# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.44928143
_cell_length_b   21.16198624
_cell_length_c   49.51261992
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   89.95053814
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta
_chemical_formula_sum   Ta264
_cell_volume   10948.6002445
_cell_formula_units_Z   264
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  0.262300  0.187689  0.325383  1
  Ta  Ta2  1  0.248907  0.610713  0.292623  1
  Ta  Ta3  1  0.760845  0.976996  0.342360  1
  Ta  Ta4  1  0.800417  0.396019  0.307904  1
  Ta  Ta5  1  0.547531  0.644575  0.285100  1
  Ta  Ta6  1  0.527241  0.214990  0.316358  1
  Ta  Ta7  1  0.944169  0.169922  0.331596  1
  Ta  Ta8  1  0.943397  0.612770  0.299355  1
  Ta  Ta9  1  0.634484  0.764651  0.298715  1
  Ta  Ta10  1  0.603409  0.333826  0.333220  1
  Ta  Ta11  1  0.936099  0.042373  0.315679  1
  Ta  Ta12  1  0.987788  0.491272  0.287187  1
  Ta  Ta13  1  0.082552  0.831978  0.331392  1
  Ta  Ta14  1  0.068235  0.261832  0.303240  1
  Ta  Ta15  1  0.384551  0.979207  0.282157  1
  Ta  Ta16  1  0.446048  0.546954  0.315845  1
  Ta  Ta17  1  0.075824  0.958779  0.348777  1
  Ta  Ta18  1  0.088427  0.389647  0.316818  1
  Ta  Ta19  1  0.512558  0.003482  0.331850  1
  Ta  Ta20  1  0.522812  0.427498  0.298961  1
  Ta  Ta21  1  0.674644  0.992468  0.287892  1
  Ta  Ta22  1  0.722601  0.543074  0.313503  1
  Ta  Ta23  1  0.759555  0.814502  0.343393  1
  Ta  Ta24  1  0.773949  0.246975  0.307580  1
  Ta  Ta25  1  0.695375  0.111777  0.303238  1
  Ta  Ta26  1  0.705040  0.667115  0.332962  1
  Ta  Ta27  1  0.902394  0.741116  0.309959  1
  Ta  Ta28  1  0.908619  0.314137  0.344024  1
  Ta  Ta29  1  0.113397  0.953428  0.293610  1
  Ta  Ta30  1  0.134126  0.530600  0.328104  1
  Ta  Ta31  1  0.320907  0.887754  0.319878  1
  Ta  Ta32  1  0.340810  0.454473  0.349441  1
  Ta  Ta33  1  0.264974  0.027022  0.327061  1
  Ta  Ta34  1  0.270663  0.462250  0.292155  1
  Ta  Ta35  1  0.347486  0.763862  0.301213  1
  Ta  Ta36  1  0.325762  0.333545  0.328780  1
  Ta  Ta37  1  0.868780  0.892828  0.308188  1
  Ta  Ta38  1  0.909493  0.478107  0.342653  1
  Ta  Ta39  1  0.574808  0.885135  0.310329  1
  Ta  Ta40  1  0.609485  0.460741  0.347595  1
  Ta  Ta41  1  0.437306  0.099869  0.294764  1
  Ta  Ta42  1  0.439367  0.672853  0.331516  1
  Ta  Ta43  1  0.145023  0.102540  0.293578  1
  Ta  Ta44  1  0.134084  0.688849  0.327547  1
  Ta  Ta45  1  0.269342  0.337107  0.395379  1
  Ta  Ta46  1  0.264641  0.766464  0.360350  1
  Ta  Ta47  1  0.769678  0.123288  0.415091  1
