# generated using pymatgen
data_Mg13Al14
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.20225313
_cell_length_b   30.91680420
_cell_length_c   53.77753997
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg13Al14
_chemical_formula_sum   'Mg156 Al168'
_cell_volume   15299.939123
_cell_formula_units_Z   12
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
  Mg  Mg1  1  1.000094  0.985223  0.463662  1
  Mg  Mg2  1  0.988299  0.559482  0.328657  1
  Mg  Mg3  1  0.055159  0.271039  0.392871  1
  Mg  Mg4  1  0.884653  0.827598  0.457249  1
  Mg  Mg5  1  0.901992  0.400429  0.316460  1
  Mg  Mg6  1  0.825767  0.102818  0.397250  1
  Mg  Mg7  1  0.706848  0.893031  0.486993  1
  Mg  Mg8  1  0.659699  0.460667  0.351629  1
  Mg  Mg9  1  0.666185  0.182291  0.410008  1
  Mg  Mg10  1  0.224981  0.825529  0.455302  1
  Mg  Mg11  1  0.234448  0.394907  0.315588  1
  Mg  Mg12  1  0.163102  0.104346  0.397062  1
  Mg  Mg13  1  0.838047  0.682920  0.412003  1
  Mg  Mg14  1  0.860548  0.393274  0.488332  1
  Mg  Mg15  1  0.822916  0.962268  0.351719  1
  Mg  Mg16  1  0.512689  0.912454  0.442402  1
  Mg  Mg17  1  0.482255  0.484404  0.305056  1
  Mg  Mg18  1  0.496109  0.202602  0.362958  1
  Mg  Mg19  1  0.059204  0.850826  0.409342  1
  Mg  Mg20  1  0.987220  0.559511  0.488274  1
  Mg  Mg21  1  0.994519  0.130273  0.352373  1
  Mg  Mg22  1  0.883919  0.869879  0.364195  1
  Mg  Mg23  1  0.826704  0.579088  0.441615  1
  Mg  Mg24  1  0.825123  0.142083  0.306536  1
  Mg  Mg25  1  0.240480  0.868554  0.362178  1
  Mg  Mg26  1  0.160008  0.578543  0.442193  1
  Mg  Mg27  1  0.177993  0.140650  0.306775  1
  Mg  Mg28  1  0.665035  0.932249  0.395314  1
  Mg  Mg29  1  0.659407  0.657211  0.454922  1
  Mg  Mg30  1  0.679354  0.229441  0.316139  1
  Mg  Mg31  1  0.827745  0.727670  0.315074  1
  Mg  Mg32  1  0.824113  0.435946  0.397743  1
  Mg  Mg33  1  0.829720  0.155812  0.455634  1
  Mg  Mg34  1  0.568481  0.811623  0.305514  1
  Mg  Mg35  1  0.491241  0.532346  0.375134  1
  Mg  Mg36  1  0.542434  0.249800  0.440795  1
  Mg  Mg37  1  0.527372  0.724300  0.484747  1
  Mg  Mg38  1  0.563608  0.292323  0.352637  1
  Mg  Mg39  1  0.497469  0.008057  0.416598  1
  Mg  Mg40  1  0.555159  0.771039  0.392871  1
  Mg  Mg41  1  0.500094  0.485223  0.463662  1
  Mg  Mg42  1  0.488299  0.059482  0.328657  1
  Mg  Mg43  1  0.401992  0.900429  0.316460  1
  Mg  Mg44  1  0.325767  0.602818  0.397250  1
  Mg  Mg45  1  0.384653  0.327598  0.457249  1
  Mg  Mg46  1  0.166185  0.682291  0.410008  1
  Mg  Mg47  1  0.206848  0.393031  0.486993  1
  Mg  Mg48  1  0.159699  0.960667  0.351629  1
  Mg  Mg49  1  0.734448  0.894907  0.315588  1
  Mg  Mg50  1  0.663102  0.604346  0.397062  1
  Mg  Mg51  1  0.724981  0.325529  0.455302  1
  Mg  Mg52  1  0.360548  0.893274  0.488332  1
  Mg  Mg53  1  0.322916  0.462268  0.351719  1
  Mg  Mg54  1  0.338047  0.182920  0.412003  1
  Mg  Mg55  1  0.996109  0.702602  0.362958  1
  Mg  Mg56  1  1.012689  0.412454  0.442402  1
  Mg  Mg57  1  0.982255  0.984404  0.305056  1
  Mg  Mg58  1  0.494519  0.630273  0.352373  1
  Mg  Mg59  1  0.559204  0.350826  0.409342  1
  Mg  Mg60  1  0.487220  0.059511  0.488274  1
