# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.09296776
_cell_length_b   25.48640606
_cell_length_c   46.15520211
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta
_chemical_formula_sum   Ta300
_cell_volume   11872.6630159
_cell_formula_units_Z   300
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
  Ta  Ta1  1  0.040008  0.900419  0.273963  1
  Ta  Ta2  1  0.007706  0.455339  0.311760  1
  Ta  Ta3  1  0.494614  0.679987  0.292060  1
  Ta  Ta4  1  0.502808  0.233579  0.338007  1
  Ta  Ta5  1  0.067651  0.556670  0.281509  1
  Ta  Ta6  1  0.065399  0.093127  0.325117  1
  Ta  Ta7  1  0.226977  0.683919  0.283997  1
  Ta  Ta8  1  0.240453  0.253390  0.330762  1
  Ta  Ta9  1  0.769365  0.653284  0.300053  1
  Ta  Ta10  1  0.760279  0.212604  0.347760  1
  Ta  Ta11  1  0.935200  0.819728  0.305504  1
  Ta  Ta12  1  0.939045  0.372591  0.349853  1
  Ta  Ta13  1  0.433792  0.879310  0.351489  1
  Ta  Ta14  1  0.427816  0.313061  0.300401  1
  Ta  Ta15  1  0.571310  0.595262  0.327232  1
  Ta  Ta16  1  0.571248  0.009282  0.284177  1
  Ta  Ta17  1  0.746905  0.899318  0.283800  1
  Ta  Ta18  1  0.746253  0.433767  0.324188  1
  Ta  Ta19  1  0.267260  0.473849  0.304547  1
  Ta  Ta20  1  0.263110  0.037384  0.354335  1
  Ta  Ta21  1  0.133764  0.748455  0.334300  1
  Ta  Ta22  1  0.137465  0.177830  0.293864  1
  Ta  Ta23  1  0.965627  0.725187  0.280601  1
  Ta  Ta24  1  0.963461  0.270236  0.321253  1
  Ta  Ta25  1  0.033528  0.638711  0.316103  1
  Ta  Ta26  1  0.036192  0.191946  0.357101  1
  Ta  Ta27  1  0.870694  0.728567  0.343300  1
  Ta  Ta28  1  0.869135  0.158029  0.302496  1
  Ta  Ta29  1  0.375123  0.528122  0.355246  1
  Ta  Ta30  1  0.363384  0.963130  0.315771  1
  Ta  Ta31  1  0.625657  0.942907  0.329495  1
  Ta  Ta32  1  0.622478  0.378963  0.281483  1
  Ta  Ta33  1  0.474793  0.863063  0.292141  1
  Ta  Ta34  1  0.467677  0.413473  0.333509  1
  Ta  Ta35  1  0.547141  0.498178  0.300526  1
  Ta  Ta36  1  0.536974  0.053095  0.343970  1
  Ta  Ta37  1  0.108062  0.549366  0.346095  1
  Ta  Ta38  1  0.103916  0.987320  0.308271  1
  Ta  Ta39  1  0.401304  0.769667  0.325141  1
  Ta  Ta40  1  0.400048  0.200927  0.284875  1
  Ta  Ta41  1  0.606757  0.705019  0.351512  1
  Ta  Ta42  1  0.603509  0.132937  0.309358  1
  Ta  Ta43  1  0.904288  0.921960  0.333892  1
  Ta  Ta44  1  0.897809  0.352516  0.288976  1
  Ta  Ta45  1  0.321709  0.579887  0.297218  1
  Ta  Ta46  1  0.320248  0.142842  0.341071  1
  Ta  Ta47  1  0.189515  0.866001  0.320121  1
  Ta  Ta48  1  0.161652  0.282888  0.274810  1
  Ta  Ta49  1  0.827904  0.540288  0.314069  1
  Ta  Ta50  1  0.817448  0.102167  0.358866  1
  Ta  Ta51  1  0.686889  0.827388  0.336643  1
  Ta  Ta52  1  0.686786  0.252903  0.289938  1
  Ta  Ta53  1  0.207135  0.795905  0.277375  1
  Ta  Ta54  1  0.182310  0.360072  0.317537  1
  Ta  Ta55  1  0.681232  0.765483  0.291921  1
  Ta  Ta56  1  0.682855  0.321374  0.335303  1
