# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.09295270
_cell_length_b   25.48641214
_cell_length_c   46.15533002
_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   11872.6810322
_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  0.969276  0.691946  0.357100  1
  Ta  Ta2  1  0.971939  0.138711  0.316102  1
  Ta  Ta3  1  0.259215  0.933766  0.324187  1
  Ta  Ta4  1  0.258562  0.399318  0.283799  1
  Ta  Ta5  1  0.322612  0.821373  0.335302  1
  Ta  Ta6  1  0.324236  0.265483  0.291920  1
  Ta  Ta7  1  0.136332  0.658029  0.302495  1
  Ta  Ta8  1  0.134774  0.228567  0.343299  1
  Ta  Ta9  1  0.868003  0.677830  0.293863  1
  Ta  Ta10  1  0.871703  0.248455  0.334299  1
  Ta  Ta11  1  0.901552  0.487320  0.308270  1
  Ta  Ta12  1  0.897405  0.049366  0.346094  1
  Ta  Ta13  1  0.823157  0.860072  0.317536  1
  Ta  Ta14  1  0.798332  0.295905  0.277375  1
  Ta  Ta15  1  0.188019  0.602167  0.358865  1
  Ta  Ta16  1  0.177563  0.040287  0.314068  1
  Ta  Ta17  1  0.742357  0.537384  0.354334  1
  Ta  Ta18  1  0.738208  0.973849  0.304546  1
  Ta  Ta19  1  0.940069  0.593127  0.325116  1
  Ta  Ta20  1  0.937817  0.056670  0.281508  1
  Ta  Ta21  1  0.401958  0.632937  0.309357  1
  Ta  Ta22  1  0.398710  0.205019  0.351511  1
  Ta  Ta23  1  0.502660  0.733579  0.338006  1
  Ta  Ta24  1  0.510854  0.179987  0.292059  1
  Ta  Ta25  1  0.537790  0.913473  0.333508  1
  Ta  Ta26  1  0.530675  0.363063  0.292140  1
  Ta  Ta27  1  0.577652  0.813061  0.300400  1
  Ta  Ta28  1  0.571675  0.379310  0.351488  1
  Ta  Ta29  1  0.042007  0.770236  0.321252  1
  Ta  Ta30  1  0.039841  0.225187  0.280600  1
  Ta  Ta31  1  0.605420  0.700927  0.284874  1
  Ta  Ta32  1  0.604163  0.269667  0.325140  1
  Ta  Ta33  1  0.318682  0.752903  0.289937  1
  Ta  Ta34  1  0.318579  0.327388  0.336642  1
  Ta  Ta35  1  0.685220  0.642842  0.341070  1
  Ta  Ta36  1  0.683759  0.079887  0.297217  1
  Ta  Ta37  1  0.997761  0.955339  0.311759  1
  Ta  Ta38  1  0.965459  0.400419  0.273963  1
  Ta  Ta39  1  0.843815  0.782888  0.274809  1
  Ta  Ta40  1  0.815952  0.366000  0.320120  1
  Ta  Ta41  1  0.674913  0.576758  0.295501  1
  Ta  Ta42  1  0.684041  0.148993  0.340126  1
  Ta  Ta43  1  0.434220  0.509281  0.284177  1
  Ta  Ta44  1  0.434158  0.095262  0.327231  1
  Ta  Ta45  1  0.192301  0.530289  0.312322  1
  Ta  Ta46  1  0.186517  0.106894  0.358017  1
  Ta  Ta47  1  0.765014  0.753389  0.330761  1
  Ta  Ta48  1  0.778490  0.183919  0.283997  1
  Ta  Ta49  1  0.382989  0.878963  0.281482  1
  Ta  Ta50  1  0.379810  0.442907  0.329494  1
  Ta  Ta51  1  0.066423  0.872590  0.349851  1
  Ta  Ta52  1  0.070267  0.319728  0.305503  1
  Ta  Ta53  1  0.642084  0.463130  0.315770  1
  Ta  Ta54  1  0.630345  0.028122  0.355245  1
  Ta  Ta55  1  0.468494  0.553094  0.343969  1
  Ta  Ta56  1  0.458327  0.998178  0.300525  1
  Ta  Ta57  1  0.245188  0.712604  0.347759  1