  Mg  Mg61  1  0.325123  0.642083  0.306536  1
  Mg  Mg62  1  0.383919  0.369879  0.364195  1
  Mg  Mg63  1  0.326704  0.079088  0.441615  1
  Mg  Mg64  1  0.677993  0.640650  0.306775  1
  Mg  Mg65  1  0.740480  0.368554  0.362178  1
  Mg  Mg66  1  0.660008  0.078543  0.442193  1
  Mg  Mg67  1  0.179354  0.729441  0.316139  1
  Mg  Mg68  1  0.165035  0.432249  0.395314  1
  Mg  Mg69  1  0.159407  0.157211  0.454922  1
  Mg  Mg70  1  0.324113  0.935946  0.397743  1
  Mg  Mg71  1  0.329720  0.655812  0.455634  1
  Mg  Mg72  1  0.327745  0.227670  0.315074  1
  Mg  Mg73  1  0.042434  0.749800  0.440795  1
  Mg  Mg74  1  0.068481  0.311623  0.305514  1
  Mg  Mg75  1  0.991241  0.032346  0.375134  1
  Mg  Mg76  1  0.063608  0.792323  0.352637  1
  Mg  Mg77  1  0.997469  0.508057  0.416598  1
  Mg  Mg78  1  0.027372  0.224300  0.484747  1
  Mg  Mg79  1  0.988299  0.131805  0.661721  1
  Mg  Mg80  1  1.000094  0.706064  0.526716  1
  Mg  Mg81  1  0.055159  0.420247  0.597507  1
  Mg  Mg82  1  0.827745  0.963616  0.675304  1
  Mg  Mg83  1  0.829720  0.535474  0.534744  1
  Mg  Mg84  1  0.824113  0.255340  0.592635  1
  Mg  Mg85  1  0.677993  0.050636  0.683603  1
  Mg  Mg86  1  0.660008  0.612744  0.548185  1
  Mg  Mg87  1  0.740480  0.322732  0.628200  1
  Mg  Mg88  1  0.179354  0.961845  0.674239  1
  Mg  Mg89  1  0.159407  0.534076  0.535456  1
  Mg  Mg90  1  0.165035  0.259037  0.595064  1
  Mg  Mg91  1  0.883919  0.821407  0.626183  1
  Mg  Mg92  1  0.825123  0.549203  0.683842  1
  Mg  Mg93  1  0.826704  0.112199  0.548763  1
  Mg  Mg94  1  0.494519  0.061013  0.638005  1
  Mg  Mg95  1  0.487220  0.631775  0.502104  1
  Mg  Mg96  1  0.559204  0.340460  0.581036  1
  Mg  Mg97  1  0.996109  0.988684  0.627420  1
  Mg  Mg98  1  0.982255  0.706883  0.685322  1
  Mg  Mg99  1  1.012689  0.278832  0.547976  1
  Mg  Mg100  1  0.838047  0.008367  0.578375  1
  Mg  Mg101  1  0.822916  0.729018  0.638659  1
  Mg  Mg102  1  0.860548  0.298013  0.502046  1
  Mg  Mg103  1  0.166185  0.008995  0.580370  1
  Mg  Mg104  1  0.159699  0.730619  0.638749  1
  Mg  Mg105  1  0.206848  0.298255  0.503385  1
  Mg  Mg106  1  0.663102  0.086940  0.593316  1
  Mg  Mg107  1  0.734448  0.796379  0.674790  1
  Mg  Mg108  1  0.724981  0.365758  0.535076  1
  Mg  Mg109  1  0.884653  0.863689  0.533129  1
  Mg  Mg110  1  0.825767  0.588468  0.593128  1
  Mg  Mg111  1  0.901992  0.290858  0.673918  1
  Mg  Mg112  1  0.527372  0.966987  0.505631  1
  Mg  Mg113  1  0.497469  0.683229  0.573780  1
  Mg  Mg114  1  0.563608  0.398963  0.637741  1
  Mg  Mg115  1  0.568481  0.879664  0.684864  1
  Mg  Mg116  1  0.542434  0.441487  0.549583  1
  Mg  Mg117  1  0.491241  0.158940  0.615245  1
  Mg  Mg118  1  0.555159  0.920247  0.597507  1
  Mg  Mg119  1  0.488299  0.631805  0.661721  1
  Mg  Mg120  1  0.500094  0.206064  0.526716  1
  Mg  Mg121  1  0.329720  0.035474  0.534744  1
  Mg  Mg122  1  0.324113  0.755340  0.592635  1
  Mg  Mg123  1  0.327745  0.463616  0.675304  1
  Mg  Mg124  1  0.240480  0.822732  0.628200  1
  Mg  Mg125  1  0.177993  0.550636  0.683603  1
  Mg  Mg126  1  0.160008  0.112744  0.548185  1
