# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.16882563
_cell_length_b   21.59199578
_cell_length_c   51.95849801
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   96.51353461
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta
_chemical_formula_sum   Ta264
_cell_volume   10219.9946499
_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  0.163878  0.742770  0.343469  1
  Ta  Ta2  1  0.993442  0.243483  0.300573  1
  Ta  Ta3  1  0.600001  0.501826  0.323181  1
  Ta  Ta4  1  0.473730  0.029726  0.285949  1
  Ta  Ta5  1  0.071826  0.591235  0.334974  1
  Ta  Ta6  1  0.962038  0.103551  0.307328  1
  Ta  Ta7  1  0.105279  0.386994  0.308591  1
  Ta  Ta8  1  0.013864  0.901737  0.273120  1
  Ta  Ta9  1  0.803216  0.601831  0.311188  1
  Ta  Ta10  1  0.733552  0.128789  0.280439  1
  Ta  Ta11  1  0.387616  0.407647  0.333871  1
  Ta  Ta12  1  0.271389  0.933438  0.299544  1
  Ta  Ta13  1  0.754133  0.835243  0.291141  1
  Ta  Ta14  1  0.844144  0.323260  0.329291  1
  Ta  Ta15  1  0.321538  0.672035  0.315441  1
  Ta  Ta16  1  0.197339  0.162105  0.278180  1
  Ta  Ta17  1  0.641392  0.386337  0.302599  1
  Ta  Ta18  1  0.514044  0.892564  0.271884  1
  Ta  Ta19  1  0.584798  0.651065  0.340731  1
  Ta  Ta20  1  0.466735  0.165058  0.302345  1
  Ta  Ta21  1  0.220709  0.506802  0.312015  1
  Ta  Ta22  1  0.118747  0.027249  0.275805  1
  Ta  Ta23  1  0.913172  0.465581  0.340615  1
  Ta  Ta24  1  0.791856  0.981004  0.297213  1
  Ta  Ta25  1  0.114448  0.600214  0.282336  1
  Ta  Ta26  1  0.260450  0.071291  0.319666  1
  Ta  Ta27  1  0.905114  0.486701  0.291751  1
  Ta  Ta28  1  0.040444  0.972592  0.328676  1
  Ta  Ta29  1  0.495745  0.796639  0.318373  1
  Ta  Ta30  1  0.328167  0.295382  0.294995  1
  Ta  Ta31  1  0.637464  0.700725  0.289979  1
  Ta  Ta32  1  0.744968  0.188381  0.329936  1
  Ta  Ta33  1  0.247858  0.804728  0.291484  1
  Ta  Ta34  1  0.490543  0.277728  0.336220  1
  Ta  Ta35  1  0.785271  0.749168  0.333449  1
  Ta  Ta36  1  0.663889  0.262055  0.287365  1
  Ta  Ta37  1  0.393215  0.437904  0.282070  1
  Ta  Ta38  1  0.546685  0.924921  0.320550  1
  Ta  Ta39  1  0.459807  0.580007  0.293350  1
  Ta  Ta40  1  0.632110  0.067531  0.329680  1
  Ta  Ta41  1  0.988675  0.709693  0.301447  1
  Ta  Ta42  1  0.202780  0.185841  0.332930  1
  Ta  Ta43  1  0.016730  0.843235  0.318146  1
  Ta  Ta44  1  0.887224  0.355844  0.274373  1
  Ta  Ta45  1  0.417104  0.703052  0.420401  1
  Ta  Ta46  1  0.292736  0.217221  0.384147  1
  Ta  Ta47  1  0.860347  0.464456  0.400103  1
  Ta  Ta48  1  0.746279  0.986991  0.361088  1
