  0.666993  0.874812  1
  Ti  Ti69  1  0.333457  0.833759  0.124686  1
  Ti  Ti70  1  0.333625  0.833591  0.374652  1
  Ti  Ti71  1  0.333625  0.833591  0.624849  1
  Ti  Ti72  1  0.333457  0.833759  0.874814  1
  Ti  Ti73  1  0.500133  0.000335  0.124620  1
  Ti  Ti74  1  0.500303  0.000277  0.374664  1
  Ti  Ti75  1  0.500303  0.000277  0.624836  1
  Ti  Ti76  1  0.500133  0.000335  0.874881  1
  Ti  Ti77  1  0.500133  0.166881  0.124620  1
  Ti  Ti78  1  0.500303  0.166939  0.374664  1
  Ti  Ti79  1  0.500303  0.166939  0.624836  1
  Ti  Ti80  1  0.500133  0.166881  0.874881  1
  Ti  Ti81  1  0.500223  0.333557  0.124688  1
  Ti  Ti82  1  0.500272  0.333579  0.374648  1
  Ti  Ti83  1  0.500272  0.333579  0.624852  1
  Ti  Ti84  1  0.500223  0.333557  0.874812  1
  Ti  Ti85  1  0.500257  0.500257  0.124707  1
  Ti  Ti86  1  0.500260  0.500260  0.374710  1
  Ti  Ti87  1  0.500260  0.500260  0.624790  1
  Ti  Ti88  1  0.500257  0.500257  0.874793  1
  Ti  Ti89  1  0.500257  0.666959  0.124707  1
  Ti  Ti90  1  0.500260  0.666956  0.374710  1
  Ti  Ti91  1  0.500260  0.666956  0.624790  1
  Ti  Ti92  1  0.500257  0.666959  0.874793  1
  Ti  Ti93  1  0.500223  0.833659  0.124688  1
  Ti  Ti94  1  0.500272  0.833637  0.374648  1
  Ti  Ti95  1  0.500272  0.833637  0.624852  1
  Ti  Ti96  1  0.500223  0.833659  0.874812  1
  Ti  Ti97  1  0.667083  0.000335  0.124620  1
  Ti  Ti98  1  0.666913  0.000277  0.374664  1
  Ti  Ti99  1  0.666913  0.000277  0.624836  1
  Ti  Ti100  1  0.667083  0.000335  0.874881  1
  Ti  Ti101  1  0.667083  0.166881  0.124620  1
  Ti  Ti102  1  0.666913  0.166939  0.374664  1
  Ti  Ti103  1  0.666913  0.166939  0.624836  1
  Ti  Ti104  1  0.667083  0.166881  0.874881  1
  Ti  Ti105  1  0.666993  0.333557  0.124688  1
  Ti  Ti106  1  0.666944  0.333579  0.374648  1
  Ti  Ti107  1  0.666944  0.333579  0.624852  1
  Ti  Ti108  1  0.666993  0.333557  0.874812  1
  Ti  Ti109  1  0.666959  0.500257  0.124707  1
  Ti  Ti110  1  0.666956  0.500260  0.374710  1
  Ti  Ti111  1  0.666956  0.500260  0.624790  1
  Ti  Ti112  1  0.666959  0.500257  0.874793  1
  Ti  Ti113  1  0.666959  0.666959  0.124707  1
  Ti  Ti114  1  0.666956  0.666956  0.374710  1
  Ti  Ti115  1  0.666956  0.666956  0.624790  1
  Ti  Ti116  1  0.666959  0.666959  0.874793  1
  Ti  Ti117  1  0.666993  0.833659  0.124688  1
  Ti  Ti118  1  0.666944  0.833637  0.374648  1
  Ti  Ti119  1  0.666944  0.833637  0.624852  1
  Ti  Ti120  1  0.666993  0.833659  0.874812  1
  Ti  Ti121  1  0.834056  0.000518  0.124535  1
  Ti  Ti122  1  0.833480  1.000203  0.374816  1
  Ti  Ti123  1  0.833480  1.000203  0.624684  1
  Ti  Ti124  1  0.834056  0.000518  0.874965  1
  Ti  Ti125  1  0.834056  0.166698  0.124535  1
  Ti  Ti126  1  0.833480  0.167013  0.374816  1
  Ti  Ti127  1  0.833480  0.167013  0.624684  1
  Ti  Ti128  1  0.834056  0.166698  0.874965  1
  Ti  Ti129  1  0.833759  0.333457  0.124686  1
  Ti  Ti130  1  0.833591  0.333625  0.374652  1
  Ti  Ti131  1  0.833591  0.333625  0.624849  1
  Ti  Ti132  1  0.833759  0.333457  0.874814  1
  Ti  Ti133  1  0.833659  0.500223  0.124688  1
  Ti  Ti134  1  0.833637  0.500272  0.374648  1
  Ti  Ti135  1  0.833637  0.500272  0.624852  1
  Ti  Ti136  1  0.833659  0.500223  0.874812  1
  Ti  Ti137  1  0.833659  0.666993  0.124688  1
  Ti  Ti138  1  0.833637  0.666944  0.374648  1
  Ti  Ti139  1  0.833637  0.666944  0.624852  1
  Ti  Ti140  1  0.833659  0.666993  0.874812  1
  Ti  Ti141  1  0.833759  0.833759  0.124686  1