  Mg  Mg127  1  0.659407  0.034076  0.535456  1
  Mg  Mg128  1  0.665035  0.759037  0.595064  1
  Mg  Mg129  1  0.679354  0.461845  0.674239  1
  Mg  Mg130  1  0.325123  0.049203  0.683842  1
  Mg  Mg131  1  0.326704  0.612199  0.548763  1
  Mg  Mg132  1  0.383919  0.321407  0.626183  1
  Mg  Mg133  1  0.059204  0.840460  0.581036  1
  Mg  Mg134  1  0.994519  0.561013  0.638005  1
  Mg  Mg135  1  0.987220  0.131775  0.502104  1
  Mg  Mg136  1  0.512689  0.778832  0.547976  1
  Mg  Mg137  1  0.496109  0.488684  0.627420  1
  Mg  Mg138  1  0.482255  0.206883  0.685322  1
  Mg  Mg139  1  0.360548  0.798013  0.502046  1
  Mg  Mg140  1  0.338047  0.508367  0.578375  1
  Mg  Mg141  1  0.322916  0.229018  0.638659  1
  Mg  Mg142  1  0.706848  0.798255  0.503385  1
  Mg  Mg143  1  0.666185  0.508995  0.580370  1
  Mg  Mg144  1  0.659699  0.230619  0.638749  1
  Mg  Mg145  1  0.224981  0.865758  0.535076  1
  Mg  Mg146  1  0.163102  0.586940  0.593316  1
  Mg  Mg147  1  0.234448  0.296379  0.674790  1
  Mg  Mg148  1  0.325767  0.088468  0.593128  1
  Mg  Mg149  1  0.401992  0.790858  0.673918  1
  Mg  Mg150  1  0.384653  0.363689  0.533129  1
  Mg  Mg151  1  0.063608  0.898963  0.637741  1
  Mg  Mg152  1  0.027372  0.466987  0.505631  1
  Mg  Mg153  1  0.997469  0.183229  0.573780  1
  Mg  Mg154  1  0.042434  0.941487  0.549583  1
  Mg  Mg155  1  0.991241  0.658940  0.615245  1
  Mg  Mg156  1  0.068481  0.379664  0.684864  1
  Al  Al157  1  0.168329  0.916054  0.443248  1
  Al  Al158  1  0.138078  0.484257  0.310252  1
  Al  Al159  1  0.179038  0.201329  0.363948  1
  Al  Al160  1  0.704288  0.752722  0.440181  1
  Al  Al161  1  0.731513  0.323060  0.310381  1
  Al  Al162  1  0.654240  0.033300  0.373061  1
  Al  Al163  1  0.715610  0.845509  0.412766  1
  Al  Al164  1  0.659646  0.557227  0.487898  1
  Al  Al165  1  0.666556  0.126939  0.353424  1
  Al  Al166  1  0.403428  0.846542  0.409463  1
  Al  Al167  1  0.319123  0.553685  0.488735  1
  Al  Al168  1  0.328416  0.126100  0.353418  1
  Al  Al169  1  0.849004  0.915522  0.439282  1
  Al  Al170  1  0.819839  0.489491  0.309549  1
  Al  Al171  1  0.827267  0.207490  0.364622  1
  Al  Al172  1  0.730055  0.790211  0.349410  1
  Al  Al173  1  0.660635  0.508232  0.417891  1
  Al  Al174  1  0.694130  0.221880  0.484084  1
  Al  Al175  1  0.854057  0.725012  0.481186  1
  Al  Al176  1  0.892376  0.291028  0.348021  1
  Al  Al177  1  0.826300  0.005919  0.417498  1
  Al  Al178  1  0.330165  0.985924  0.461589  1
  Al  Al179  1  0.315513  0.554822  0.331965  1
  Al  Al180  1  0.381232  0.274567  0.396204  1
  Al  Al181  1  0.999366  0.941389  0.398552  1
  Al  Al182  1  0.998142  0.657717  0.460662  1
  Al  Al183  1  1.007319  0.220182  0.325396  1
  Al  Al184  1  0.060390  0.892807  0.319475  1
  Al  Al185  1  0.995028  0.601132  0.393634  1
  Al  Al186  1  0.047692  0.320147  0.456250  1
  Al  Al187  1  0.040576  0.894834  0.488614  1
  Al  Al188  1  0.989721  0.464748  0.352245  1
  Al  Al189  1  0.998111  0.183917  0.408613  1
  Al  Al190  1  1.001693  0.649991  0.315127  1
  Al  Al191  1  0.061662  0.363446  0.360830  1
  Al  Al192  1  0.992783  0.073716  0.442989  1
