# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.15478530
_cell_length_b   31.88728181
_cell_length_c   48.45125868
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   94.37541000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta
_chemical_formula_sum   Ta330
_cell_volume   14102.7291602
_cell_formula_units_Z   330
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  0.067097  0.536245  0.350772  1
  Ta  Ta2  1  0.834997  0.867628  0.293989  1
  Ta  Ta3  1  0.924500  0.208073  0.316419  1
  Ta  Ta4  1  0.519547  0.372160  0.337193  1
  Ta  Ta5  1  0.583787  0.704813  0.356640  1
  Ta  Ta6  1  0.415882  0.056474  0.307559  1
  Ta  Ta7  1  0.981452  0.430822  0.347667  1
  Ta  Ta8  1  0.062625  0.766376  0.367511  1
  Ta  Ta9  1  0.824815  0.124335  0.313403  1
  Ta  Ta10  1  0.009546  0.299182  0.318923  1
  Ta  Ta11  1  0.159259  0.618618  0.342180  1
  Ta  Ta12  1  0.864412  0.969411  0.302362  1
  Ta  Ta13  1  0.708347  0.440104  0.323957  1
  Ta  Ta14  1  0.791360  0.773727  0.333496  1
  Ta  Ta15  1  0.882703  0.100433  0.366863  1
  Ta  Ta16  1  0.303061  0.312442  0.346863  1
  Ta  Ta17  1  0.080419  0.666012  0.295940  1
  Ta  Ta18  1  0.198255  0.988806  0.315043  1
  Ta  Ta19  1  0.889379  0.590457  0.371044  1
  Ta  Ta20  1  0.636817  0.917952  0.315294  1
  Ta  Ta21  1  0.754176  0.253609  0.347393  1
  Ta  Ta22  1  0.224178  0.478203  0.326105  1
  Ta  Ta23  1  0.308191  0.801872  0.343442  1
  Ta  Ta24  1  0.108971  0.150497  0.289580  1
  Ta  Ta25  1  0.573385  0.295366  0.314475  1
  Ta  Ta26  1  0.622908  0.617323  0.344375  1
  Ta  Ta27  1  0.516165  0.979785  0.287180  1
  Ta  Ta28  1  0.493525  0.476899  0.351688  1
  Ta  Ta29  1  0.285071  0.810274  0.287646  1
  Ta  Ta30  1  0.382501  0.144921  0.315434  1
  Ta  Ta31  1  0.140064  0.378859  0.320717  1
  Ta  Ta32  1  0.239371  0.706966  0.341364  1
  Ta  Ta33  1  0.318005  0.036182  0.365002  1
  Ta  Ta34  1  0.827460  0.349192  0.354868  1
  Ta  Ta35  1  0.737448  0.688324  0.302356  1
  Ta  Ta36  1  0.750970  0.032415  0.325348  1
  Ta  Ta37  1  0.298497  0.411531  0.365780  1
  Ta  Ta38  1  0.055669  0.748758  0.307870  1
  Ta  Ta39  1  0.115466  0.078470  0.329336  1
  Ta  Ta40  1  0.812807  0.367880  0.302635  1
  Ta  Ta41  1  0.900754  0.681819  0.345293  1
  Ta  Ta42  1  0.986613  1.007962  0.364768  1
  Ta  Ta43  1  0.375211  0.561937  0.319822  1
  Ta  Ta44  1  0.461473  0.887080  0.362403  1
  Ta  Ta45  1  0.405929  0.225489  0.350408  1
  Ta  Ta46  1  0.821142  0.487760  0.372922  1
  Ta  Ta47  1  0.556749  0.833935  0.314528  1
  Ta  Ta48  1  0.654348  0.167615  0.347950  1