  Ta  Ta49  1  0.334141  0.547786  0.412090  1
  Ta  Ta50  1  0.209430  0.066847  0.376823  1
  Ta  Ta51  1  0.395958  0.346403  0.385468  1
  Ta  Ta52  1  0.268945  0.868762  0.346682  1
  Ta  Ta53  1  0.064908  0.559336  0.387706  1
  Ta  Ta54  1  0.953117  0.086543  0.355778  1
  Ta  Ta55  1  0.656320  0.366061  0.413345  1
  Ta  Ta56  1  0.524590  0.890517  0.375085  1
  Ta  Ta57  1  0.991671  0.812608  0.370253  1
  Ta  Ta58  1  0.119808  0.290824  0.407167  1
  Ta  Ta59  1  0.582602  0.628543  0.393652  1
  Ta  Ta60  1  0.466633  0.143768  0.359207  1
  Ta  Ta61  1  0.935966  0.354956  0.380305  1
  Ta  Ta62  1  0.771533  0.870410  0.344696  1
  Ta  Ta63  1  0.852942  0.617340  0.417798  1
  Ta  Ta64  1  0.728926  0.135895  0.384022  1
  Ta  Ta65  1  0.500796  0.471386  0.385403  1
  Ta  Ta66  1  0.376698  0.991445  0.350117  1
  Ta  Ta67  1  0.182008  0.423757  0.418777  1
  Ta  Ta68  1  0.048988  0.943706  0.379972  1
  Ta  Ta69  1  0.378089  0.555324  0.352768  1
  Ta  Ta70  1  0.529699  0.033091  0.393371  1
  Ta  Ta71  1  0.176906  0.448053  0.366002  1
  Ta  Ta72  1  0.302802  0.935949  0.406312  1
  Ta  Ta73  1  0.741992  0.754036  0.392209  1
  Ta  Ta74  1  0.677485  0.266527  0.373444  1
  Ta  Ta75  1  0.906225  0.665519  0.362711  1
  Ta  Ta76  1  0.030302  0.144839  0.406785  1
  Ta  Ta77  1  0.487896  0.757999  0.366165  1
  Ta  Ta78  1  0.543022  0.228486  0.414539  1
  Ta  Ta79  1  0.056833  0.711494  0.406343  1
  Ta  Ta80  1  0.966562  0.222558  0.364152  1
  Ta  Ta81  1  0.666130  0.397453  0.358243  1
  Ta  Ta82  1  0.792145  0.885817  0.399710  1
  Ta  Ta83  1  0.747770  0.549569  0.366455  1
  Ta  Ta84  1  0.872805  0.028938  0.408680  1
  Ta  Ta85  1  0.272464  0.657330  0.375827  1
  Ta  Ta86  1  0.391895  0.120742  0.417379  1
  Ta  Ta87  1  0.267372  0.805361  0.393546  1
  Ta  Ta88  1  0.173690  0.310291  0.347136  1
  Ta  Ta89  1  0.669658  0.666314  0.497513  1
  Ta  Ta90  1  0.533932  0.182186  0.462662  1
  Ta  Ta91  1  0.107324  0.428475  0.478285  1
  Ta  Ta92  1  0.978797  0.944837  0.442166  1
  Ta  Ta93  1  0.584096  0.511907  0.489724  1
  Ta  Ta94  1  0.455434  0.026125  0.454352  1
  Ta  Ta95  1  0.642221  0.310792  0.462790  1
  Ta  Ta96  1  0.517924  0.828625  0.423609  1
  Ta  Ta97  1  0.312545  0.523967  0.466308  1
  Ta  Ta98  1  0.180364  0.036223  0.430623  1
  Ta  Ta99  1  0.890482  0.338336  0.492800  1
  Ta  Ta100  1  0.766641  0.853209  0.454012  1
  Ta  Ta101  1  0.246895  0.775363  0.447565  1
  Ta  Ta102  1  0.369001  0.256198  0.487554  1
  Ta  Ta103  1  0.835016  0.590850  0.471178  1
