# generated using pymatgen
data_Mg17Al12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   23.51043122
_cell_length_b   23.50734629
_cell_length_c   51.48648206
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   78.46304097
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg17Al12
_chemical_formula_sum   'Mg408 Al288'
_cell_volume   27880.0170513
_cell_formula_units_Z   24
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  0.249966  0.250240  0.259867  1
  Mg  Mg2  1  0.749966  0.750240  0.259867  1
  Mg  Mg3  1  0.667253  0.167552  0.335651  1
  Mg  Mg4  1  0.167253  0.667552  0.335651  1
  Mg  Mg5  1  0.549164  0.224731  0.363932  1
  Mg  Mg6  1  0.049164  0.724731  0.363932  1
  Mg  Mg7  1  0.129473  0.309133  0.285441  1
  Mg  Mg8  1  0.629473  0.809133  0.285441  1
  Mg  Mg9  1  0.558855  0.379734  0.285445  1
  Mg  Mg10  1  0.058855  0.879734  0.285445  1
  Mg  Mg11  1  0.974428  0.299460  0.363934  1
  Mg  Mg12  1  0.474428  0.799460  0.363934  1
  Mg  Mg13  1  0.552509  0.552814  0.359546  1
  Mg  Mg14  1  0.052509  0.052814  0.359546  1
  Mg  Mg15  1  0.138569  0.638869  0.279906  1
  Mg  Mg16  1  0.638569  0.138869  0.279906  1
  Mg  Mg17  1  0.333692  0.333978  0.257399  1
  Mg  Mg18  1  0.833692  0.833978  0.257399  1
  Mg  Mg19  1  0.754489  0.254794  0.334289  1
  Mg  Mg20  1  0.254489  0.754794  0.334289  1
  Mg  Mg21  1  0.544625  0.345107  0.385853  1
  Mg  Mg22  1  0.044625  0.845107  0.385853  1
  Mg  Mg23  1  0.126573  0.431167  0.302440  1
  Mg  Mg24  1  0.626573  0.931167  0.302440  1
  Mg  Mg25  1  0.406355  0.106309  0.416025  1
  Mg  Mg26  1  0.906355  0.606309  0.416025  1
  Mg  Mg27  1  0.988087  0.191434  0.330091  1
  Mg  Mg28  1  0.488087  0.691434  0.330091  1
  Mg  Mg29  1  0.585912  0.424842  0.345635  1
  Mg  Mg30  1  0.085912  0.924842  0.345635  1
  Mg  Mg31  1  0.172388  0.511155  0.264923  1
  Mg  Mg32  1  0.672388  0.011155  0.264923  1
  Mg  Mg33  1  0.455761  0.456062  0.366774  1
  Mg  Mg34  1  0.955761  0.956062  0.366774  1
  Mg  Mg35  1  0.041256  0.541545  0.280830  1
  Mg  Mg36  1  0.541256  0.041545  0.280830  1
  Mg  Mg37  1  0.491786  0.351831  0.329391  1
  Mg  Mg38  1  0.991786  0.851831  0.329391  1
  Mg  Mg39  1  0.910542  0.269109  0.411988  1
  Mg  Mg40  1  0.410542  0.769109  0.411988  1
  Mg  Mg41  1  0.424548  0.586206  0.345631  1
  Mg  Mg42  1  0.924548  0.086206  0.345631  1
  Mg  Mg43  1  0.010869  0.672678  0.264918  1
  Mg  Mg44  1  0.510869  0.172678  0.264918  1
  Mg  Mg45  1  0.703882  0.547613  0.277775  1
  Mg  Mg46  1  0.203882  0.047613  0.277775  1
  Mg  Mg47  1  0.118982  0.461567  0.361639  1
  Mg  Mg48  1  0.618982  0.961567  0.361639  1
  Mg  Mg49  1  0.680879  0.376874  0.302440  1
  Mg  Mg50  1  0.180879  0.876874  0.302440  1
  Mg  Mg51  1  0.094804  0.294934  0.385851  1
  Mg  Mg52  1  0.594804  0.794934  0.385851  1
  Mg  Mg53  1  0.612016  0.612310  0.317936  1
  Mg  Mg54  1  0.112016  0.112310  0.317936  1
  Mg  Mg55  1  0.028838  0.529142  0.402128  1
  Mg  Mg56  1  0.528838  0.029142  0.402128  1
  Mg  Mg57  1  0.351535  0.492083  0.329389  1
  Mg  Mg58  1  0.851535  0.992083  0.329389  1
  Mg  Mg59  1  0.768803  0.410850  0.411988  1
  Mg  Mg60  1  0.268803  0.910850  0.411988  1
  Mg  Mg61  1  0.106001  0.406663  0.416027  1
  Mg  Mg62  1  0.606001  0.906663  0.416027  1
  Mg  Mg63  1  0.691135  0.488388  0.330098  1
  Mg  Mg64  1  0.191135  0.988388  0.330098  1
  Mg  Mg65  1  0.297330  0.454183  0.277772  1
  Mg  Mg66  1  0.797330  0.954183  0.277772  1
  Mg  Mg67  1  0.711272  0.369287  0.361639  1
  Mg  Mg68  1  0.211272  0.869287  0.361639  1
  Mg  Mg69  1  0.499966  0.500240  0.259867  1
  Mg  Mg70  1  0.999966  1.000240  0.259867  1
  Mg  Mg71  1  0.917253  0.417552  0.335651  1
  Mg  Mg72  1  0.417253  0.917552  0.335651  1
  Mg  Mg73  1  0.379473  0.559133  0.285441  1
  Mg  Mg74  1  0.879473  0.059133  0.285441  1
  Mg  Mg75  1  0.799164  0.474731  0.363932  1
  Mg  Mg76  1  0.299164  0.974731  0.363932  1
  Mg  Mg77  1  0.224428  0.549460  0.363934  1
  Mg  Mg78  1  0.724428  0.049460  0.363934  1
  Mg  Mg79  1  0.808855  0.629734  0.285445  1
  Mg  Mg80  1  0.308855  0.129734  0.285445  1
  Mg  Mg81  1  0.302509  0.302814  0.359546  1