  Ta  Ta49  1  0.391691  0.551530  0.372464  1
  Ta  Ta50  1  0.307115  0.898348  0.315901  1
  Ta  Ta51  1  0.250509  0.236132  0.306468  1
  Ta  Ta52  1  0.688415  0.537263  0.334997  1
  Ta  Ta53  1  0.789813  0.862388  0.352451  1
  Ta  Ta54  1  0.598968  0.208871  0.300843  1
  Ta  Ta55  1  0.317609  0.328443  0.291658  1
  Ta  Ta56  1  0.412601  0.655514  0.312480  1
  Ta  Ta57  1  0.494913  0.981995  0.341089  1
  Ta  Ta58  1  0.403988  0.421707  0.302273  1
  Ta  Ta59  1  0.478235  0.747647  0.312545  1
  Ta  Ta60  1  0.574855  0.084131  0.349667  1
  Ta  Ta61  1  0.922438  0.501506  0.309017  1
  Ta  Ta62  1  0.046856  0.832004  0.321963  1
  Ta  Ta63  1  0.119949  0.162630  0.346342  1
  Ta  Ta64  1  0.886753  0.599124  0.312862  1
  Ta  Ta65  1  -0.000512  0.919420  0.334395  1
  Ta  Ta66  1  0.087718  0.249866  0.363293  1
  Ta  Ta67  1  0.342028  0.521492  0.433304  1
  Ta  Ta68  1  0.141501  0.860569  0.371473  1
  Ta  Ta69  1  0.216560  0.187187  0.401192  1
  Ta  Ta70  1  0.791116  0.355416  0.418877  1
  Ta  Ta71  1  0.871407  0.692679  0.444633  1
  Ta  Ta72  1  0.684627  0.031268  0.385583  1
  Ta  Ta73  1  0.265050  0.414044  0.429746  1
  Ta  Ta74  1  0.368597  0.747639  0.452657  1
  Ta  Ta75  1  0.147229  0.092591  0.394281  1
  Ta  Ta76  1  0.301184  0.277174  0.403885  1
  Ta  Ta77  1  0.453882  0.603642  0.427677  1
  Ta  Ta78  1  0.231713  0.948386  0.366649  1
  Ta  Ta79  1  0.989653  0.418827  0.404062  1
  Ta  Ta80  1  0.092075  0.755177  0.425204  1
  Ta  Ta81  1  0.183497  0.079034  0.455164  1
  Ta  Ta82  1  0.588346  0.293153  0.433470  1
  Ta  Ta83  1  0.380863  0.646038  0.377667  1
  Ta  Ta84  1  0.486517  0.971194  0.401116  1
  Ta  Ta85  1  0.175494  0.576113  0.458002  1
  Ta  Ta86  1  0.969558  0.912656  0.397252  1
  Ta  Ta87  1  0.041877  0.233877  0.430975  1
  Ta  Ta88  1  0.503554  0.466084  0.408000  1
  Ta  Ta89  1  0.615422  0.786063  0.429168  1
  Ta  Ta90  1  0.383084  0.132331  0.371534  1
  Ta  Ta91  1  0.853361  0.277852  0.399622  1
  Ta  Ta92  1  0.904650  0.603632  0.432135  1
  Ta  Ta93  1  0.742394  0.949691  0.363504  1
  Ta  Ta94  1  0.778793  0.460963  0.433684  1
  Ta  Ta95  1  0.580396  0.796282  0.370118  1
  Ta  Ta96  1  0.667870  0.124530  0.402208  1
  Ta  Ta97  1  0.421523  0.358605  0.402955  1
  Ta  Ta98  1  0.537910  0.692694  0.425362  1
  Ta  Ta99  1  0.651991  0.022010  0.450118  1
  Ta  Ta100  1  0.108021  0.332216  0.436966  1
  Ta  Ta101  1  0.049159  0.674046  0.389844  1
  Ta  Ta102  1  0.141427  0.999828  0.413736  1
  Ta  Ta103  1  0.577408  0.395620  0.449040  1