  Ti  Ti142  1  0.833591  0.833591  0.374652  1
  Ti  Ti143  1  0.833591  0.833591  0.624849  1
  Ti  Ti144  1  0.833759  0.833759  0.874814  1
  Al  Al145  1  0.083608  0.083608  0.250704  1
  Al  Al146  1  0.083608  0.083608  0.499750  1
  Al  Al147  1  0.083608  0.083608  0.748797  1
  Al  Al148  1  0.083608  0.246716  -0.000250  1
  Al  Al149  1  0.083608  0.250416  0.250159  1
  Al  Al150  1  0.083608  0.250470  0.499750  1
  Al  Al151  1  0.083608  0.250416  0.749341  1
  Al  Al152  1  0.083608  0.416241  -0.000250  1
  Al  Al153  1  0.083608  0.416858  0.249654  1
  Al  Al154  1  0.083608  0.417079  0.499750  1
  Al  Al155  1  0.083608  0.416858  0.749846  1
  Al  Al156  1  0.083608  0.583608  -0.000250  1
  Al  Al157  1  0.083608  0.583608  0.249604  1
  Al  Al158  1  0.083608  0.583608  0.499750  1
  Al  Al159  1  0.083608  0.583608  0.749896  1
  Al  Al160  1  0.083608  0.750975  -0.000250  1
  Al  Al161  1  0.083608  0.750358  0.249654  1
  Al  Al162  1  0.083608  0.750136  0.499750  1
  Al  Al163  1  0.083608  0.750358  0.749846  1
  Al  Al164  1  0.083608  0.920500  -0.000250  1
  Al  Al165  1  0.083608  0.916800  0.250159  1
  Al  Al166  1  0.083608  0.916746  0.499750  1
  Al  Al167  1  0.083608  0.916800  0.749341  1
  Al  Al168  1  0.246716  0.083608  -0.000250  1
  Al  Al169  1  0.250416  0.083608  0.250159  1
  Al  Al170  1  0.250470  0.083608  0.499750  1
  Al  Al171  1  0.250416  0.083608  0.749341  1
  Al  Al172  1  0.249986  0.249986  -0.000250  1
  Al  Al173  1  0.250136  0.250136  0.249696  1
  Al  Al174  1  0.250435  0.250435  0.499750  1
  Al  Al175  1  0.250136  0.250136  0.749804  1
  Al  Al176  1  0.250177  0.416746  -0.000250  1
  Al  Al177  1  0.250168  0.416828  0.249601  1
  Al  Al178  1  0.250346  0.417046  0.499750  1
  Al  Al179  1  0.250168  0.416828  0.749899  1
  Al  Al180  1  0.250228  0.583608  -0.000250  1
  Al  Al181  1  0.250215  0.583608  0.249611  1
  Al  Al182  1  0.250277  0.583608  0.499750  1
  Al  Al183  1  0.250215  0.583608  0.749889  1
  Al  Al184  1  0.250177  0.750470  -0.000250  1
  Al  Al185  1  0.250168  0.750388  0.249601  1
  Al  Al186  1  0.250346  0.750170  0.499750  1
  Al  Al187  1  0.250168  0.750388  0.749899  1
  Al  Al188  1  0.249986  0.917230  -0.000250  1
  Al  Al189  1  0.250136  0.917080  0.249696  1
  Al  Al190  1  0.250435  0.916781  0.499750  1
  Al  Al191  1  0.250136  0.917080  0.749804  1
  Al  Al192  1  0.416241  0.083608  -0.000250  1
  Al  Al193  1  0.416858  0.083608  0.249654  1
  Al  Al194  1  0.417079  0.083608  0.499750  1
  Al  Al195  1  0.416858  0.083608  0.749846  1
  Al  Al196  1  0.416746  0.250177  -0.000250  1
  Al  Al197  1  0.416828  0.250168  0.249601  1
  Al  Al198  1  0.417046  0.250346  0.499750  1
  Al  Al199  1  0.416828  0.250168  0.749899  1
  Al  Al200  1  0.416869  0.416869  -0.000250  1
  Al  Al201  1  0.416898  0.416898  0.249656  1
  Al  Al202  1  0.416943  0.416943  0.499750  1
  Al  Al203  1  0.416898  0.416898  0.749845  1
  Al  Al204  1  0.416905  0.583608  -0.000250  1
  Al  Al205  1  0.416918  0.583608  0.249677  1
  Al  Al206  1  0.416901  0.583608  0.499750  1
  Al  Al207  1  0.416918  0.583608  0.749823  1
  Al  Al208  1  0.416869  0.750347  -0.000250  1
  Al  Al209  1  0.416898  0.750318  0.249656  1
  Al  Al210  1  0.416943  0.750273  0.499750  1
  Al  Al211  1  0.416898  0.750318  0.749845  1
  Al  Al212  1  0.416746  0.917039  -0.000250  1
  Al  Al213  1  0.416828  0.917048  0.249601  1
  Al  Al214  1  0.417046  0.916870  0.499750  1