  Mg  Mg82  1  0.802509  0.802814  0.359546  1
  Mg  Mg83  1  0.888569  0.388869  0.279906  1
  Mg  Mg84  1  0.388569  0.888869  0.279906  1
  Mg  Mg85  1  0.583692  0.583978  0.257399  1
  Mg  Mg86  1  0.083692  0.083978  0.257399  1
  Mg  Mg87  1  0.004489  0.504794  0.334289  1
  Mg  Mg88  1  0.504489  0.004794  0.334289  1
  Mg  Mg89  1  0.376573  0.681167  0.302440  1
  Mg  Mg90  1  0.876573  0.181167  0.302440  1
  Mg  Mg91  1  0.794625  0.595107  0.385853  1
  Mg  Mg92  1  0.294625  0.095107  0.385853  1
  Mg  Mg93  1  0.238087  0.441434  0.330091  1
  Mg  Mg94  1  0.738087  0.941434  0.330091  1
  Mg  Mg95  1  0.656355  0.356309  0.416025  1
  Mg  Mg96  1  0.156355  0.856309  0.416025  1
  Mg  Mg97  1  0.335912  0.174842  0.345635  1
  Mg  Mg98  1  0.835912  0.674842  0.345635  1
  Mg  Mg99  1  0.922388  0.261155  0.264923  1
  Mg  Mg100  1  0.422388  0.761155  0.264923  1
  Mg  Mg101  1  0.205761  0.206062  0.366774  1
  Mg  Mg102  1  0.705761  0.706062  0.366774  1
  Mg  Mg103  1  0.791256  0.291545  0.280830  1
  Mg  Mg104  1  0.291256  0.791545  0.280830  1
  Mg  Mg105  1  0.160542  0.519109  0.411988  1
  Mg  Mg106  1  0.660542  0.019109  0.411988  1
  Mg  Mg107  1  0.741786  0.601831  0.329391  1
  Mg  Mg108  1  0.241786  0.101831  0.329391  1
  Mg  Mg109  1  0.174548  0.336206  0.345631  1
  Mg  Mg110  1  0.674548  0.836206  0.345631  1
  Mg  Mg111  1  0.760869  0.422678  0.264918  1
  Mg  Mg112  1  0.260869  0.922678  0.264918  1
  Mg  Mg113  1  0.453882  0.297613  0.277775  1
  Mg  Mg114  1  0.953882  0.797613  0.277775  1
  Mg  Mg115  1  0.868982  0.211567  0.361639  1
  Mg  Mg116  1  0.368982  0.711567  0.361639  1
  Mg  Mg117  1  0.344804  0.544934  0.385851  1
  Mg  Mg118  1  0.844804  0.044934  0.385851  1
  Mg  Mg119  1  0.930879  0.626874  0.302440  1
  Mg  Mg120  1  0.430879  0.126874  0.302440  1
  Mg  Mg121  1  0.362016  0.362310  0.317936  1
  Mg  Mg122  1  0.862016  0.862310  0.317936  1
  Mg  Mg123  1  0.778838  0.279142  0.402128  1
  Mg  Mg124  1  0.278838  0.779142  0.402128  1
  Mg  Mg125  1  0.518803  0.160850  0.411988  1
  Mg  Mg126  1  0.018803  0.660850  0.411988  1
  Mg  Mg127  1  0.101535  0.242083  0.329389  1
  Mg  Mg128  1  0.601535  0.742083  0.329389  1
  Mg  Mg129  1  0.441135  0.238388  0.330098  1
  Mg  Mg130  1  0.941135  0.738388  0.330098  1
  Mg  Mg131  1  0.856001  0.156663  0.416027  1
  Mg  Mg132  1  0.356001  0.656663  0.416027  1
  Mg  Mg133  1  0.547330  0.704183  0.277772  1
  Mg  Mg134  1  0.047330  0.204183  0.277772  1
  Mg  Mg135  1  0.961272  0.619287  0.361639  1
  Mg  Mg136  1  0.461272  0.119287  0.361639  1
  Mg  Mg137  1  0.082188  0.082497  0.418892  1
  Mg  Mg138  1  0.582188  0.582497  0.418892  1
  Mg  Mg139  1  0.499373  0.999693  0.502611  1
  Mg  Mg140  1  0.999373  0.499693  0.502611  1
  Mg  Mg141  1  0.382813  0.057954  0.531840  1
  Mg  Mg142  1  0.882813  0.557954  0.531840  1
  Mg  Mg143  1  0.965946  0.141085  0.448100  1
  Mg  Mg144  1  0.465946  0.641085  0.448100  1
  Mg  Mg145  1  0.390772  0.216254  0.448103  1
  Mg  Mg146  1  0.890772  0.716254  0.448103  1
  Mg  Mg147  1  0.807632  0.133131  0.531842  1
  Mg  Mg148  1  0.307632  0.633131  0.531842  1
  Mg  Mg149  1  0.386927  0.387254  0.528083  1
  Mg  Mg150  1  0.886927  0.887254  0.528083  1
  Mg  Mg151  1  0.970311  0.470628  0.444186  1
  Mg  Mg152  1  0.470311  0.970628  0.444186  1
  Mg  Mg153  1  0.169359  0.169673  0.419093  1
  Mg  Mg154  1  0.669359  0.669673  0.419093  1
  Mg  Mg155  1  0.586746  0.087069  0.502564  1
  Mg  Mg156  1  0.086746  0.587069  0.502564  1
  Mg  Mg157  1  0.378464  0.179210  0.553006  1
  Mg  Mg158  1  0.878464  0.679210  0.553006  1
  Mg  Mg159  1  0.961960  0.262412  0.469192  1
  Mg  Mg160  1  0.461960  0.762412  0.469192  1
  Mg  Mg161  1  0.239763  0.939720  0.583497  1
  Mg  Mg162  1  0.739763  0.439720  0.583497  1
  Mg  Mg163  1  0.823108  0.022755  0.499906  1
  Mg  Mg164  1  0.323108  0.522755  0.499906  1
  Mg  Mg165  1  0.418756  0.260477  0.512383  1
  Mg  Mg166  1  0.918756  0.760477  0.512383  1
  Mg  Mg167  1  0.002123  0.343834  0.428624  1
  Mg  Mg168  1  0.502123  0.843834  0.428624  1
  Mg  Mg169  1  0.289738  0.290059  0.533396  1