  Ta  Ta57  1  0.321426  0.648993  0.340127  1
  Ta  Ta58  1  0.330554  0.076758  0.295502  1
  Ta  Ta59  1  0.818951  0.606894  0.358018  1
  Ta  Ta60  1  0.813167  0.030289  0.312323  1
  Ta  Ta61  1  1.000600  0.017072  0.363447  1
  Ta  Ta62  1  0.003249  0.580574  0.405848  1
  Ta  Ta63  1  0.503735  0.798286  0.385149  1
  Ta  Ta64  1  0.502710  0.361511  0.428569  1
  Ta  Ta65  1  0.069091  0.664235  0.372494  1
  Ta  Ta66  1  0.067226  0.223955  0.417063  1
  Ta  Ta67  1  0.241128  0.818327  0.376899  1
  Ta  Ta68  1  0.241573  0.382053  0.419354  1
  Ta  Ta69  1  0.764166  0.778708  0.393932  1
  Ta  Ta70  1  0.763895  0.341196  0.437829  1
  Ta  Ta71  1  0.936773  0.935843  0.399735  1
  Ta  Ta72  1  0.938013  0.499046  0.441294  1
  Ta  Ta73  1  0.436676  0.006750  0.442345  1
  Ta  Ta74  1  0.438015  0.443033  0.392727  1
  Ta  Ta75  1  0.568865  0.717380  0.420143  1
  Ta  Ta76  1  0.567003  0.151596  0.374317  1
  Ta  Ta77  1  0.741820  0.997484  0.373391  1
  Ta  Ta78  1  0.742246  0.560367  0.414868  1
  Ta  Ta79  1  0.265170  0.600935  0.397150  1
  Ta  Ta80  1  0.263360  0.163690  0.444477  1
  Ta  Ta81  1  0.132178  0.872761  0.427124  1
  Ta  Ta82  1  0.131197  0.308495  0.378829  1
  Ta  Ta83  1  0.968136  0.838870  0.367766  1
  Ta  Ta84  1  0.967901  0.401673  0.410498  1
  Ta  Ta85  1  0.037453  0.759337  0.403321  1
  Ta  Ta86  1  0.037607  0.321670  0.446877  1
  Ta  Ta87  1  0.872715  0.851016  0.436675  1
  Ta  Ta88  1  0.871915  0.286750  0.388326  1
  Ta  Ta89  1  0.373266  0.654602  0.447631  1
  Ta  Ta90  1  0.372165  0.090543  0.403713  1
  Ta  Ta91  1  0.631518  0.069260  0.413595  1
  Ta  Ta92  1  0.634748  0.507077  0.365012  1
  Ta  Ta93  1  0.464979  0.977172  0.382578  1
  Ta  Ta94  1  0.468499  0.540478  0.423720  1
  Ta  Ta95  1  0.538956  0.621282  0.388140  1
  Ta  Ta96  1  0.537389  0.183003  0.435183  1
  Ta  Ta97  1  0.106387  0.675850  0.438878  1
  Ta  Ta98  1  0.104710  0.111260  0.393886  1
  Ta  Ta99  1  0.398817  0.893610  0.418226  1
  Ta  Ta100  1  0.398749  0.329711  0.368722  1
  Ta  Ta101  1  0.605908  0.829747  0.445635  1
  Ta  Ta102  1  0.604876  0.265372  0.397823  1
  Ta  Ta103  1  0.898943  0.048096  0.423124  1
  Ta  Ta104  1  0.902283  0.484858  0.373698  1
  Ta  Ta105  1  0.321710  0.710629  0.386493  1
  Ta  Ta106  1  0.319603  0.272918  0.431427  1
  Ta  Ta107  1  0.184497  0.992173  0.411692  1
  Ta  Ta108  1  0.186174  0.428939  0.361298  1
  Ta  Ta109  1  0.819793  0.669500  0.404790  1
  Ta  Ta110  1  0.819378  0.231683  0.450417  1
  Ta  Ta111  1  0.685011  0.950123  0.430122  1
  Ta  Ta112  1  0.686330  0.386166  0.380436  1
  Ta  Ta113  1  0.183764  0.927930  0.366304  1
  Ta  Ta114  1  0.186267  0.491602  0.407565  1
  Ta  Ta115  1  0.685408  0.886342  0.385184  1
  Ta  Ta116  1  0.686189  0.450367  0.426358  1
  Ta  Ta117  1  0.320267  0.773682  0.433348  1