  Ta  Ta48  1  0.771217  0.549747  0.378336  1
  Ta  Ta49  1  0.512798  0.789153  0.349039  1
  Ta  Ta50  1  0.519809  0.363664  0.385089  1
  Ta  Ta51  1  0.948558  0.320492  0.403820  1
  Ta  Ta52  1  0.947723  0.747681  0.367242  1
  Ta  Ta53  1  0.590242  0.904137  0.367937  1
  Ta  Ta54  1  0.598013  0.479112  0.405682  1
  Ta  Ta55  1  0.946751  0.193942  0.387490  1
  Ta  Ta56  1  0.947347  0.620396  0.352652  1
  Ta  Ta57  1  0.085683  0.980005  0.405686  1
  Ta  Ta58  1  0.091092  0.408000  0.370473  1
  Ta  Ta59  1  0.443971  0.119928  0.350347  1
  Ta  Ta60  1  0.437046  0.692801  0.387898  1
  Ta  Ta61  1  0.088677  0.107343  0.421232  1
  Ta  Ta62  1  0.090261  0.534933  0.386402  1
  Ta  Ta63  1  0.517087  0.150423  0.404128  1
  Ta  Ta64  1  0.522569  0.576110  0.367581  1
  Ta  Ta65  1  0.711912  0.123834  0.354045  1
  Ta  Ta66  1  0.707088  0.695810  0.386507  1
  Ta  Ta67  1  0.766265  0.963271  0.412451  1
  Ta  Ta68  1  0.772846  0.390863  0.376434  1
  Ta  Ta69  1  0.704180  0.245897  0.368178  1
  Ta  Ta70  1  0.702512  0.817937  0.404639  1
  Ta  Ta71  1  0.899783  0.889220  0.376144  1
  Ta  Ta72  1  0.907231  0.463118  0.413318  1
  Ta  Ta73  1  0.125271  0.103257  0.358486  1
  Ta  Ta74  1  0.129726  0.677405  0.394955  1
  Ta  Ta75  1  0.324645  0.035430  0.386958  1
  Ta  Ta76  1  0.328168  0.604538  0.422734  1
  Ta  Ta77  1  0.265426  0.178082  0.393606  1
  Ta  Ta78  1  0.271897  0.603778  0.359679  1
  Ta  Ta79  1  0.322475  0.912733  0.371395  1
  Ta  Ta80  1  0.328563  0.482546  0.404463  1
  Ta  Ta81  1  0.903203  0.049778  0.377970  1
  Ta  Ta82  1  0.905967  0.624186  0.414791  1
  Ta  Ta83  1  0.592233  0.032236  0.384538  1
  Ta  Ta84  1  0.597553  0.606933  0.420763  1
  Ta  Ta85  1  0.434435  0.248901  0.365171  1
  Ta  Ta86  1  0.434435  0.820472  0.402438  1
  Ta  Ta87  1  0.132428  0.264625  0.359632  1
  Ta  Ta88  1  0.125182  0.838479  0.395818  1
  Ta  Ta89  1  0.267007  0.483218  0.468799  1
  Ta  Ta90  1  0.262644  0.909886  0.433106  1
  Ta  Ta91  1  0.770999  0.270414  0.486759  1
  Ta  Ta92  1  0.768100  0.696759  0.450816  1
  Ta  Ta93  1  0.515055  0.936483  0.422449  1
  Ta  Ta94  1  0.518218  0.509945  0.458576  1
  Ta  Ta95  1  0.947310  0.466927  0.475704  1
  Ta  Ta96  1  0.943937  0.893746  0.439445  1
  Ta  Ta97  1  0.594270  0.052872  0.442057  1
  Ta  Ta98  1  0.596198  0.626057  0.478487  1
  Ta  Ta99  1  0.948602  0.340272  0.459969  1
  Ta  Ta100  1  0.944733  0.767055  0.423818  1
  Ta  Ta101  1  0.089748  0.126652  0.477726  1
  Ta  Ta102  1  0.089079  0.553640  0.442412  1