  Ta  Ta104  1  0.346147  0.734824  0.391695  1
  Ta  Ta105  1  0.435548  0.062274  0.416661  1
  Ta  Ta106  1  0.092963  0.344044  0.379908  1
  Ta  Ta107  1  0.197526  0.666183  0.433388  1
  Ta  Ta108  1  0.330757  0.992441  0.452984  1
  Ta  Ta109  1  0.657171  0.548171  0.397906  1
  Ta  Ta110  1  0.794332  0.871171  0.448358  1
  Ta  Ta111  1  0.701391  0.204973  0.437824  1
  Ta  Ta112  1  0.100319  0.471152  0.455699  1
  Ta  Ta113  1  0.876222  0.819162  0.398382  1
  Ta  Ta114  1  0.957013  0.144201  0.429636  1
  Ta  Ta115  1  0.671678  0.536923  0.454851  1
  Ta  Ta116  1  0.626507  0.879929  0.405379  1
  Ta  Ta117  1  0.550823  0.215107  0.395216  1
  Ta  Ta118  1  0.973373  0.524799  0.417408  1
  Ta  Ta119  1  0.105535  0.847686  0.436138  1
  Ta  Ta120  1  0.883282  0.190050  0.382338  1
  Ta  Ta121  1  0.580718  0.305432  0.375221  1
  Ta  Ta122  1  0.713956  0.645333  0.397314  1
  Ta  Ta123  1  0.814295  0.967213  0.422855  1
  Ta  Ta124  1  0.667302  0.409455  0.381806  1
  Ta  Ta125  1  0.800305  0.735191  0.394860  1
  Ta  Ta126  1  0.900755  0.059895  0.423986  1
  Ta  Ta127  1  0.189787  0.483612  0.388232  1
  Ta  Ta128  1  0.337275  0.817525  0.404955  1
  Ta  Ta129  1  0.409029  0.142852  0.433979  1
  Ta  Ta130  1  0.169616  0.586623  0.399321  1
  Ta  Ta131  1  0.297532  0.909351  0.418257  1
  Ta  Ta132  1  0.377340  0.230046  0.450221  1
  Ta  Ta133  1  0.625992  0.505965  0.516537  1
  Ta  Ta134  1  0.440876  0.846821  0.457264  1
  Ta  Ta135  1  0.507175  0.167857  0.487899  1
  Ta  Ta136  1  0.075558  0.338491  0.501844  1
  Ta  Ta137  1  0.160671  0.675066  0.532561  1
  Ta  Ta138  1  0.988270  1.012741  0.472200  1
  Ta  Ta139  1  0.546600  0.397610  0.512336  1
  Ta  Ta140  1  0.644296  0.734655  0.542649  1
  Ta  Ta141  1  0.442677  0.071939  0.483155  1
  Ta  Ta142  1  0.590936  0.259051  0.489457  1
  Ta  Ta143  1  0.739898  0.588354  0.512996  1
  Ta  Ta144  1  0.561045  0.929840  0.452375  1
  Ta  Ta145  1  0.270454  0.402766  0.486743  1
  Ta  Ta146  1  0.378104  0.739255  0.514721  1
  Ta  Ta147  1  0.452401  0.060716  0.539767  1
  Ta  Ta148  1  0.875690  0.276040  0.517931  1
  Ta  Ta149  1  0.667509  0.633914  0.465577  1
  Ta  Ta150  1  0.783989  0.952511  0.488541  1
  Ta  Ta151  1  0.461087  0.560080  0.542819  1
  Ta  Ta152  1  0.297452  0.908011  0.481725  1
  Ta  Ta153  1  0.331586  0.216534  0.516887  1
  Ta  Ta154  1  0.783980  0.449842  0.490653  1
  Ta  Ta155  1  0.887735  0.774844  0.516261  1
  Ta  Ta156  1  0.687711  0.112448  0.458501  1
  Ta  Ta157  1  0.139822  0.260312  0.484146  1