  Ta  Ta118  1  0.319562  0.208765  0.386619  1
  Ta  Ta119  1  0.819695  0.731937  0.451032  1
  Ta  Ta120  1  0.818771  0.166740  0.404922  1
  Ta  Ta121  1  1.002139  0.143488  0.453651  1
  Ta  Ta122  1  1.002538  0.707079  0.498817  1
  Ta  Ta123  1  0.502222  0.925411  0.477845  1
  Ta  Ta124  1  0.502998  0.488584  0.519686  1
  Ta  Ta125  1  0.068319  0.788350  0.464050  1
  Ta  Ta126  1  0.068080  0.351204  0.507410  1
  Ta  Ta127  1  0.240798  0.945658  0.468861  1
  Ta  Ta128  1  0.241310  0.508859  0.510813  1
  Ta  Ta129  1  0.763752  0.905158  0.486728  1
  Ta  Ta130  1  0.764478  0.468442  0.528790  1
  Ta  Ta131  1  0.937130  0.062796  0.490208  1
  Ta  Ta132  1  0.936710  0.625824  0.533604  1
  Ta  Ta133  1  0.437584  0.133505  0.532669  1
  Ta  Ta134  1  0.437366  0.569948  0.484537  1
  Ta  Ta135  1  0.567863  0.844103  0.513041  1
  Ta  Ta136  1  0.567780  0.280456  0.464950  1
  Ta  Ta137  1  0.741043  0.123315  0.462948  1
  Ta  Ta138  1  0.740989  0.686920  0.507489  1
  Ta  Ta139  1  0.264132  0.727239  0.490140  1
  Ta  Ta140  1  0.264169  0.290641  0.534630  1
  Ta  Ta141  1  0.132146  0.999700  0.518590  1
  Ta  Ta142  1  0.132695  0.435886  0.469281  1
  Ta  Ta143  1  0.967229  0.965512  0.460016  1
  Ta  Ta144  1  0.967675  0.528782  0.502099  1
  Ta  Ta145  1  0.037460  0.885324  0.495544  1
  Ta  Ta146  1  0.037764  0.448555  0.537571  1
  Ta  Ta147  1  0.872636  0.978087  0.528335  1
  Ta  Ta148  1  0.873175  0.414307  0.479067  1
  Ta  Ta149  1  0.372382  0.781230  0.540509  1
  Ta  Ta150  1  0.372945  0.217715  0.493849  1
  Ta  Ta151  1  0.632421  0.196260  0.503773  1
  Ta  Ta152  1  0.632875  0.632856  0.457121  1
  Ta  Ta153  1  0.467309  0.103910  0.472124  1
  Ta  Ta154  1  0.467436  0.667011  0.516319  1
  Ta  Ta155  1  0.537693  0.747121  0.481260  1
  Ta  Ta156  1  0.538048  0.310069  0.525474  1
  Ta  Ta157  1  0.105641  0.802420  0.531492  1
  Ta  Ta158  1  0.105610  0.239050  0.484257  1
  Ta  Ta159  1  0.399261  0.021059  0.509241  1
  Ta  Ta160  1  0.399813  0.457288  0.459972  1
  Ta  Ta161  1  0.605547  0.956674  0.537638  1
  Ta  Ta162  1  0.606116  0.392925  0.488374  1
  Ta  Ta163  1  0.899658  0.174957  0.513385  1
  Ta  Ta164  1  0.899612  0.611675  0.466178  1
  Ta  Ta165  1  0.319752  0.836716  0.479367  1
  Ta  Ta166  1  0.320147  0.399936  0.521888  1
  Ta  Ta167  1  0.185461  0.119128  0.502128  1
  Ta  Ta168  1  0.185925  0.555506  0.453930  1
  Ta  Ta169  1  0.819651  0.795598  0.497665  1
  Ta  Ta170  1  0.820354  0.358913  0.540968  1
  Ta  Ta171  1  0.685562  0.077068  0.520747  1
  Ta  Ta172  1  0.686077  0.513522  0.471957  1
  Ta  Ta173  1  0.184952  0.055205  0.456728  1
  Ta  Ta174  1  0.185423  0.618525  0.499948  1
  Ta  Ta175  1  0.685080  0.014025  0.475645  1
  Ta  Ta176  1  0.685417  0.577377  0.518221  1
  Ta  Ta177  1  0.319303  0.900496  0.525680  1
  Ta  Ta178  1  0.319770  0.336889  0.476855  1