  Mg  Mg170  1  0.789738  0.790059  0.533396  1
  Mg  Mg171  1  0.873084  0.373395  0.449473  1
  Mg  Mg172  1  0.373084  0.873395  0.449473  1
  Mg  Mg173  1  0.326854  0.185678  0.495864  1
  Mg  Mg174  1  0.826854  0.685678  0.495864  1
  Mg  Mg175  1  0.743837  0.102266  0.579467  1
  Mg  Mg176  1  0.243837  0.602266  0.579467  1
  Mg  Mg177  1  0.260160  0.419072  0.512382  1
  Mg  Mg178  1  0.760160  0.919072  0.512382  1
  Mg  Mg179  1  0.843528  0.502429  0.428623  1
  Mg  Mg180  1  0.343528  0.002429  0.428623  1
  Mg  Mg181  1  0.535539  0.377124  0.445585  1
  Mg  Mg182  1  0.035539  0.877124  0.445585  1
  Mg  Mg183  1  0.952496  0.293981  0.529218  1
  Mg  Mg184  1  0.452496  0.793981  0.529218  1
  Mg  Mg185  1  0.512098  0.212279  0.469190  1
  Mg  Mg186  1  0.012098  0.712279  0.469190  1
  Mg  Mg187  1  0.928887  0.128794  0.553004  1
  Mg  Mg188  1  0.428887  0.628794  0.553004  1
  Mg  Mg189  1  0.445107  0.445421  0.485839  1
  Mg  Mg190  1  0.945107  0.945421  0.485839  1
  Mg  Mg191  1  0.862076  0.362400  0.569424  1
  Mg  Mg192  1  0.362076  0.862400  0.569424  1
  Mg  Mg193  1  0.185362  0.327172  0.495863  1
  Mg  Mg194  1  0.685362  0.827172  0.495863  1
  Mg  Mg195  1  0.601939  0.244164  0.579467  1
  Mg  Mg196  1  0.101939  0.744164  0.579467  1
  Mg  Mg197  1  0.939392  0.240091  0.583500  1
  Mg  Mg198  1  0.439392  0.740091  0.583500  1
  Mg  Mg199  1  0.522437  0.323426  0.499909  1
  Mg  Mg200  1  0.022437  0.823426  0.499909  1
  Mg  Mg201  1  0.126819  0.285854  0.445585  1
  Mg  Mg202  1  0.626819  0.785854  0.445585  1
  Mg  Mg203  1  0.543666  0.202820  0.529218  1
  Mg  Mg204  1  0.043666  0.702820  0.529218  1
  Mg  Mg205  1  0.332188  0.332497  0.418892  1
  Mg  Mg206  1  0.832188  0.832497  0.418892  1
  Mg  Mg207  1  0.749373  0.249693  0.502611  1
  Mg  Mg208  1  0.249373  0.749693  0.502611  1
  Mg  Mg209  1  0.215946  0.391085  0.448100  1
  Mg  Mg210  1  0.715946  0.891085  0.448100  1
  Mg  Mg211  1  0.632813  0.307954  0.531840  1
  Mg  Mg212  1  0.132813  0.807954  0.531840  1
  Mg  Mg213  1  0.057632  0.383131  0.531842  1
  Mg  Mg214  1  0.557632  0.883131  0.531842  1
  Mg  Mg215  1  0.640772  0.466254  0.448103  1
  Mg  Mg216  1  0.140772  0.966254  0.448103  1
  Mg  Mg217  1  0.136927  0.137254  0.528083  1
  Mg  Mg218  1  0.636927  0.637254  0.528083  1
  Mg  Mg219  1  0.720311  0.220628  0.444186  1
  Mg  Mg220  1  0.220311  0.720628  0.444186  1
  Mg  Mg221  1  0.419359  0.419673  0.419093  1
  Mg  Mg222  1  0.919359  0.919673  0.419093  1
  Mg  Mg223  1  0.836746  0.337069  0.502564  1
  Mg  Mg224  1  0.336746  0.837069  0.502564  1
  Mg  Mg225  1  0.211960  0.512412  0.469192  1
  Mg  Mg226  1  0.711960  0.012412  0.469192  1
  Mg  Mg227  1  0.628464  0.429210  0.553006  1
  Mg  Mg228  1  0.128464  0.929210  0.553006  1
  Mg  Mg229  1  0.073108  0.272755  0.499906  1
  Mg  Mg230  1  0.573108  0.772755  0.499906  1
  Mg  Mg231  1  0.489763  0.189720  0.583497  1
  Mg  Mg232  1  0.989763  0.689720  0.583497  1
  Mg  Mg233  1  0.168756  0.010477  0.512383  1
  Mg  Mg234  1  0.668756  0.510477  0.512383  1
  Mg  Mg235  1  0.752123  0.093834  0.428624  1
  Mg  Mg236  1  0.252123  0.593834  0.428624  1
  Mg  Mg237  1  0.039738  0.040059  0.533396  1
  Mg  Mg238  1  0.539738  0.540059  0.533396  1
  Mg  Mg239  1  0.623084  0.123395  0.449473  1
  Mg  Mg240  1  0.123084  0.623395  0.449473  1
  Mg  Mg241  1  0.993837  0.352266  0.579467  1
  Mg  Mg242  1  0.493837  0.852266  0.579467  1
  Mg  Mg243  1  0.576854  0.435678  0.495864  1
  Mg  Mg244  1  0.076854  0.935678  0.495864  1
  Mg  Mg245  1  0.010160  0.169072  0.512382  1
  Mg  Mg246  1  0.510160  0.669072  0.512382  1
  Mg  Mg247  1  0.593528  0.252429  0.428623  1
  Mg  Mg248  1  0.093528  0.752429  0.428623  1
  Mg  Mg249  1  0.285539  0.127124  0.445585  1
  Mg  Mg250  1  0.785539  0.627124  0.445585  1
  Mg  Mg251  1  0.702496  0.043981  0.529218  1
  Mg  Mg252  1  0.202496  0.543981  0.529218  1
  Mg  Mg253  1  0.178887  0.378794  0.553004  1
  Mg  Mg254  1  0.678887  0.878794  0.553004  1
  Mg  Mg255  1  0.762098  0.462279  0.469190  1
  Mg  Mg256  1  0.262098  0.962279  0.469190  1
  Mg  Mg257  1  0.195107  0.195421  0.485839  1