  Ta  Ta58  1  0.236102  0.153283  0.300052  1
  Ta  Ta59  1  0.107659  0.852516  0.288975  1
  Ta  Ta60  1  0.101180  0.421960  0.333891  1
  Ta  Ta61  1  0.967861  0.821670  0.446876  1
  Ta  Ta62  1  0.968014  0.259336  0.403320  1
  Ta  Ta63  1  0.263222  0.060367  0.414867  1
  Ta  Ta64  1  0.263648  0.497484  0.373390  1
  Ta  Ta65  1  0.319278  0.950366  0.426356  1
  Ta  Ta66  1  0.320059  0.386342  0.385183  1
  Ta  Ta67  1  0.133552  0.786750  0.388325  1
  Ta  Ta68  1  0.132753  0.351016  0.436673  1
  Ta  Ta69  1  0.874271  0.808495  0.378828  1
  Ta  Ta70  1  0.873289  0.372761  0.427123  1
  Ta  Ta71  1  0.900757  0.611260  0.393885  1
  Ta  Ta72  1  0.899080  0.175850  0.438877  1
  Ta  Ta73  1  0.819201  0.991602  0.407564  1
  Ta  Ta74  1  0.821704  0.427930  0.366302  1
  Ta  Ta75  1  0.186090  0.731683  0.450416  1
  Ta  Ta76  1  0.185674  0.169500  0.404789  1
  Ta  Ta77  1  0.742108  0.663690  0.444475  1
  Ta  Ta78  1  0.740297  0.100935  0.397149  1
  Ta  Ta79  1  0.938242  0.723955  0.417062  1
  Ta  Ta80  1  0.936377  0.164234  0.372492  1
  Ta  Ta81  1  0.400592  0.765372  0.397821  1
  Ta  Ta82  1  0.399560  0.329746  0.445634  1
  Ta  Ta83  1  0.502757  0.861511  0.428567  1
  Ta  Ta84  1  0.501732  0.298286  0.385148  1
  Ta  Ta85  1  0.536969  0.040478  0.423719  1
  Ta  Ta86  1  0.540488  0.477172  0.382577  1
  Ta  Ta87  1  0.567452  0.943033  0.392726  1
  Ta  Ta88  1  0.568791  0.506750  0.442344  1
  Ta  Ta89  1  0.037566  0.901673  0.410497  1
  Ta  Ta90  1  0.037331  0.338870  0.367765  1
  Ta  Ta91  1  0.606719  0.829711  0.368721  1
  Ta  Ta92  1  0.606651  0.393610  0.418224  1
  Ta  Ta93  1  0.319137  0.886166  0.380434  1
  Ta  Ta94  1  0.320456  0.450123  0.430121  1
  Ta  Ta95  1  0.685864  0.772918  0.431426  1
  Ta  Ta96  1  0.683757  0.210629  0.386492  1
  Ta  Ta97  1  1.002218  0.080574  0.405847  1
  Ta  Ta98  1  0.004867  0.517072  0.363446  1
  Ta  Ta99  1  0.819294  0.928939  0.361297  1
  Ta  Ta100  1  0.820970  0.492173  0.411691  1
  Ta  Ta101  1  0.685906  0.708765  0.386617  1
  Ta  Ta102  1  0.685201  0.273682  0.433347  1
  Ta  Ta103  1  0.438465  0.651596  0.374316  1
  Ta  Ta104  1  0.436602  0.217380  0.420141  1
  Ta  Ta105  1  0.186696  0.666740  0.404921  1
  Ta  Ta106  1  0.185773  0.231936  0.451031  1
  Ta  Ta107  1  0.763895  0.882053  0.419353  1
  Ta  Ta108  1  0.764340  0.318327  0.376898  1
  Ta  Ta109  1  0.370720  0.007077  0.365011  1
  Ta  Ta110  1  0.373949  0.569260  0.413594  1
  Ta  Ta111  1  0.067454  0.999046  0.441293  1
  Ta  Ta112  1  0.068695  0.435842  0.399733  1
  Ta  Ta113  1  0.633303  0.590543  0.403712  1
  Ta  Ta114  1  0.632201  0.154602  0.447630  1
  Ta  Ta115  1  0.468079  0.683003  0.435182  1
  Ta  Ta116  1  0.466512  0.121282  0.388139  1
  Ta  Ta117  1  0.241572  0.841196  0.437828  1
  Ta  Ta118  1  0.241301  0.278708  0.393931  1