  Ta  Ta104  1  0.707090  0.108515  0.436354  1
  Ta  Ta105  1  0.121841  0.304044  0.463023  1
  Ta  Ta106  1  0.018870  0.829150  0.424088  1
  Ta  Ta107  1  0.098930  0.579631  0.495691  1
  Ta  Ta108  1  0.977859  0.095653  0.460249  1
  Ta  Ta109  1  0.749802  0.436135  0.463776  1
  Ta  Ta110  1  0.619515  0.951448  0.428854  1
  Ta  Ta111  1  0.412833  0.388346  0.492140  1
  Ta  Ta112  1  0.294669  0.905342  0.457833  1
  Ta  Ta113  1  0.651684  0.521421  0.429017  1
  Ta  Ta114  1  0.761292  0.998351  0.472509  1
  Ta  Ta115  1  0.445799  0.429568  0.442062  1
  Ta  Ta116  1  0.543964  0.891162  0.485524  1
  Ta  Ta117  1  -0.003367  0.711399  0.466929  1
  Ta  Ta118  1  0.844218  0.240622  0.424166  1
  Ta  Ta119  1  0.166268  0.626626  0.439195  1
  Ta  Ta120  1  0.285065  0.105444  0.480863  1
  Ta  Ta121  1  0.743954  0.722219  0.442157  1
  Ta  Ta122  1  0.864961  0.206273  0.479172  1
  Ta  Ta123  1  0.306380  0.672912  0.483656  1
  Ta  Ta124  1  0.203468  0.192423  0.445102  1
  Ta  Ta125  1  0.924261  0.366366  0.437281  1
  Ta  Ta126  1  0.041166  0.842958  0.478397  1
  Ta  Ta127  1  0.003612  0.512475  0.443990  1
  Ta  Ta128  1  0.122491  0.990449  0.486469  1
  Ta  Ta129  1  0.527268  0.617634  0.453074  1
  Ta  Ta130  1  0.655264  0.101226  0.494576  1
  Ta  Ta131  1  0.519087  0.762960  0.469993  1
  Ta  Ta132  1  0.375910  0.306040  0.436781  1
  Ta  Ta133  1  0.923476  0.633539  0.575148  1
  Ta  Ta134  1  0.798070  0.149601  0.537644  1
  Ta  Ta135  1  0.360934  0.392342  0.555151  1
  Ta  Ta136  1  0.241019  0.909432  0.519140  1
  Ta  Ta137  1  0.833926  0.475335  0.566870  1
  Ta  Ta138  1  0.707074  0.994181  0.531657  1
  Ta  Ta139  1  0.896392  0.273909  0.540029  1
  Ta  Ta140  1  0.772210  0.789877  0.500181  1
  Ta  Ta141  1  0.567527  0.487607  0.542804  1
  Ta  Ta142  1  0.443123  1.004579  0.506896  1
  Ta  Ta143  1  0.146364  0.301576  0.570188  1
  Ta  Ta144  1  0.016801  0.824138  0.532696  1
  Ta  Ta145  1  0.498421  0.740409  0.524240  1
  Ta  Ta146  1  0.625170  0.220177  0.564728  1
  Ta  Ta147  1  0.083055  0.554922  0.548650  1
  Ta  Ta148  1  0.958902  0.071197  0.512813  1
  Ta  Ta149  1  0.394177  0.272918  0.540293  1
  Ta  Ta150  1  0.268574  0.790747  0.501732  1
  Ta  Ta151  1  0.353662  0.545635  0.572237  1
  Ta  Ta152  1  0.224855  0.059956  0.537022  1
  Ta  Ta153  1  0.994773  0.398985  0.541759  1
  Ta  Ta154  1  0.867277  0.914969  0.505998  1
  Ta  Ta155  1  0.668864  0.352020  0.571398  1
  Ta  Ta156  1  0.565560  0.868695  0.538215  1