  Ta  Ta158  1  0.190460  0.587222  0.518176  1
  Ta  Ta159  1  0.048115  0.932417  0.456612  1
  Ta  Ta160  1  0.059945  0.444741  0.516313  1
  Ta  Ta161  1  0.881178  0.786046  0.459642  1
  Ta  Ta162  1  0.954730  0.107751  0.485905  1
  Ta  Ta163  1  0.704277  0.341495  0.486363  1
  Ta  Ta164  1  0.824990  0.679328  0.513765  1
  Ta  Ta165  1  0.897848  0.999721  0.541822  1
  Ta  Ta166  1  0.392690  0.315198  0.520797  1
  Ta  Ta167  1  0.341847  0.658592  0.477275  1
  Ta  Ta168  1  0.258894  0.989701  0.505808  1
  Ta  Ta169  1  0.860375  0.379050  0.531662  1
  Ta  Ta170  1  0.634976  0.720358  0.480160  1
  Ta  Ta171  1  0.743989  0.046088  0.507363  1
  Ta  Ta172  1  0.375026  0.326867  0.463996  1
  Ta  Ta173  1  0.485396  0.650881  0.520811  1
  Ta  Ta174  1  0.526336  0.982961  0.498141  1
  Ta  Ta175  1  0.938147  0.532197  0.481900  1
  Ta  Ta176  1  0.068948  0.857711  0.492284  1
  Ta  Ta177  1  0.990938  0.188399  0.524354  1
  Ta  Ta178  1  0.383195  0.454975  0.538444  1
  Ta  Ta179  1  0.209435  0.796134  0.481764  1
  Ta  Ta180  1  0.245306  0.128336  0.516538  1
  Ta  Ta181  1  0.954499  0.520761  0.538819  1
  Ta  Ta182  1  0.800559  0.863810  0.500566  1
  Ta  Ta183  1  0.845901  0.196352  0.481037  1
  Ta  Ta184  1  0.255161  0.508869  0.501007  1
  Ta  Ta185  1  0.343229  0.834293  0.526943  1
  Ta  Ta186  1  0.169442  0.172463  0.469085  1
  Ta  Ta187  1  0.868752  0.287625  0.459819  1
  Ta  Ta188  1  0.000312  0.630803  0.484914  1
  Ta  Ta189  1  0.035129  0.938197  0.516919  1
  Ta  Ta190  1  0.947090  0.392423  0.464597  1
  Ta  Ta191  1  0.088189  0.718702  0.483995  1
  Ta  Ta192  1  0.123552  0.051201  0.518112  1
  Ta  Ta193  1  0.470475  0.468252  0.471268  1
  Ta  Ta194  1  0.587447  0.800310  0.492441  1
  Ta  Ta195  1  0.698064  0.126238  0.520822  1
  Ta  Ta196  1  0.455781  0.571077  0.484548  1
  Ta  Ta197  1  0.547496  0.894622  0.510870  1
  Ta  Ta198  1  0.665997  0.212911  0.536303  1
  Ta  Ta199  1  0.907713  0.489109  0.599875  1
  Ta  Ta200  1  0.680246  0.824998  0.549351  1
  Ta  Ta201  1  0.797948  0.153569  0.575841  1
  Ta  Ta202  1  0.357747  0.321529  0.585247  1
  Ta  Ta203  1  0.444435  0.658755  0.619516  1
  Ta  Ta204  1  0.232312  0.998142  0.562521  1
  Ta  Ta205  1  0.827599  0.380753  0.594664  1
  Ta  Ta206  1  0.935471  0.720559  0.631539  1
  Ta  Ta207  1  0.721331  0.059807  0.570263  1
  Ta  Ta208  1  0.879613  0.242662  0.574633  1
  Ta  Ta209  1  0.026467  0.570992  0.598650  1
  Ta  Ta210  1  0.774786  0.916457  0.546888  1
  Ta  Ta211  1  0.551479  0.385959  0.569216  1
  Ta  Ta212  1  0.664468  0.724942  0.600568  1