  Ta  Ta179  1  0.819513  0.858529  0.543726  1
  Ta  Ta180  1  0.819831  0.294895  0.495527  1
  Ta  Ta181  1  0.003073  0.270562  0.543995  1
  Ta  Ta182  1  0.002797  0.833454  0.591955  1
  Ta  Ta183  1  0.502716  0.052444  0.569055  1
  Ta  Ta184  1  0.500125  0.614852  0.611619  1
  Ta  Ta185  1  0.067561  0.914920  0.556399  1
  Ta  Ta186  1  0.067487  0.478480  0.597736  1
  Ta  Ta187  1  0.241537  0.072765  0.559813  1
  Ta  Ta188  1  0.239389  0.635196  0.603595  1
  Ta  Ta189  1  0.763857  0.031948  0.578255  1
  Ta  Ta190  1  0.764051  0.595535  0.620997  1
  Ta  Ta191  1  0.938076  0.190175  0.580599  1
  Ta  Ta192  1  0.937315  0.749876  0.625254  1
  Ta  Ta193  1  0.438240  0.262398  0.623223  1
  Ta  Ta194  1  0.435801  0.696697  0.577374  1
  Ta  Ta195  1  0.567421  0.970897  0.604911  1
  Ta  Ta196  1  0.568622  0.407248  0.555191  1
  Ta  Ta197  1  0.741957  0.250400  0.553177  1
  Ta  Ta198  1  0.740790  0.813139  0.600562  1
  Ta  Ta199  1  0.263554  0.853522  0.582824  1
  Ta  Ta200  1  0.263137  0.416182  0.623716  1
  Ta  Ta201  1  0.133509  0.127345  0.609286  1
  Ta  Ta202  1  0.131805  0.563119  0.560887  1
  Ta  Ta203  1  0.967761  0.092346  0.550761  1
  Ta  Ta204  1  0.966959  0.654765  0.594457  1
  Ta  Ta205  1  0.037626  0.012300  0.587144  1
  Ta  Ta206  1  0.034341  0.575710  0.630515  1
  Ta  Ta207  1  0.874282  0.105660  0.618770  1
  Ta  Ta208  1  0.872564  0.541503  0.570623  1
  Ta  Ta209  1  0.371116  0.906435  0.632811  1
  Ta  Ta210  1  0.373839  0.344589  0.583845  1
  Ta  Ta211  1  0.633328  0.323609  0.593937  1
  Ta  Ta212  1  0.631994  0.759521  0.550006  1
  Ta  Ta213  1  0.467987  0.230984  0.562411  1
  Ta  Ta214  1  0.467163  0.792638  0.609661  1
  Ta  Ta215  1  0.537074  0.873453  0.573954  1
  Ta  Ta216  1  0.540330  0.436751  0.614806  1
  Ta  Ta217  1  0.103838  0.929031  0.624019  1
  Ta  Ta218  1  0.105966  0.365957  0.574435  1
  Ta  Ta219  1  0.400544  0.148652  0.599783  1
  Ta  Ta220  1  0.398693  0.584249  0.551759  1
  Ta  Ta221  1  0.606755  0.084422  0.628859  1
  Ta  Ta222  1  0.606342  0.520342  0.579255  1
  Ta  Ta223  1  0.900538  0.303056  0.603830  1
  Ta  Ta224  1  0.898914  0.738275  0.558802  1
  Ta  Ta225  1  0.319343  0.963529  0.571326  1
  Ta  Ta226  1  0.318499  0.527531  0.612115  1
  Ta  Ta227  1  0.186435  0.247320  0.592680  1
  Ta  Ta228  1  0.185105  0.682199  0.546588  1
  Ta  Ta229  1  0.819413  0.922403  0.590092  1
  Ta  Ta230  1  0.821818  0.486925  0.631924  1
  Ta  Ta231  1  0.685889  0.205404  0.611008  1
  Ta  Ta232  1  0.684899  0.640407  0.564221  1
  Ta  Ta233  1  0.185922  0.182321  0.547219  1
  Ta  Ta234  1  0.185513  0.744405  0.592943  1
  Ta  Ta235  1  0.685803  0.141117  0.566193  1
  Ta  Ta236  1  0.683308  0.703572  0.611003  1
  Ta  Ta237  1  0.319151  0.027781  0.617196  1
  Ta  Ta238  1  0.319891  0.463850  0.567283  1
  Ta  Ta239  1  0.819441  0.985242  0.636272  1