  Ta  Ta157  1  0.887074  0.482406  0.508186  1
  Ta  Ta158  1  0.007537  0.964173  0.549465  1
  Ta  Ta159  1  0.663174  0.378401  0.520007  1
  Ta  Ta160  1  0.811148  0.854315  0.569700  1
  Ta  Ta161  1  0.251475  0.673245  0.544245  1
  Ta  Ta162  1  0.115605  0.193657  0.506968  1
  Ta  Ta163  1  0.418199  0.590346  0.516804  1
  Ta  Ta164  1  0.543908  0.073799  0.558027  1
  Ta  Ta165  1  -0.001348  0.690990  0.518622  1
  Ta  Ta166  1  0.120567  0.170734  0.559115  1
  Ta  Ta167  1  0.563790  0.640126  0.560696  1
  Ta  Ta168  1  0.430665  0.154583  0.524063  1
  Ta  Ta169  1  0.167339  0.327104  0.515788  1
  Ta  Ta170  1  0.300995  0.808470  0.555553  1
  Ta  Ta171  1  0.250780  0.475724  0.521963  1
  Ta  Ta172  1  0.387589  0.960031  0.561583  1
  Ta  Ta173  1  0.781621  0.585113  0.530787  1
  Ta  Ta174  1  0.902376  0.067039  0.572043  1
  Ta  Ta175  1  0.772054  0.732034  0.547288  1
  Ta  Ta176  1  0.646930  0.246679  0.510531  1
  Ta  Ta177  1  0.170556  0.595868  0.652442  1
  Ta  Ta178  1  0.044038  0.114498  0.616392  1
  Ta  Ta179  1  0.612637  0.357939  0.632007  1
  Ta  Ta180  1  0.466773  0.877985  0.598578  1
  Ta  Ta181  1  0.086576  0.442602  0.643233  1
  Ta  Ta182  1  0.952325  0.960457  0.608529  1
  Ta  Ta183  1  0.148990  0.239480  0.618522  1
  Ta  Ta184  1  0.044201  0.752025  0.575623  1
  Ta  Ta185  1  0.821707  0.452735  0.619411  1
  Ta  Ta186  1  0.684942  0.970465  0.585971  1
  Ta  Ta187  1  0.406004  0.268776  0.650658  1
  Ta  Ta188  1  0.256156  0.790345  0.614483  1
  Ta  Ta189  1  0.762504  0.715569  0.601817  1
  Ta  Ta190  1  0.876373  0.186546  0.643929  1
  Ta  Ta191  1  0.337010  0.520150  0.624638  1
  Ta  Ta192  1  0.207037  0.035967  0.590301  1
  Ta  Ta193  1  0.648418  0.239471  0.618372  1
  Ta  Ta194  1  0.516095  0.757069  0.580384  1
  Ta  Ta195  1  0.608348  0.510102  0.647602  1
  Ta  Ta196  1  0.465794  0.026987  0.615188  1
  Ta  Ta197  1  0.251689  0.364793  0.618715  1
  Ta  Ta198  1  0.144178  0.888230  0.580477  1
  Ta  Ta199  1  0.921375  0.317478  0.649490  1
  Ta  Ta200  1  0.712445  0.846998  0.619978  1
  Ta  Ta201  1  0.141440  0.447426  0.584765  1
  Ta  Ta202  1  0.242065  0.923697  0.631371  1
  Ta  Ta203  1  0.920934  0.343280  0.597864  1
  Ta  Ta204  1  0.972996  0.826249  0.621098  1
  Ta  Ta205  1  0.512985  0.633874  0.619121  1
  Ta  Ta206  1  0.370676  0.156995  0.584365  1
  Ta  Ta207  1  0.677711  0.555897  0.592770  1
  Ta  Ta208  1  0.788093  0.039507  0.637591  1
  Ta  Ta209  1  0.258144  0.658786  0.597621  1
  Ta  Ta210  1  0.362075  0.140137  0.635854  1