  Mg  Mg258  1  0.695107  0.695421  0.485839  1
  Mg  Mg259  1  0.612076  0.112400  0.569424  1
  Mg  Mg260  1  0.112076  0.612400  0.569424  1
  Mg  Mg261  1  0.351939  0.994164  0.579467  1
  Mg  Mg262  1  0.851939  0.494164  0.579467  1
  Mg  Mg263  1  0.935362  0.077172  0.495863  1
  Mg  Mg264  1  0.435362  0.577172  0.495863  1
  Mg  Mg265  1  0.272437  0.073426  0.499909  1
  Mg  Mg266  1  0.772437  0.573426  0.499909  1
  Mg  Mg267  1  0.689392  0.990091  0.583500  1
  Mg  Mg268  1  0.189392  0.490091  0.583500  1
  Mg  Mg269  1  0.376819  0.535854  0.445585  1
  Mg  Mg270  1  0.876819  0.035854  0.445585  1
  Mg  Mg271  1  0.793666  0.452820  0.529218  1
  Mg  Mg272  1  0.293666  0.952820  0.529218  1
  Mg  Mg273  1  0.916031  0.916360  0.586693  1
  Mg  Mg274  1  0.416031  0.416360  0.586693  1
  Mg  Mg275  1  0.332620  0.832960  0.669902  1
  Mg  Mg276  1  0.832620  0.332960  0.669902  1
  Mg  Mg277  1  0.215010  0.889706  0.698280  1
  Mg  Mg278  1  0.715010  0.389706  0.698280  1
  Mg  Mg279  1  0.799628  0.974310  0.615710  1
  Mg  Mg280  1  0.299628  0.474310  0.615710  1
  Mg  Mg281  1  0.223979  0.049955  0.615712  1
  Mg  Mg282  1  0.723979  0.549955  0.615712  1
  Mg  Mg283  1  0.639361  0.965346  0.698285  1
  Mg  Mg284  1  0.139361  0.465346  0.698285  1
  Mg  Mg285  1  0.221212  0.221563  0.693980  1
  Mg  Mg286  1  0.721212  0.721563  0.693980  1
  Mg  Mg287  1  0.803668  0.304005  0.611417  1
  Mg  Mg288  1  0.303668  0.804005  0.611417  1
  Mg  Mg289  1  0.003317  0.003648  0.586607  1
  Mg  Mg290  1  0.503317  0.503648  0.586607  1
  Mg  Mg291  1  0.419840  0.920183  0.670392  1
  Mg  Mg292  1  0.919840  0.420183  0.670392  1
  Mg  Mg293  1  0.214003  0.011484  0.720159  1
  Mg  Mg294  1  0.714003  0.511484  0.720159  1
  Mg  Mg295  1  0.795205  0.095591  0.636636  1
  Mg  Mg296  1  0.295205  0.595591  0.636636  1
  Mg  Mg297  1  0.072632  0.782542  0.749246  1
  Mg  Mg298  1  0.572632  0.282542  0.749246  1
  Mg  Mg299  1  0.656559  0.856422  0.666720  1
  Mg  Mg300  1  0.156559  0.356422  0.666720  1
  Mg  Mg301  1  0.253293  0.093362  0.680827  1
  Mg  Mg302  1  0.753293  0.593362  0.680827  1
  Mg  Mg303  1  0.835597  0.177105  0.595990  1
  Mg  Mg304  1  0.335597  0.677105  0.595990  1
  Mg  Mg305  1  0.122675  0.123017  0.703001  1
  Mg  Mg306  1  0.622675  0.623017  0.703001  1
  Mg  Mg307  1  0.706127  0.206457  0.616857  1
  Mg  Mg308  1  0.206127  0.706457  0.616857  1
  Mg  Mg309  1  0.160611  0.019911  0.663605  1
  Mg  Mg310  1  0.660611  0.519911  0.663605  1
  Mg  Mg311  1  0.569167  0.943973  0.745814  1
  Mg  Mg312  1  0.069167  0.443973  0.745814  1
  Mg  Mg313  1  0.093028  0.253626  0.680822  1
  Mg  Mg314  1  0.593028  0.753626  0.680822  1
  Mg  Mg315  1  0.676778  0.335923  0.595988  1
  Mg  Mg316  1  0.176778  0.835923  0.595988  1
  Mg  Mg317  1  0.369280  0.211141  0.612949  1
  Mg  Mg318  1  0.869280  0.711141  0.612949  1
  Mg  Mg319  1  0.785356  0.128265  0.696570  1
  Mg  Mg320  1  0.285356  0.628265  0.696570  1
  Mg  Mg321  1  0.345259  0.045546  0.636635  1
  Mg  Mg322  1  0.845259  0.545546  0.636635  1
  Mg  Mg323  1  0.761141  0.964357  0.720153  1
  Mg  Mg324  1  0.261141  0.464357  0.720153  1
  Mg  Mg325  1  0.279426  0.279760  0.653071  1
  Mg  Mg326  1  0.779426  0.779760  0.653071  1
  Mg  Mg327  1  0.691527  0.191871  0.735615  1
  Mg  Mg328  1  0.191527  0.691871  0.735615  1
  Mg  Mg329  1  0.019575  0.160946  0.663604  1
  Mg  Mg330  1  0.519575  0.660946  0.663604  1
  Mg  Mg331  1  0.443621  0.069526  0.745812  1
  Mg  Mg332  1  0.943621  0.569526  0.745812  1
  Mg  Mg333  1  0.782191  0.072979  0.749254  1
  Mg  Mg334  1  0.282191  0.572979  0.749254  1
  Mg  Mg335  1  0.356084  0.156899  0.666723  1
  Mg  Mg336  1  0.856084  0.656899  0.666723  1
  Mg  Mg337  1  0.960816  0.119613  0.612949  1
  Mg  Mg338  1  0.460816  0.619613  0.612949  1
  Mg  Mg339  1  0.377936  0.035703  0.696568  1
  Mg  Mg340  1  0.877936  0.535703  0.696568  1
  Mg  Mg341  1  0.166031  0.166360  0.586693  1
  Mg  Mg342  1  0.666031  0.666360  0.586693  1
  Mg  Mg343  1  0.582620  0.082960  0.669902  1
  Mg  Mg344  1  0.082620  0.582960  0.669902  1
  Mg  Mg345  1  0.049628  0.224310  0.615710  1