  Ta  Ta240  1  0.820515  0.422241  0.586079  1
  Ta  Ta241  1  0.004368  0.397437  0.634234  1
  Ta  Ta242  1  0.998053  0.958833  0.685771  1
  Ta  Ta243  1  0.502729  0.180591  0.659587  1
  Ta  Ta244  1  0.530736  0.725954  0.705216  1
  Ta  Ta245  1  0.066616  0.041532  0.647728  1
  Ta  Ta246  1  0.059504  0.591912  0.693690  1
  Ta  Ta247  1  0.245156  0.201511  0.649831  1
  Ta  Ta248  1  0.245674  0.757584  0.697651  1
  Ta  Ta249  1  0.765028  0.160911  0.666819  1
  Ta  Ta250  1  0.792983  0.740951  0.716576  1
  Ta  Ta251  1  0.939921  0.322103  0.672836  1
  Ta  Ta252  1  0.933536  0.859555  0.716313  1
  Ta  Ta253  1  0.433077  0.404307  0.713227  1
  Ta  Ta254  1  0.437454  0.816885  0.671104  1
  Ta  Ta255  1  0.577835  0.101072  0.697174  1
  Ta  Ta256  1  0.570868  0.534102  0.645819  1
  Ta  Ta257  1  0.742780  0.377334  0.643445  1
  Ta  Ta258  1  0.737302  0.941394  0.692954  1
  Ta  Ta259  1  0.259089  0.980217  0.673418  1
  Ta  Ta260  1  0.260563  0.513676  0.712735  1
  Ta  Ta261  1  0.136222  0.256351  0.695030  1
  Ta  Ta262  1  0.133137  0.684381  0.654655  1
  Ta  Ta263  1  0.969146  0.222452  0.640569  1
  Ta  Ta264  1  0.979750  0.776611  0.681423  1
  Ta  Ta265  1  0.042047  0.144017  0.676324  1
  Ta  Ta266  1  0.038528  0.688403  0.716735  1
  Ta  Ta267  1  0.868053  0.236659  0.703665  1
  Ta  Ta268  1  0.868092  0.667392  0.664016  1
  Ta  Ta269  1  0.383188  0.035114  0.716053  1
  Ta  Ta270  1  0.379116  0.470506  0.667459  1
  Ta  Ta271  1  0.638727  0.450656  0.681434  1
  Ta  Ta272  1  0.630577  0.885867  0.642376  1
  Ta  Ta273  1  0.468318  0.360747  0.653390  1
  Ta  Ta274  1  0.457817  0.915875  0.696955  1
  Ta  Ta275  1  0.537400  1.000699  0.664003  1
  Ta  Ta276  1  0.526962  0.551675  0.704887  1
  Ta  Ta277  1  0.107794  0.061694  0.708586  1
  Ta  Ta278  1  0.103038  0.491938  0.662295  1
  Ta  Ta279  1  0.401971  0.281217  0.688182  1
  Ta  Ta280  1  0.398283  0.708338  0.645865  1
  Ta  Ta281  1  0.605567  0.213411  0.712677  1
  Ta  Ta282  1  0.597678  0.642019  0.669568  1
  Ta  Ta283  1  0.902654  0.429617  0.689520  1
  Ta  Ta284  1  0.897947  0.864857  0.651637  1
  Ta  Ta285  1  0.322635  0.092754  0.662278  1
  Ta  Ta286  1  0.322032  0.646525  0.705562  1
  Ta  Ta287  1  0.192299  0.384096  0.684953  1
  Ta  Ta288  1  0.189212  0.806668  0.639814  1
  Ta  Ta289  1  0.823399  0.054311  0.679990  1
  Ta  Ta290  1  0.765286  0.632499  0.717711  1
  Ta  Ta291  1  0.675325  0.337921  0.702061  1
  Ta  Ta292  1  0.687469  0.764978  0.657808  1
  Ta  Ta293  1  0.187388  0.311951  0.638689  1
  Ta  Ta294  1  0.179161  0.873035  0.683908  1
  Ta  Ta295  1  0.685480  0.271574  0.656531  1
  Ta  Ta296  1  0.681639  0.835621  0.700130  1
  Ta  Ta297  1  0.318764  0.161300  0.707627  1
  Ta  Ta298  1  0.313350  0.585877  0.660628  1
  Ta  Ta299  1  0.843987  0.131501  0.722745  1
  Ta  Ta300  1  0.814027  0.548982  0.679413  1