  Ta  Ta103  1  0.440444  0.266588  0.423380  1
  Ta  Ta104  1  0.437815  0.839437  0.460234  1
  Ta  Ta105  1  0.091075  0.253636  0.493387  1
  Ta  Ta106  1  0.087756  0.680616  0.457662  1
  Ta  Ta107  1  0.519327  0.297250  0.476449  1
  Ta  Ta108  1  0.516203  0.723144  0.440582  1
  Ta  Ta109  1  0.710031  0.269930  0.423116  1
  Ta  Ta110  1  0.706853  0.842402  0.459155  1
  Ta  Ta111  1  0.769878  0.110357  0.484367  1
  Ta  Ta112  1  0.769678  0.537017  0.448840  1
  Ta  Ta113  1  0.709126  0.391833  0.440572  1
  Ta  Ta114  1  0.706259  0.964617  0.476498  1
  Ta  Ta115  1  0.905007  0.035994  0.448667  1
  Ta  Ta116  1  0.905264  0.609719  0.485135  1
  Ta  Ta117  1  0.131595  0.249820  0.430662  1
  Ta  Ta118  1  0.127056  0.823070  0.466991  1
  Ta  Ta119  1  0.328618  0.178498  0.458046  1
  Ta  Ta120  1  0.325354  0.751234  0.494441  1
  Ta  Ta121  1  0.267835  0.323823  0.466352  1
  Ta  Ta122  1  0.264317  0.750792  0.430764  1
  Ta  Ta123  1  0.325321  0.056032  0.441320  1
  Ta  Ta124  1  0.326717  0.629024  0.477230  1
  Ta  Ta125  1  0.907509  0.197719  0.450375  1
  Ta  Ta126  1  0.904175  0.770548  0.486661  1
  Ta  Ta127  1  0.597523  0.180956  0.456776  1
  Ta  Ta128  1  0.594632  0.753787  0.493307  1
  Ta  Ta129  1  0.440165  0.393765  0.438362  1
  Ta  Ta130  1  0.437255  0.967177  0.475090  1
  Ta  Ta131  1  0.132102  0.410489  0.432322  1
  Ta  Ta132  1  0.127731  0.984112  0.468703  1
  Ta  Ta133  1  0.265344  0.629560  0.540978  1
  Ta  Ta134  1  0.266124  0.056590  0.504881  1
  Ta  Ta135  1  0.770092  0.416354  0.559112  1
  Ta  Ta136  1  0.767736  0.843037  0.523069  1
  Ta  Ta137  1  0.517997  0.083563  0.494640  1
  Ta  Ta138  1  0.516842  0.656765  0.531266  1
  Ta  Ta139  1  0.944701  0.613080  0.547296  1
  Ta  Ta140  1  0.946267  0.040227  0.511498  1
  Ta  Ta141  1  0.598608  0.200036  0.514296  1
  Ta  Ta142  1  0.595605  0.773109  0.551166  1
  Ta  Ta143  1  0.946448  0.486172  0.532094  1
  Ta  Ta144  1  0.944519  0.913234  0.495940  1
  Ta  Ta145  1  0.091780  0.273153  0.549879  1
  Ta  Ta146  1  0.087641  0.699765  0.514015  1
  Ta  Ta147  1  0.440375  0.413220  0.496442  1
  Ta  Ta148  1  0.438612  0.986275  0.532595  1
  Ta  Ta149  1  0.089778  0.399771  0.565675  1
  Ta  Ta150  1  0.087012  0.826632  0.529448  1
  Ta  Ta151  1  0.518327  0.443914  0.549581  1
  Ta  Ta152  1  0.516279  0.869891  0.513033  1
  Ta  Ta153  1  0.709392  0.416000  0.495232  1
  Ta  Ta154  1  0.707548  0.988226  0.531176  1
  Ta  Ta155  1  0.773299  0.257217  0.556046  1
  Ta  Ta156  1  0.767730  0.683701  0.520892  1