  Al  Al215  1  0.416828  0.917048  0.749899  1
  Al  Al216  1  0.583608  0.083608  -0.000250  1
  Al  Al217  1  0.583608  0.083608  0.249604  1
  Al  Al218  1  0.583608  0.083608  0.499750  1
  Al  Al219  1  0.583608  0.083608  0.749896  1
  Al  Al220  1  0.583608  0.250228  -0.000250  1
  Al  Al221  1  0.583608  0.250215  0.249611  1
  Al  Al222  1  0.583608  0.250277  0.499750  1
  Al  Al223  1  0.583608  0.250215  0.749889  1
  Al  Al224  1  0.583608  0.416905  -0.000250  1
  Al  Al225  1  0.583608  0.416918  0.249677  1
  Al  Al226  1  0.583608  0.416901  0.499750  1
  Al  Al227  1  0.583608  0.416918  0.749823  1
  Al  Al228  1  0.583608  0.583608  -0.000250  1
  Al  Al229  1  0.583608  0.583608  0.249707  1
  Al  Al230  1  0.583608  0.583608  0.499750  1
  Al  Al231  1  0.583608  0.583608  0.749793  1
  Al  Al232  1  0.583608  0.750311  -0.000250  1
  Al  Al233  1  0.583608  0.750298  0.249677  1
  Al  Al234  1  0.583608  0.750314  0.499750  1
  Al  Al235  1  0.583608  0.750298  0.749823  1
  Al  Al236  1  0.583608  0.916988  -0.000250  1
  Al  Al237  1  0.583608  0.917001  0.249611  1
  Al  Al238  1  0.583608  0.916939  0.499750  1
  Al  Al239  1  0.583608  0.917001  0.749889  1
  Al  Al240  1  0.750975  0.083608  -0.000250  1
  Al  Al241  1  0.750358  0.083608  0.249654  1
  Al  Al242  1  0.750136  0.083608  0.499750  1
  Al  Al243  1  0.750358  0.083608  0.749846  1
  Al  Al244  1  0.750470  0.250177  -0.000250  1
  Al  Al245  1  0.750388  0.250168  0.249601  1
  Al  Al246  1  0.750170  0.250346  0.499750  1
  Al  Al247  1  0.750388  0.250168  0.749899  1
  Al  Al248  1  0.750347  0.416869  -0.000250  1
  Al  Al249  1  0.750318  0.416898  0.249656  1
  Al  Al250  1  0.750273  0.416943  0.499750  1
  Al  Al251  1  0.750318  0.416898  0.749845  1
  Al  Al252  1  0.750311  0.583608  -0.000250  1
  Al  Al253  1  0.750298  0.583608  0.249677  1
  Al  Al254  1  0.750314  0.583608  0.499750  1
  Al  Al255  1  0.750298  0.583608  0.749823  1
  Al  Al256  1  0.750347  0.750347  -0.000250  1
  Al  Al257  1  0.750318  0.750318  0.249656  1
  Al  Al258  1  0.750273  0.750273  0.499750  1
  Al  Al259  1  0.750318  0.750318  0.749845  1
  Al  Al260  1  0.750470  0.917039  -0.000250  1
  Al  Al261  1  0.750388  0.917048  0.249601  1
  Al  Al262  1  0.750170  0.916870  0.499750  1
  Al  Al263  1  0.750388  0.917048  0.749899  1
  Al  Al264  1  0.920500  0.083608  -0.000250  1
  Al  Al265  1  0.916800  0.083608  0.250159  1
  Al  Al266  1  0.916746  0.083608  0.499750  1
  Al  Al267  1  0.916800  0.083608  0.749341  1
  Al  Al268  1  0.917230  0.249986  -0.000250  1
  Al  Al269  1  0.917080  0.250136  0.249696  1
  Al  Al270  1  0.916781  0.250435  0.499750  1
  Al  Al271  1  0.917080  0.250136  0.749804  1
  Al  Al272  1  0.917039  0.416746  -0.000250  1
  Al  Al273  1  0.917048  0.416828  0.249601  1
  Al  Al274  1  0.916870  0.417046  0.499750  1
  Al  Al275  1  0.917048  0.416828  0.749899  1
  Al  Al276  1  0.916988  0.583608  -0.000250  1
  Al  Al277  1  0.917001  0.583608  0.249611  1
  Al  Al278  1  0.916939  0.583608  0.499750  1
  Al  Al279  1  0.917001  0.583608  0.749889  1
  Al  Al280  1  0.917039  0.750470  -0.000250  1
  Al  Al281  1  0.917048  0.750388  0.249601  1
  Al  Al282  1  0.916870  0.750170  0.499750  1
  Al  Al283  1  0.917048  0.750388  0.749899  1
  Al  Al284  1  0.917230  0.917230  -0.000250  1
  Al  Al285  1  0.917080  0.917080  0.249696  1
  Al  Al286  1  0.916781  0.916781  0.499750  1
  Al  Al287  1  0.917080  0.917080  0.749804  1