  Ta  Ta211  1  0.816442  0.605744  0.638410  1
  Ta  Ta212  1  0.682395  0.120028  0.602150  1
  Ta  Ta213  1  0.418172  0.288235  0.593973  1
  Ta  Ta214  1  0.530360  0.753586  0.635424  1
  Ta  Ta215  1  0.505161  0.441190  0.598295  1
  Ta  Ta216  1  0.614033  0.932809  0.645400  1
  Ta  Ta217  1  0.034528  0.550994  0.607506  1
  Ta  Ta218  1  0.156601  0.033768  0.650307  1
  Ta  Ta219  1  0.031122  0.695639  0.627155  1
  Ta  Ta220  1  0.898389  0.211982  0.588549  1
  Ta  Ta221  1  0.444083  0.569490  0.724666  1
  Ta  Ta222  1  0.310545  0.088262  0.691079  1
  Ta  Ta223  1  0.868911  0.329811  0.710316  1
  Ta  Ta224  1  0.739288  0.838973  0.674252  1
  Ta  Ta225  1  0.314139  0.427440  0.719099  1
  Ta  Ta226  1  0.238400  0.925797  0.687434  1
  Ta  Ta227  1  0.403626  0.209292  0.697451  1
  Ta  Ta228  1  0.287093  0.714157  0.658698  1
  Ta  Ta229  1  0.066606  0.417784  0.693609  1
  Ta  Ta230  1  0.945390  0.935775  0.661119  1
  Ta  Ta231  1  0.652030  0.237278  0.728062  1
  Ta  Ta232  1  0.537638  0.742036  0.695181  1
  Ta  Ta233  1  0.017916  0.667895  0.683527  1
  Ta  Ta234  1  0.123201  0.148199  0.721879  1
  Ta  Ta235  1  0.581510  0.487342  0.697845  1
  Ta  Ta236  1  0.467706  1.008921  0.669415  1
  Ta  Ta237  1  0.907061  0.211991  0.696870  1
  Ta  Ta238  1  0.775877  0.720403  0.657800  1
  Ta  Ta239  1  0.828831  0.465838  0.720993  1
  Ta  Ta240  1  0.741642  0.982934  0.695331  1
  Ta  Ta241  1  0.514223  0.341708  0.701247  1
  Ta  Ta242  1  0.405196  0.842840  0.660165  1
  Ta  Ta243  1  0.182319  0.287749  0.720415  1
  Ta  Ta244  1  0.064795  0.807921  0.666927  1
  Ta  Ta245  1  0.396561  0.411925  0.662219  1
  Ta  Ta246  1  0.518417  0.885978  0.704535  1
  Ta  Ta247  1  0.177770  0.315488  0.673604  1
  Ta  Ta248  1  0.227988  0.788414  0.706986  1
  Ta  Ta249  1  0.754127  0.605670  0.698714  1
  Ta  Ta250  1  0.612408  0.133690  0.660023  1
  Ta  Ta251  1  0.919206  0.522229  0.671162  1
  Ta  Ta252  1  0.079205  1.009415  0.709283  1
  Ta  Ta253  1  0.504995  0.620443  0.670259  1
  Ta  Ta254  1  0.638951  0.112610  0.707949  1
  Ta  Ta255  1  0.093741  0.549603  0.713627  1
  Ta  Ta256  1  0.932797  0.087972  0.679911  1
  Ta  Ta257  1  0.672937  0.259214  0.674550  1
  Ta  Ta258  1  0.867584  0.750407  0.709275  1
  Ta  Ta259  1  0.757402  0.406294  0.673261  1
  Ta  Ta260  1  0.959459  0.880208  0.710785  1
  Ta  Ta261  1  0.298578  0.517510  0.680858  1
  Ta  Ta262  1  0.429399  1.001915  0.722363  1
  Ta  Ta263  1  0.285385  0.654842  0.705234  1
  Ta  Ta264  1  0.149876  0.183061  0.668835  1