  Ta  Ta119  1  0.103185  0.984858  0.373697  1
  Ta  Ta120  1  0.106524  0.548096  0.423123  1
  Ta  Ta121  1  0.967703  0.948554  0.537569  1
  Ta  Ta122  1  0.968008  0.385324  0.495542  1
  Ta  Ta123  1  0.264478  0.186920  0.507487  1
  Ta  Ta124  1  0.264424  0.623314  0.462947  1
  Ta  Ta125  1  0.320051  0.077377  0.518220  1
  Ta  Ta126  1  0.320388  0.514025  0.475644  1
  Ta  Ta127  1  0.132292  0.914307  0.479065  1
  Ta  Ta128  1  0.132831  0.478087  0.528333  1
  Ta  Ta129  1  0.872773  0.935886  0.469280  1
  Ta  Ta130  1  0.873322  0.499700  0.518588  1
  Ta  Ta131  1  0.899858  0.739049  0.484256  1
  Ta  Ta132  1  0.899826  0.302420  0.531491  1
  Ta  Ta133  1  0.820045  0.118524  0.499946  1
  Ta  Ta134  1  0.820515  0.555205  0.456727  1
  Ta  Ta135  1  0.185113  0.858913  0.540967  1
  Ta  Ta136  1  0.185816  0.295598  0.497664  1
  Ta  Ta137  1  0.741298  0.790641  0.534629  1
  Ta  Ta138  1  0.741336  0.227239  0.490138  1
  Ta  Ta139  1  0.937388  0.851203  0.507409  1
  Ta  Ta140  1  0.937148  0.288350  0.464049  1
  Ta  Ta141  1  0.399351  0.892925  0.488373  1
  Ta  Ta142  1  0.399921  0.456674  0.537636  1
  Ta  Ta143  1  0.502469  0.988584  0.519685  1
  Ta  Ta144  1  0.503245  0.425410  0.477844  1
  Ta  Ta145  1  0.538032  0.167011  0.516318  1
  Ta  Ta146  1  0.538159  0.603910  0.472122  1
  Ta  Ta147  1  0.568102  0.069948  0.484535  1
  Ta  Ta148  1  0.567884  0.633505  0.532668  1
  Ta  Ta149  1  0.037792  0.028782  0.502098  1
  Ta  Ta150  1  0.038238  0.465512  0.460015  1
  Ta  Ta151  1  0.605655  0.957288  0.459971  1
  Ta  Ta152  1  0.606206  0.521059  0.509240  1
  Ta  Ta153  1  0.319391  0.013522  0.471955  1
  Ta  Ta154  1  0.319906  0.577068  0.520746  1
  Ta  Ta155  1  0.685320  0.899936  0.521887  1
  Ta  Ta156  1  0.685715  0.336716  0.479366  1
  Ta  Ta157  1  0.002929  0.207079  0.498816  1
  Ta  Ta158  1  0.003328  0.643488  0.453649  1
  Ta  Ta159  1  0.819543  0.055506  0.453929  1
  Ta  Ta160  1  0.820006  0.619128  0.502127  1
  Ta  Ta161  1  0.685698  0.836889  0.476854  1
  Ta  Ta162  1  0.686165  0.400496  0.525679  1
  Ta  Ta163  1  0.437688  0.780455  0.464948  1
  Ta  Ta164  1  0.437604  0.344103  0.513039  1
  Ta  Ta165  1  0.185637  0.794895  0.495525  1
  Ta  Ta166  1  0.185954  0.358529  0.543725  1
  Ta  Ta167  1  0.764158  0.008858  0.510812  1
  Ta  Ta168  1  0.764670  0.445658  0.468859  1
  Ta  Ta169  1  0.372592  0.132856  0.457120  1
  Ta  Ta170  1  0.373046  0.696260  0.503771  1
  Ta  Ta171  1  0.068758  0.125823  0.533602  1
  Ta  Ta172  1  0.068338  0.562796  0.490207  1
  Ta  Ta173  1  0.632522  0.717715  0.493848  1
  Ta  Ta174  1  0.633086  0.281230  0.540508  1
  Ta  Ta175  1  0.467419  0.810069  0.525473  1
  Ta  Ta176  1  0.467774  0.247121  0.481259  1
  Ta  Ta177  1  0.240989  0.968442  0.528788  1
  Ta  Ta178  1  0.241716  0.405158  0.486727  1
  Ta  Ta179  1  0.105855  0.111675  0.466176  1