  Mg  Mg346  1  0.549628  0.724310  0.615710  1
  Mg  Mg347  1  0.465010  0.139706  0.698280  1
  Mg  Mg348  1  0.965010  0.639706  0.698280  1
  Mg  Mg349  1  0.889361  0.215346  0.698285  1
  Mg  Mg350  1  0.389361  0.715346  0.698285  1
  Mg  Mg351  1  0.473979  0.299955  0.615712  1
  Mg  Mg352  1  0.973979  0.799955  0.615712  1
  Mg  Mg353  1  0.971212  0.971563  0.693980  1
  Mg  Mg354  1  0.471212  0.471563  0.693980  1
  Mg  Mg355  1  0.553668  0.054005  0.611417  1
  Mg  Mg356  1  0.053668  0.554005  0.611417  1
  Mg  Mg357  1  0.253317  0.253648  0.586607  1
  Mg  Mg358  1  0.753317  0.753648  0.586607  1
  Mg  Mg359  1  0.669840  0.170183  0.670392  1
  Mg  Mg360  1  0.169840  0.670183  0.670392  1
  Mg  Mg361  1  0.045205  0.345591  0.636636  1
  Mg  Mg362  1  0.545205  0.845591  0.636636  1
  Mg  Mg363  1  0.464003  0.261484  0.720159  1
  Mg  Mg364  1  0.964003  0.761484  0.720159  1
  Mg  Mg365  1  0.906559  0.106422  0.666720  1
  Mg  Mg366  1  0.406559  0.606422  0.666720  1
  Mg  Mg367  1  0.322632  0.032542  0.749246  1
  Mg  Mg368  1  0.822632  0.532542  0.749246  1
  Mg  Mg369  1  0.003293  0.843362  0.680827  1
  Mg  Mg370  1  0.503293  0.343362  0.680827  1
  Mg  Mg371  1  0.585597  0.927105  0.595990  1
  Mg  Mg372  1  0.085597  0.427105  0.595990  1
  Mg  Mg373  1  0.872675  0.873017  0.703001  1
  Mg  Mg374  1  0.372675  0.373017  0.703001  1
  Mg  Mg375  1  0.456127  0.956457  0.616857  1
  Mg  Mg376  1  0.956127  0.456457  0.616857  1
  Mg  Mg377  1  0.819167  0.193973  0.745814  1
  Mg  Mg378  1  0.319167  0.693973  0.745814  1
  Mg  Mg379  1  0.410611  0.269911  0.663605  1
  Mg  Mg380  1  0.910611  0.769911  0.663605  1
  Mg  Mg381  1  0.843028  0.003626  0.680822  1
  Mg  Mg382  1  0.343028  0.503626  0.680822  1
  Mg  Mg383  1  0.426778  0.085923  0.595988  1
  Mg  Mg384  1  0.926778  0.585923  0.595988  1
  Mg  Mg385  1  0.119280  0.961141  0.612949  1
  Mg  Mg386  1  0.619280  0.461141  0.612949  1
  Mg  Mg387  1  0.535356  0.878265  0.696570  1
  Mg  Mg388  1  0.035356  0.378265  0.696570  1
  Mg  Mg389  1  0.011141  0.214357  0.720153  1
  Mg  Mg390  1  0.511141  0.714357  0.720153  1
  Mg  Mg391  1  0.595259  0.295546  0.636635  1
  Mg  Mg392  1  0.095259  0.795546  0.636635  1
  Mg  Mg393  1  0.029426  0.029760  0.653071  1
  Mg  Mg394  1  0.529426  0.529760  0.653071  1
  Mg  Mg395  1  0.441527  0.941871  0.735615  1
  Mg  Mg396  1  0.941527  0.441871  0.735615  1
  Mg  Mg397  1  0.193621  0.819526  0.745812  1
  Mg  Mg398  1  0.693621  0.319526  0.745812  1
  Mg  Mg399  1  0.769575  0.910946  0.663604  1
  Mg  Mg400  1  0.269575  0.410946  0.663604  1
  Mg  Mg401  1  0.106084  0.906899  0.666723  1
  Mg  Mg402  1  0.606084  0.406899  0.666723  1
  Mg  Mg403  1  0.532191  0.822979  0.749254  1
  Mg  Mg404  1  0.032191  0.322979  0.749254  1
  Mg  Mg405  1  0.210816  0.369613  0.612949  1
  Mg  Mg406  1  0.710816  0.869613  0.612949  1
  Mg  Mg407  1  0.627936  0.285703  0.696568  1
  Mg  Mg408  1  0.127936  0.785703  0.696568  1
  Al  Al409  1  0.242972  0.560546  0.304974  1
  Al  Al410  1  0.742972  0.060546  0.304974  1
  Al  Al411  1  0.658104  0.475904  0.387937  1
  Al  Al412  1  0.158104  0.975904  0.387937  1
  Al  Al413  1  0.620608  0.303222  0.335452  1
  Al  Al414  1  0.120608  0.803222  0.335452  1
  Al  Al415  1  0.206858  0.384772  0.259647  1
  Al  Al416  1  0.706858  0.884772  0.259647  1
  Al  Al417  1  0.498771  0.589906  0.300716  1
  Al  Al418  1  0.998771  0.089906  0.300716  1
  Al  Al419  1  0.915952  0.508546  0.380642  1
  Al  Al420  1  0.415952  0.008546  0.380642  1
  Al  Al421  1  0.674531  0.674817  0.284149  1
  Al  Al422  1  0.174531  0.174817  0.284149  1
  Al  Al423  1  0.090820  0.591120  0.366175  1
  Al  Al424  1  0.590820  0.091120  0.366175  1
  Al  Al425  1  0.332285  0.422685  0.372879  1
  Al  Al426  1  0.832285  0.922685  0.372879  1
  Al  Al427  1  0.917543  0.508850  0.290125  1
  Al  Al428  1  0.417543  0.008850  0.290125  1
  Al  Al429  1  0.589619  0.499053  0.300716  1
  Al  Al430  1  0.089619  0.999053  0.300716  1
  Al  Al431  1  0.008237  0.416257  0.380642  1
  Al  Al432  1  0.508237  0.916257  0.380642  1