  Al  Al193  1  0.679213  0.986535  0.461177  1
  Al  Al194  1  0.658696  0.554392  0.332208  1
  Al  Al195  1  0.732716  0.274087  0.396558  1
  Al  Al196  1  0.913376  0.818942  0.310854  1
  Al  Al197  1  0.826491  0.533189  0.373508  1
  Al  Al198  1  0.880792  0.246658  0.439573  1
  Al  Al199  1  0.679038  0.701329  0.363948  1
  Al  Al200  1  0.668329  0.416054  0.443248  1
  Al  Al201  1  0.638078  0.984257  0.310252  1
  Al  Al202  1  0.231513  0.823060  0.310381  1
  Al  Al203  1  0.154240  0.533300  0.373061  1
  Al  Al204  1  0.204288  0.252722  0.440181  1
  Al  Al205  1  0.166556  0.626939  0.353424  1
  Al  Al206  1  0.215610  0.345509  0.412766  1
  Al  Al207  1  0.159646  0.057227  0.487898  1
  Al  Al208  1  0.828416  0.626100  0.353418  1
  Al  Al209  1  0.903428  0.346542  0.409463  1
  Al  Al210  1  0.819123  0.053685  0.488735  1
  Al  Al211  1  0.327267  0.707490  0.364622  1
  Al  Al212  1  0.349004  0.415522  0.439282  1
  Al  Al213  1  0.319839  0.989491  0.309549  1
  Al  Al214  1  0.194130  0.721880  0.484084  1
  Al  Al215  1  0.230055  0.290211  0.349410  1
  Al  Al216  1  0.160635  0.008232  0.417891  1
  Al  Al217  1  0.392376  0.791028  0.348021  1
  Al  Al218  1  0.326300  0.505919  0.417498  1
  Al  Al219  1  0.354057  0.225012  0.481186  1
  Al  Al220  1  0.881232  0.774567  0.396204  1
  Al  Al221  1  0.830165  0.485924  0.461589  1
  Al  Al222  1  0.815513  0.054822  0.331965  1
  Al  Al223  1  0.507319  0.720182  0.325396  1
  Al  Al224  1  0.499366  0.441389  0.398552  1
  Al  Al225  1  0.498142  0.157717  0.460662  1
  Al  Al226  1  0.547692  0.820147  0.456250  1
  Al  Al227  1  0.560390  0.392807  0.319475  1
  Al  Al228  1  0.495028  0.101132  0.393634  1
  Al  Al229  1  0.498111  0.683917  0.408613  1
  Al  Al230  1  0.540576  0.394834  0.488614  1
  Al  Al231  1  0.489721  0.964748  0.352245  1
  Al  Al232  1  0.561662  0.863446  0.360830  1
  Al  Al233  1  0.492783  0.573716  0.442989  1
  Al  Al234  1  0.501693  0.149991  0.315127  1
  Al  Al235  1  0.232716  0.774087  0.396558  1
  Al  Al236  1  0.179213  0.486535  0.461177  1
  Al  Al237  1  0.158696  0.054392  0.332208  1
  Al  Al238  1  0.380792  0.746658  0.439573  1
  Al  Al239  1  0.413376  0.318942  0.310854  1
  Al  Al240  1  0.326491  0.033189  0.373508  1
  Al  Al241  1  0.166556  0.064347  0.636954  1
  Al  Al242  1  0.159646  0.634060  0.502480  1
  Al  Al243  1  0.215610  0.345778  0.577612  1
  Al  Al244  1  0.730055  0.901076  0.640968  1
  Al  Al245  1  0.694130  0.469407  0.506294  1
  Al  Al246  1  0.660635  0.183055  0.572488  1
  Al  Al247  1  0.679038  0.989957  0.626430  1
  Al  Al248  1  0.638078  0.707030  0.680126  1
  Al  Al249  1  0.668329  0.275233  0.547130  1
  Al  Al250  1  0.327267  0.983796  0.625757  1
  Al  Al251  1  0.319839  0.701795  0.680829  1
  Al  Al252  1  0.349004  0.275764  0.551096  1
  Al  Al253  1  0.828416  0.065187  0.636960  1
  Al  Al254  1  0.819123  0.637601  0.501643  1
  Al  Al255  1  0.903428  0.344744  0.580915  1
  Al  Al256  1  0.704288  0.938565  0.550197  1
  Al  Al257  1  0.654240  0.657987  0.617317  1
  Al  Al258  1  0.731513  0.368226  0.679997  1