  Ta  Ta157  1  0.707646  0.537902  0.512982  1
  Ta  Ta158  1  0.710257  0.110736  0.547864  1
  Ta  Ta159  1  0.908136  0.182752  0.520550  1
  Ta  Ta160  1  0.903181  0.756296  0.557181  1
  Ta  Ta161  1  0.130963  0.396154  0.502863  1
  Ta  Ta162  1  0.128574  0.969360  0.538976  1
  Ta  Ta163  1  0.327939  0.324297  0.530185  1
  Ta  Ta164  1  0.325972  0.897223  0.566300  1
  Ta  Ta165  1  0.266476  0.470026  0.538738  1
  Ta  Ta166  1  0.264663  0.896750  0.502650  1
  Ta  Ta167  1  0.329491  0.202277  0.512716  1
  Ta  Ta168  1  0.326583  0.775152  0.549002  1
  Ta  Ta169  1  0.907780  0.344167  0.522550  1
  Ta  Ta170  1  0.904713  0.917003  0.558619  1
  Ta  Ta171  1  0.596862  0.328012  0.529455  1
  Ta  Ta172  1  0.595447  0.900425  0.565998  1
  Ta  Ta173  1  0.438873  0.540684  0.511378  1
  Ta  Ta174  1  0.441489  0.114392  0.547206  1
  Ta  Ta175  1  0.129166  0.556996  0.504656  1
  Ta  Ta176  1  0.131130  0.130956  0.540586  1
  Ta  Ta177  1  0.264184  0.776223  0.612933  1
  Ta  Ta178  1  0.270062  0.203605  0.576893  1
  Ta  Ta179  1  0.761791  0.561429  0.631353  1
  Ta  Ta180  1  0.771189  0.988512  0.595675  1
  Ta  Ta181  1  0.520804  0.230906  0.566864  1
  Ta  Ta182  1  0.516627  0.803372  0.604300  1
  Ta  Ta183  1  0.944451  0.759442  0.618722  1
  Ta  Ta184  1  0.950877  0.186678  0.583333  1
  Ta  Ta185  1  0.600607  0.347438  0.587643  1
  Ta  Ta186  1  0.602851  0.917849  0.624272  1
  Ta  Ta187  1  0.942259  0.631730  0.603033  1
  Ta  Ta188  1  0.947830  0.059271  0.567979  1
  Ta  Ta189  1  0.088467  0.419356  0.622260  1
  Ta  Ta190  1  0.087792  0.846468  0.585548  1
  Ta  Ta191  1  0.438106  0.560075  0.569312  1
  Ta  Ta192  1  0.446536  0.135378  0.604655  1
  Ta  Ta193  1  0.085613  0.547014  0.636865  1
  Ta  Ta194  1  0.090263  0.973020  0.601826  1
  Ta  Ta195  1  0.512586  0.590050  0.623124  1
  Ta  Ta196  1  0.519439  0.016615  0.585159  1
  Ta  Ta197  1  0.705752  0.561588  0.567828  1
  Ta  Ta198  1  0.714097  0.129507  0.602259  1
  Ta  Ta199  1  0.771300  0.399811  0.629312  1
  Ta  Ta200  1  0.766700  0.830145  0.593960  1
  Ta  Ta201  1  0.704612  0.684097  0.585494  1
  Ta  Ta202  1  0.712966  0.252182  0.616301  1
  Ta  Ta203  1  0.910464  0.328121  0.593621  1
  Ta  Ta204  1  0.904473  0.902432  0.629754  1
  Ta  Ta205  1  0.127388  0.542530  0.574798  1
  Ta  Ta206  1  0.133414  0.117250  0.611240  1
  Ta  Ta207  1  0.323260  0.470453  0.602039  1
  Ta  Ta208  1  0.324626  0.043892  0.635259  1
  Ta  Ta209  1  0.264913  0.616158  0.611089  1
  Ta  Ta210  1  0.266915  0.043813  0.574211  1