  Ta  Ta180  1  0.105809  0.674957  0.513384  1
  Ta  Ta181  1  0.971127  0.075710  0.630513  1
  Ta  Ta182  1  0.967841  0.512300  0.587142  1
  Ta  Ta183  1  0.264677  0.313139  0.600560  1
  Ta  Ta184  1  0.263510  0.750400  0.553175  1
  Ta  Ta185  1  0.322159  0.203572  0.611002  1
  Ta  Ta186  1  0.319665  0.641117  0.566192  1
  Ta  Ta187  1  0.132903  0.041503  0.570621  1
  Ta  Ta188  1  0.131186  0.605660  0.618768  1
  Ta  Ta189  1  0.873663  0.063119  0.560885  1
  Ta  Ta190  1  0.871959  0.627345  0.609284  1
  Ta  Ta191  1  0.899502  0.865957  0.574433  1
  Ta  Ta192  1  0.901630  0.429031  0.624017  1
  Ta  Ta193  1  0.819955  0.244405  0.592942  1
  Ta  Ta194  1  0.819545  0.682321  0.547217  1
  Ta  Ta195  1  0.183649  0.986925  0.631922  1
  Ta  Ta196  1  0.186054  0.422403  0.590090  1
  Ta  Ta197  1  0.742330  0.916182  0.623714  1
  Ta  Ta198  1  0.741914  0.353522  0.582822  1
  Ta  Ta199  1  0.937980  0.978480  0.597734  1
  Ta  Ta200  1  0.937906  0.414920  0.556398  1
  Ta  Ta201  1  0.399126  0.020342  0.579254  1
  Ta  Ta202  1  0.398713  0.584421  0.628858  1
  Ta  Ta203  1  0.505343  0.114852  0.611617  1
  Ta  Ta204  1  0.502752  0.552444  0.569054  1
  Ta  Ta205  1  0.538305  0.292638  0.609659  1
  Ta  Ta206  1  0.537480  0.730984  0.562409  1
  Ta  Ta207  1  0.569666  0.196696  0.577373  1
  Ta  Ta208  1  0.567227  0.762398  0.623221  1
  Ta  Ta209  1  0.038509  0.154765  0.594455  1
  Ta  Ta210  1  0.037707  0.592346  0.550759  1
  Ta  Ta211  1  0.606775  0.084249  0.551757  1
  Ta  Ta212  1  0.604923  0.648652  0.599781  1
  Ta  Ta213  1  0.320569  0.140407  0.564219  1
  Ta  Ta214  1  0.319578  0.705404  0.611006  1
  Ta  Ta215  1  0.686968  0.027531  0.612114  1
  Ta  Ta216  1  0.686125  0.463529  0.571325  1
  Ta  Ta217  1  1.002671  0.333454  0.591953  1
  Ta  Ta218  1  1.002394  0.770562  0.543993  1
  Ta  Ta219  1  0.820362  0.182199  0.546586  1
  Ta  Ta220  1  0.819033  0.747319  0.592678  1
  Ta  Ta221  1  0.685577  0.963850  0.567281  1
  Ta  Ta222  1  0.686317  0.527781  0.617195  1
  Ta  Ta223  1  0.436845  0.907247  0.555189  1
  Ta  Ta224  1  0.438047  0.470897  0.604909  1
  Ta  Ta225  1  0.184952  0.922240  0.586078  1
  Ta  Ta226  1  0.186027  0.485241  0.636271  1
  Ta  Ta227  1  0.766078  0.135196  0.603593  1
  Ta  Ta228  1  0.763931  0.572765  0.559812  1
  Ta  Ta229  1  0.373474  0.259521  0.550005  1
  Ta  Ta230  1  0.372140  0.823609  0.593935  1
  Ta  Ta231  1  0.068153  0.249876  0.625252  1
  Ta  Ta232  1  0.067391  0.690175  0.580598  1
  Ta  Ta233  1  0.631629  0.844589  0.583843  1
  Ta  Ta234  1  0.634352  0.406435  0.632809  1
  Ta  Ta235  1  0.465138  0.936751  0.614804  1
  Ta  Ta236  1  0.468394  0.373453  0.573952  1
  Ta  Ta237  1  0.241416  0.095535  0.620996  1
  Ta  Ta238  1  0.241610  0.531948  0.578253  1
  Ta  Ta239  1  0.106553  0.238274  0.558800  1