  Al  Al259  1  0.913376  0.872345  0.679524  1
  Al  Al260  1  0.880792  0.444629  0.550805  1
  Al  Al261  1  0.826491  0.158097  0.616870  1
  Al  Al262  1  0.315513  0.136465  0.658413  1
  Al  Al263  1  0.330165  0.705362  0.528789  1
  Al  Al264  1  0.381232  0.416720  0.594174  1
  Al  Al265  1  0.995028  0.090155  0.596744  1
  Al  Al266  1  0.060390  0.798479  0.670903  1
  Al  Al267  1  0.047692  0.371140  0.534128  1
  Al  Al268  1  0.998142  0.033569  0.529716  1
  Al  Al269  1  0.999366  0.749897  0.591826  1
  Al  Al270  1  1.007319  0.471105  0.664982  1
  Al  Al271  1  1.001693  0.041295  0.675251  1
  Al  Al272  1  0.992783  0.617570  0.547389  1
  Al  Al273  1  0.061662  0.327841  0.629548  1
  Al  Al274  1  0.040576  0.796452  0.501764  1
  Al  Al275  1  0.998111  0.507370  0.581765  1
  Al  Al276  1  0.989721  0.226539  0.638133  1
  Al  Al277  1  0.658696  0.136895  0.658170  1
  Al  Al278  1  0.679213  0.704751  0.529201  1
  Al  Al279  1  0.732716  0.417200  0.593820  1
  Al  Al280  1  0.854057  0.966274  0.509192  1
  Al  Al281  1  0.826300  0.685368  0.572880  1
  Al  Al282  1  0.892376  0.400259  0.642357  1
  Al  Al283  1  0.715610  0.845778  0.577612  1
  Al  Al284  1  0.666556  0.564347  0.636954  1
  Al  Al285  1  0.659646  0.134060  0.502480  1
  Al  Al286  1  0.194130  0.969407  0.506294  1
  Al  Al287  1  0.160635  0.683055  0.572488  1
  Al  Al288  1  0.230055  0.401076  0.640968  1
  Al  Al289  1  0.168329  0.775233  0.547130  1
  Al  Al290  1  0.179038  0.489957  0.626430  1
  Al  Al291  1  0.138078  0.207030  0.680126  1
  Al  Al292  1  0.849004  0.775764  0.551096  1
  Al  Al293  1  0.827267  0.483796  0.625757  1
  Al  Al294  1  0.819839  0.201795  0.680829  1
  Al  Al295  1  0.403428  0.844744  0.580915  1
  Al  Al296  1  0.328416  0.565187  0.636960  1
  Al  Al297  1  0.319123  0.137601  0.501643  1
  Al  Al298  1  0.231513  0.868226  0.679997  1
  Al  Al299  1  0.204288  0.438565  0.550197  1
  Al  Al300  1  0.154240  0.157987  0.617317  1
  Al  Al301  1  0.380792  0.944629  0.550805  1
  Al  Al302  1  0.326491  0.658097  0.616870  1
  Al  Al303  1  0.413376  0.372345  0.679524  1
  Al  Al304  1  0.881232  0.916720  0.594174  1
  Al  Al305  1  0.815513  0.636465  0.658413  1
  Al  Al306  1  0.830165  0.205362  0.528789  1
  Al  Al307  1  0.547692  0.871140  0.534128  1
  Al  Al308  1  0.495028  0.590155  0.596744  1
  Al  Al309  1  0.560390  0.298479  0.670903  1
  Al  Al310  1  0.507319  0.971105  0.664982  1
  Al  Al311  1  0.498142  0.533569  0.529716  1
  Al  Al312  1  0.499366  0.249897  0.591826  1
  Al  Al313  1  0.561662  0.827841  0.629548  1
  Al  Al314  1  0.501693  0.541295  0.675251  1
  Al  Al315  1  0.492783  0.117570  0.547389  1
  Al  Al316  1  0.498111  0.007370  0.581765  1
  Al  Al317  1  0.489721  0.726539  0.638133  1
  Al  Al318  1  0.540576  0.296452  0.501764  1
  Al  Al319  1  0.232716  0.917200  0.593820  1
  Al  Al320  1  0.158696  0.636895  0.658170  1
  Al  Al321  1  0.179213  0.204751  0.529201  1
  Al  Al322  1  0.392376  0.900259  0.642357  1
  Al  Al323  1  0.354057  0.466274  0.509192  1
  Al  Al324  1  0.326300  0.185368  0.572880  1