  Ta  Ta211  1  0.333079  0.348411  0.584719  1
  Ta  Ta212  1  0.333640  0.921689  0.621312  1
  Ta  Ta213  1  0.903427  0.489268  0.595146  1
  Ta  Ta214  1  0.912309  0.062853  0.630844  1
  Ta  Ta215  1  0.593277  0.474587  0.604020  1
  Ta  Ta216  1  0.591762  0.046359  0.638944  1
  Ta  Ta217  1  0.437116  0.687619  0.583936  1
  Ta  Ta218  1  0.446372  0.263648  0.621917  1
  Ta  Ta219  1  0.127889  0.703676  0.576298  1
  Ta  Ta220  1  0.137114  0.277749  0.613243  1
  Ta  Ta221  1  0.262902  0.919640  0.682004  1
  Ta  Ta222  1  0.278087  0.352972  0.645978  1
  Ta  Ta223  1  0.768505  0.706133  0.697118  1
  Ta  Ta224  1  0.771809  0.138780  0.662136  1
  Ta  Ta225  1  0.524375  0.378986  0.641167  1
  Ta  Ta226  1  0.509554  0.951833  0.673119  1
  Ta  Ta227  1  0.968297  0.905844  0.686176  1
  Ta  Ta228  1  0.956373  0.333563  0.657554  1
  Ta  Ta229  1  0.601655  0.493560  0.664216  1
  Ta  Ta230  1  0.599629  0.067053  0.694660  1
  Ta  Ta231  1  0.950144  0.778320  0.672413  1
  Ta  Ta232  1  0.961429  0.206918  0.640223  1
  Ta  Ta233  1  0.096736  0.554083  0.689510  1
  Ta  Ta234  1  0.093654  -0.003017  0.657785  1
  Ta  Ta235  1  0.430480  0.706572  0.641392  1
  Ta  Ta236  1  0.463195  0.281847  0.679417  1
  Ta  Ta237  1  0.049720  0.675031  0.701419  1
  Ta  Ta238  1  0.101081  0.124561  0.673677  1
  Ta  Ta239  1  0.514211  0.738919  0.690287  1
  Ta  Ta240  1  0.523854  0.162751  0.657414  1
  Ta  Ta241  1  0.695906  0.712107  0.640284  1
  Ta  Ta242  1  0.715599  0.273654  0.667494  1
  Ta  Ta243  1  0.813215  0.561843  0.696828  1
  Ta  Ta244  1  0.774339  0.979348  0.664032  1
  Ta  Ta245  1  0.711030  0.833356  0.660632  1
  Ta  Ta246  1  0.704810  0.391250  0.686901  1
  Ta  Ta247  1  0.902301  0.476604  0.662221  1
  Ta  Ta248  1  0.892699  0.064423  0.695862  1
  Ta  Ta249  1  0.127997  0.690349  0.645837  1
  Ta  Ta250  1  0.169686  0.274067  0.681058  1
  Ta  Ta251  1  0.311385  0.625263  0.674097  1
  Ta  Ta252  1  0.362596  0.174107  0.701371  1
  Ta  Ta253  1  0.237588  0.770594  0.681258  1
  Ta  Ta254  1  0.276178  0.189812  0.646900  1
  Ta  Ta255  1  0.335595  0.499390  0.655034  1
  Ta  Ta256  1  0.341424  0.054635  0.686145  1
  Ta  Ta257  1  0.903800  0.639505  0.659857  1
  Ta  Ta258  1  0.922494  0.214332  0.695415  1
  Ta  Ta259  1  0.595028  0.619335  0.674561  1
  Ta  Ta260  1  0.652908  0.188059  0.707126  1
  Ta  Ta261  1  0.433832  0.833126  0.656194  1
  Ta  Ta262  1  0.404148  0.403005  0.690755  1
  Ta  Ta263  1  0.128931  0.853332  0.645268  1
  Ta  Ta264  1  0.133765  0.425712  0.679133  1