  Al  Al433  1  0.210793  0.303314  0.403644  1
  Al  Al434  1  0.710793  0.803314  0.403644  1
  Al  Al435  1  0.795535  0.386452  0.320008  1
  Al  Al436  1  0.295535  0.886452  0.320008  1
  Al  Al437  1  0.225599  0.408416  0.387934  1
  Al  Al438  1  0.725599  0.908416  0.387934  1
  Al  Al439  1  0.810249  0.493273  0.304972  1
  Al  Al440  1  0.310249  0.993273  0.304972  1
  Al  Al441  1  0.482298  0.482582  0.314952  1
  Al  Al442  1  0.982298  0.982582  0.314952  1
  Al  Al443  1  0.900710  0.401012  0.396206  1
  Al  Al444  1  0.400710  0.901012  0.396206  1
  Al  Al445  1  0.422376  0.332595  0.372880  1
  Al  Al446  1  0.922376  0.832595  0.372880  1
  Al  Al447  1  0.008546  0.417844  0.290126  1
  Al  Al448  1  0.508546  0.917844  0.290126  1
  Al  Al449  1  0.302922  0.620906  0.335453  1
  Al  Al450  1  0.802922  0.120906  0.335453  1
  Al  Al451  1  0.884484  0.707133  0.259641  1
  Al  Al452  1  0.384484  0.207133  0.259641  1
  Al  Al453  1  0.553007  0.461101  0.403645  1
  Al  Al454  1  0.053007  0.961101  0.403645  1
  Al  Al455  1  0.136157  0.545833  0.320009  1
  Al  Al456  1  0.636157  0.045833  0.320009  1
  Al  Al457  1  0.408104  0.225904  0.387937  1
  Al  Al458  1  0.908104  0.725904  0.387937  1
  Al  Al459  1  0.992972  0.310546  0.304974  1
  Al  Al460  1  0.492972  0.810546  0.304974  1
  Al  Al461  1  0.456858  0.634772  0.259647  1
  Al  Al462  1  0.956858  0.134772  0.259647  1
  Al  Al463  1  0.870608  0.553222  0.335452  1
  Al  Al464  1  0.370608  0.053222  0.335452  1
  Al  Al465  1  0.248771  0.339906  0.300716  1
  Al  Al466  1  0.748771  0.839906  0.300716  1
  Al  Al467  1  0.665952  0.258546  0.380642  1
  Al  Al468  1  0.165952  0.758546  0.380642  1
  Al  Al469  1  0.424531  0.424817  0.284149  1
  Al  Al470  1  0.924531  0.924817  0.284149  1
  Al  Al471  1  0.840820  0.341120  0.366175  1
  Al  Al472  1  0.340820  0.841120  0.366175  1
  Al  Al473  1  0.667543  0.258850  0.290125  1
  Al  Al474  1  0.167543  0.758850  0.290125  1
  Al  Al475  1  0.082285  0.172685  0.372879  1
  Al  Al476  1  0.582285  0.672685  0.372879  1
  Al  Al477  1  0.339619  0.249053  0.300716  1
  Al  Al478  1  0.839619  0.749053  0.300716  1
  Al  Al479  1  0.758237  0.166257  0.380642  1
  Al  Al480  1  0.258237  0.666257  0.380642  1
  Al  Al481  1  0.460793  0.553314  0.403644  1
  Al  Al482  1  0.960793  0.053314  0.403644  1
  Al  Al483  1  0.045535  0.636452  0.320008  1
  Al  Al484  1  0.545535  0.136452  0.320008  1
  Al  Al485  1  0.560249  0.243273  0.304972  1
  Al  Al486  1  0.060249  0.743273  0.304972  1
  Al  Al487  1  0.975599  0.158416  0.387934  1
  Al  Al488  1  0.475599  0.658416  0.387934  1
  Al  Al489  1  0.232298  0.232582  0.314952  1
  Al  Al490  1  0.732298  0.732582  0.314952  1
  Al  Al491  1  0.650710  0.151012  0.396206  1
  Al  Al492  1  0.150710  0.651012  0.396206  1
  Al  Al493  1  0.258546  0.667844  0.290126  1
  Al  Al494  1  0.758546  0.167844  0.290126  1
  Al  Al495  1  0.672376  0.582595  0.372880  1
  Al  Al496  1  0.172376  0.082595  0.372880  1
  Al  Al497  1  0.634484  0.457133  0.259641  1
  Al  Al498  1  0.134484  0.957133  0.259641  1
  Al  Al499  1  0.052922  0.370906  0.335453  1
  Al  Al500  1  0.552922  0.870906  0.335453  1
  Al  Al501  1  0.303007  0.211101  0.403645  1
  Al  Al502  1  0.803007  0.711101  0.403645  1
  Al  Al503  1  0.886157  0.295833  0.320009  1
  Al  Al504  1  0.386157  0.795833  0.320009  1
  Al  Al505  1  0.074760  0.392888  0.472148  1
  Al  Al506  1  0.574760  0.892888  0.472148  1
  Al  Al507  1  0.491400  0.309716  0.555982  1
  Al  Al508  1  0.991400  0.809716  0.555982  1
  Al  Al509  1  0.453984  0.136385  0.502924  1
  Al  Al510  1  0.953984  0.636385  0.502924  1
  Al  Al511  1  0.036967  0.219142  0.419193  1
  Al  Al512  1  0.536967  0.719142  0.419193  1
  Al  Al513  1  0.332021  0.424463  0.464457  1
  Al  Al514  1  0.832021  0.924463  0.464457  1
  Al  Al515  1  0.749000  0.341444  0.548120  1
  Al  Al516  1  0.249000  0.841444  0.548120  1
  Al  Al517  1  0.506740  0.507051  0.449745  1
  Al  Al518  1  0.006740  0.007051  0.449745  1
  Al  Al519  1  0.923672  0.423992  0.533386  1
  Al  Al520  1  0.423672  0.923992  0.533386  1