  Ta  Ta240  1  0.104929  0.803056  0.603828  1
  Ta  Ta241  1  0.966939  0.188403  0.716733  1
  Ta  Ta242  1  0.963420  0.644017  0.676323  1
  Ta  Ta243  1  0.268165  0.441394  0.692952  1
  Ta  Ta244  1  0.262687  0.877334  0.643443  1
  Ta  Ta245  1  0.323828  0.335621  0.700128  1
  Ta  Ta246  1  0.319988  0.771574  0.656530  1
  Ta  Ta247  1  0.137375  0.167392  0.664015  1
  Ta  Ta248  1  0.137414  0.736659  0.703663  1
  Ta  Ta249  1  0.872330  0.184381  0.654653  1
  Ta  Ta250  1  0.869246  0.756350  0.695028  1
  Ta  Ta251  1  0.902430  0.991938  0.662294  1
  Ta  Ta252  1  0.897673  0.561693  0.708584  1
  Ta  Ta253  1  0.826306  0.373035  0.683906  1
  Ta  Ta254  1  0.818079  0.811951  0.638687  1
  Ta  Ta255  1  0.240182  0.132499  0.717709  1
  Ta  Ta256  1  0.182068  0.554310  0.679988  1
  Ta  Ta257  1  0.744905  0.013676  0.712734  1
  Ta  Ta258  1  0.746378  0.480217  0.673417  1
  Ta  Ta259  1  0.945964  0.091912  0.693688  1
  Ta  Ta260  1  0.938851  0.541532  0.647726  1
  Ta  Ta261  1  0.407789  0.142019  0.669566  1
  Ta  Ta262  1  0.399900  0.713411  0.712675  1
  Ta  Ta263  1  0.474732  0.225954  0.705214  1
  Ta  Ta264  1  0.502738  0.680590  0.659585  1
  Ta  Ta265  1  0.547650  0.415875  0.696953  1
  Ta  Ta266  1  0.537149  0.860747  0.653389  1
  Ta  Ta267  1  0.568014  0.316885  0.671102  1
  Ta  Ta268  1  0.572390  0.904306  0.713225  1
  Ta  Ta269  1  0.025718  0.276611  0.681421  1
  Ta  Ta270  1  0.036321  0.722452  0.640567  1
  Ta  Ta271  1  0.607184  0.208337  0.645863  1
  Ta  Ta272  1  0.603497  0.781217  0.688180  1
  Ta  Ta273  1  0.317998  0.264978  0.657806  1
  Ta  Ta274  1  0.330142  0.837921  0.702059  1
  Ta  Ta275  1  0.683436  0.146525  0.705560  1
  Ta  Ta276  1  0.682833  0.592754  0.662276  1
  Ta  Ta277  1  0.007414  0.458833  0.685769  1
  Ta  Ta278  1  1.001100  0.897437  0.634232  1
  Ta  Ta279  1  0.816256  0.306668  0.639813  1
  Ta  Ta280  1  0.813168  0.884095  0.684951  1
  Ta  Ta281  1  0.692117  0.085877  0.660627  1
  Ta  Ta282  1  0.686704  0.661300  0.707625  1
  Ta  Ta283  1  0.434599  0.034102  0.645817  1
  Ta  Ta284  1  0.427633  0.601072  0.697172  1
  Ta  Ta285  1  0.191440  0.048982  0.679411  1
  Ta  Ta286  1  0.161480  0.631501  0.722743  1
  Ta  Ta287  1  0.759793  0.257584  0.697649  1
  Ta  Ta288  1  0.760311  0.701511  0.649829  1
  Ta  Ta289  1  0.374891  0.385867  0.642374  1
  Ta  Ta290  1  0.366740  0.950656  0.681432  1
  Ta  Ta291  1  0.071931  0.359555  0.716311  1
  Ta  Ta292  1  0.065547  0.822103  0.672834  1
  Ta  Ta293  1  0.626351  0.970506  0.667457  1
  Ta  Ta294  1  0.622279  0.535113  0.716051  1
  Ta  Ta295  1  0.478506  0.051675  0.704885  1
  Ta  Ta296  1  0.468067  0.500699  0.664001  1
  Ta  Ta297  1  0.212485  0.240951  0.716574  1
  Ta  Ta298  1  0.240440  0.660911  0.666817  1
  Ta  Ta299  1  0.107521  0.364857  0.651635  1
  Ta  Ta300  1  0.102814  0.929617  0.689518  1