  Al  Al521  1  0.166681  0.257075  0.540656  1
  Al  Al522  1  0.666681  0.757075  0.540656  1
  Al  Al523  1  0.749972  0.340528  0.456721  1
  Al  Al524  1  0.249972  0.840528  0.456721  1
  Al  Al525  1  0.424145  0.332336  0.464458  1
  Al  Al526  1  0.924145  0.832336  0.464458  1
  Al  Al527  1  0.841117  0.249324  0.548121  1
  Al  Al528  1  0.341117  0.749324  0.548121  1
  Al  Al529  1  0.044420  0.136670  0.571072  1
  Al  Al530  1  0.544420  0.636670  0.571072  1
  Al  Al531  1  0.627589  0.219976  0.487240  1
  Al  Al532  1  0.127589  0.719976  0.487240  1
  Al  Al533  1  0.059391  0.241731  0.555980  1
  Al  Al534  1  0.559391  0.741731  0.555980  1
  Al  Al535  1  0.642574  0.325081  0.472146  1
  Al  Al536  1  0.142574  0.825081  0.472146  1
  Al  Al537  1  0.316766  0.317080  0.479924  1
  Al  Al538  1  0.816766  0.817080  0.479924  1
  Al  Al539  1  0.733665  0.233988  0.563571  1
  Al  Al540  1  0.233665  0.733988  0.563571  1
  Al  Al541  1  0.256748  0.167009  0.540656  1
  Al  Al542  1  0.756748  0.667009  0.540656  1
  Al  Al543  1  0.840210  0.250291  0.456721  1
  Al  Al544  1  0.340210  0.750291  0.456721  1
  Al  Al545  1  0.136063  0.454303  0.502925  1
  Al  Al546  1  0.636063  0.954303  0.502925  1
  Al  Al547  1  0.718831  0.537276  0.419195  1
  Al  Al548  1  0.218831  0.037276  0.419195  1
  Al  Al549  1  0.386345  0.294748  0.571073  1
  Al  Al550  1  0.886345  0.794748  0.571073  1
  Al  Al551  1  0.969661  0.377907  0.487241  1
  Al  Al552  1  0.469661  0.877907  0.487241  1
  Al  Al553  1  0.241400  0.059716  0.555982  1
  Al  Al554  1  0.741400  0.559716  0.555982  1
  Al  Al555  1  0.824760  0.142888  0.472148  1
  Al  Al556  1  0.324760  0.642888  0.472148  1
  Al  Al557  1  0.286967  0.469142  0.419193  1
  Al  Al558  1  0.786967  0.969142  0.419193  1
  Al  Al559  1  0.703984  0.386385  0.502924  1
  Al  Al560  1  0.203984  0.886385  0.502924  1
  Al  Al561  1  0.082021  0.174463  0.464457  1
  Al  Al562  1  0.582021  0.674463  0.464457  1
  Al  Al563  1  0.499000  0.091444  0.548120  1
  Al  Al564  1  0.999000  0.591444  0.548120  1
  Al  Al565  1  0.256740  0.257051  0.449745  1
  Al  Al566  1  0.756740  0.757051  0.449745  1
  Al  Al567  1  0.673672  0.173992  0.533386  1
  Al  Al568  1  0.173672  0.673992  0.533386  1
  Al  Al569  1  0.499972  0.090528  0.456721  1
  Al  Al570  1  0.999972  0.590528  0.456721  1
  Al  Al571  1  0.916681  0.007075  0.540656  1
  Al  Al572  1  0.416681  0.507075  0.540656  1
  Al  Al573  1  0.174145  0.082336  0.464458  1
  Al  Al574  1  0.674145  0.582336  0.464458  1
  Al  Al575  1  0.591117  0.999324  0.548121  1
  Al  Al576  1  0.091117  0.499324  0.548121  1
  Al  Al577  1  0.294420  0.386670  0.571072  1
  Al  Al578  1  0.794420  0.886670  0.571072  1
  Al  Al579  1  0.877589  0.469976  0.487240  1
  Al  Al580  1  0.377589  0.969976  0.487240  1
  Al  Al581  1  0.392574  0.075081  0.472146  1
  Al  Al582  1  0.892574  0.575081  0.472146  1
  Al  Al583  1  0.809391  0.991731  0.555980  1
  Al  Al584  1  0.309391  0.491731  0.555980  1
  Al  Al585  1  0.066766  0.067080  0.479924  1
  Al  Al586  1  0.566766  0.567080  0.479924  1
  Al  Al587  1  0.483665  0.983988  0.563571  1
  Al  Al588  1  0.983665  0.483988  0.563571  1
  Al  Al589  1  0.090210  0.500291  0.456721  1
  Al  Al590  1  0.590210  1.000291  0.456721  1
  Al  Al591  1  0.506748  0.417009  0.540656  1
  Al  Al592  1  0.006748  0.917009  0.540656  1
  Al  Al593  1  0.468831  0.287276  0.419195  1
  Al  Al594  1  0.968831  0.787276  0.419195  1
  Al  Al595  1  0.886063  0.204303  0.502925  1
  Al  Al596  1  0.386063  0.704303  0.502925  1
  Al  Al597  1  0.136345  0.044748  0.571073  1
  Al  Al598  1  0.636345  0.544748  0.571073  1
  Al  Al599  1  0.719661  0.127907  0.487241  1
  Al  Al600  1  0.219661  0.627907  0.487241  1
  Al  Al601  1  0.908351  0.226175  0.639505  1
  Al  Al602  1  0.408351  0.726175  0.639505  1
  Al  Al603  1  0.330940  0.142855  0.721469  1
  Al  Al604  1  0.830940  0.642855  0.721469  1
  Al  Al605  1  0.286907  0.970024  0.670270  1
  Al  Al606  1  0.786907  0.470024  0.670270  1
  Al  Al607  1  0.870916  0.052859  0.586956  1
  Al  Al608  1  0.370916  0.552859  0.586956  1
  Al  Al609  1  0.165675  0.257722  0.632389  1
  Al  Al610  1  0.665675  0.757722  0.632389  1
  Al  Al611  1  0.580836  0.176087  0.714537  1
  Al  Al612  1  0.080836  0.676087  0.714537  1
  Al  Al613  1  0.340808  0.341137  0.617345  1
  Al  Al614  1  0.840808  0.841137  0.617345  1
  Al  Al615  1  0.755951  0.256292  0.700107  1
  Al  Al616  1  0.255951  0.756292  0.700107  1
  Al  Al617  1  0.999763  0.090912  0.706438  1
  Al  Al618  1  0.499763  0.590912  0.706438  1
  Al  Al619  1  0.583300  0.173818  0.624130  1
  Al  Al620  1  0.083300  0.673818  0.624130  1
  Al  Al621  1  0.257386  0.166007  0.632391  1
  Al  Al622  1  0.757386  0.666007  0.632391  1
  Al  Al623  1  0.675734  0.081180  0.714539  1
  Al  Al624  1  0.175734  0.581180  0.714539  1
  Al  Al625  1  0.881705  0.974750  0.735329  1
  Al  Al626  1  0.381705  0.474750  0.735329  1
  Al  Al627  1  0.460870  0.053189  0.654246  1
  Al  Al628  1  0.960870  0.553189  0.654246  1
  Al  Al629  1  0.892502  0.081297  0.721468  1
  Al  Al630  1  0.392502  0.581297  0.721468  1
  Al  Al631  1  0.475840  0.158693  0.639503  1
  Al  Al632  1  0.975840  0.658693  0.639503  1
  Al  Al633  1  0.150209  0.150540  0.648690  1
  Al  Al634  1  0.650209  0.650540  0.648690  1
  Al  Al635  1  0.567269  0.067621  0.728379  1
  Al  Al636  1  0.067269  0.567621  0.728379  1
  Al  Al637  1  0.090560  1.000120  0.706437  1
  Al  Al638  1  0.590560  0.500120  0.706437  1
  Al  Al639  1  0.673481  0.083638  0.624130  1
  Al  Al640  1  0.173481  0.583638  0.624130  1
  Al  Al641  1  0.969680  0.287246  0.670271  1
  Al  Al642  1  0.469680  0.787246  0.670271  1
  Al  Al643  1  0.552528  0.371245  0.586957  1
  Al  Al644  1  0.052528  0.871245  0.586957  1
  Al  Al645  1  0.224398  0.132062  0.735331  1
  Al  Al646  1  0.724398  0.632062  0.735331  1
  Al  Al647  1  0.802853  0.211207  0.654248  1
  Al  Al648  1  0.302853  0.711207  0.654248  1
  Al  Al649  1  0.080940  0.892855  0.721469  1
  Al  Al650  1  0.580940  0.392855  0.721469  1
  Al  Al651  1  0.658351  0.976175  0.639505  1
  Al  Al652  1  0.158351  0.476175  0.639505  1
  Al  Al653  1  0.120916  0.302859  0.586956  1
  Al  Al654  1  0.620916  0.802859  0.586956  1
  Al  Al655  1  0.536907  0.220024  0.670270  1
  Al  Al656  1  0.036907  0.720024  0.670270  1
  Al  Al657  1  0.915675  0.007722  0.632389  1
  Al  Al658  1  0.415675  0.507722  0.632389  1
  Al  Al659  1  0.330836  0.926087  0.714537  1
  Al  Al660  1  0.830836  0.426087  0.714537  1
  Al  Al661  1  0.090808  0.091137  0.617345  1
  Al  Al662  1  0.590808  0.591137  0.617345  1
  Al  Al663  1  0.505951  0.006292  0.700107  1
  Al  Al664  1  0.005951  0.506292  0.700107  1
  Al  Al665  1  0.333300  0.923818  0.624130  1
  Al  Al666  1  0.833300  0.423818  0.624130  1
  Al  Al667  1  0.749763  0.840912  0.706438  1
  Al  Al668  1  0.249763  0.340912  0.706438  1
  Al  Al669  1  0.007386  0.916007  0.632391  1
  Al  Al670  1  0.507386  0.416007  0.632391  1
  Al  Al671  1  0.425734  0.831180  0.714539  1
  Al  Al672  1  0.925734  0.331180  0.714539  1
  Al  Al673  1  0.131705  0.224750  0.735329  1
  Al  Al674  1  0.631705  0.724750  0.735329  1
  Al  Al675  1  0.710870  0.303189  0.654246  1
  Al  Al676  1  0.210870  0.803189  0.654246  1
  Al  Al677  1  0.225840  0.908693  0.639503  1
  Al  Al678  1  0.725840  0.408693  0.639503  1
  Al  Al679  1  0.642502  0.831297  0.721468  1
  Al  Al680  1  0.142502  0.331297  0.721468  1
  Al  Al681  1  0.900209  0.900540  0.648690  1
  Al  Al682  1  0.400209  0.400540  0.648690  1
  Al  Al683  1  0.317269  0.817621  0.728379  1
  Al  Al684  1  0.817269  0.317621  0.728379  1
  Al  Al685  1  0.923481  0.333638  0.624130  1
  Al  Al686  1  0.423481  0.833638  0.624130  1
  Al  Al687  1  0.340560  0.250120  0.706437  1
  Al  Al688  1  0.840560  0.750120  0.706437  1
  Al  Al689  1  0.302528  0.121245  0.586957  1
  Al  Al690  1  0.802528  0.621245  0.586957  1
  Al  Al691  1  0.719680  0.037246  0.670271  1
  Al  Al692  1  0.219680  0.537246  0.670271  1
  Al  Al693  1  0.974398  0.882062  0.735331  1
  Al  Al694  1  0.474398  0.382062  0.735331  1
  Al  Al695  1  0.552853  0.961207  0.654248  1
  Al  Al696  1  0.052853  0.461207  0.654248  1