  Ta  Ta213  1  0.759932  0.048139  0.628582  1
  Ta  Ta214  1  0.163082  0.259013  0.603226  1
  Ta  Ta215  1  0.951981  0.617840  0.552138  1
  Ta  Ta216  1  0.038833  0.936704  0.580844  1
  Ta  Ta217  1  0.747080  0.542912  0.627293  1
  Ta  Ta218  1  0.520809  0.879526  0.575870  1
  Ta  Ta219  1  0.621018  0.200868  0.604052  1
  Ta  Ta220  1  0.065608  0.433393  0.573244  1
  Ta  Ta221  1  0.176423  0.754199  0.604303  1
  Ta  Ta222  1  0.966076  0.099268  0.547648  1
  Ta  Ta223  1  0.427643  0.242970  0.569902  1
  Ta  Ta224  1  0.474982  0.570331  0.603041  1
  Ta  Ta225  1  0.286224  0.914994  0.541867  1
  Ta  Ta226  1  0.341169  0.428436  0.598955  1
  Ta  Ta227  1  0.146793  0.767590  0.544339  1
  Ta  Ta228  1  0.243609  0.090959  0.574843  1
  Ta  Ta229  1  0.989447  0.325174  0.569316  1
  Ta  Ta230  1  0.108177  0.661196  0.600880  1
  Ta  Ta231  1  0.199213  0.984009  0.627482  1
  Ta  Ta232  1  0.674270  0.298363  0.604367  1
  Ta  Ta233  1  0.628131  0.642978  0.564377  1
  Ta  Ta234  1  0.543766  0.975609  0.550291  1
  Ta  Ta235  1  0.142513  0.362784  0.614455  1
  Ta  Ta236  1  0.917829  0.704673  0.567877  1
  Ta  Ta237  1  0.001871  0.028113  0.593929  1
  Ta  Ta238  1  0.659784  0.310001  0.547693  1
  Ta  Ta239  1  0.774821  0.634522  0.607625  1
  Ta  Ta240  1  0.712488  0.966452  0.593527  1
  Ta  Ta241  1  0.221549  0.515573  0.565725  1
  Ta  Ta242  1  0.185685  0.847636  0.584068  1
  Ta  Ta243  1  0.283675  0.171141  0.611812  1
  Ta  Ta244  1  0.662555  0.437325  0.620947  1
  Ta  Ta245  1  0.432707  0.787563  0.575629  1
  Ta  Ta246  1  0.535277  0.111035  0.604047  1
  Ta  Ta247  1  0.236390  0.503827  0.622608  1
  Ta  Ta248  1  0.000737  0.854513  0.545051  1
  Ta  Ta249  1  0.137007  0.180365  0.568074  1
  Ta  Ta250  1  0.538803  0.492338  0.583970  1
  Ta  Ta251  1  0.654183  0.815840  0.616377  1
  Ta  Ta252  1  0.461073  0.154458  0.556198  1
  Ta  Ta253  1  0.156280  0.270742  0.544426  1
  Ta  Ta254  1  0.286629  0.614169  0.571347  1
  Ta  Ta255  1  0.368439  0.933507  0.601839  1
  Ta  Ta256  1  0.230340  0.376055  0.547301  1
  Ta  Ta257  1  0.374552  0.703373  0.571602  1
  Ta  Ta258  1  0.460549  0.026661  0.600650  1
  Ta  Ta259  1  0.752563  0.451726  0.553955  1
  Ta  Ta260  1  0.895690  0.786104  0.581400  1
  Ta  Ta261  1  0.994381  0.111132  0.608555  1
  Ta  Ta262  1  0.740791  0.554958  0.569255  1
  Ta  Ta263  1  0.849289  0.875373  0.598901  1
  Ta  Ta264  1  0.957395  0.198831  0.624676  1
  Ta  Ta265  1  0.191341  0.469023  0.681201  1
  Ta  Ta266  1  0.002599  0.811900  0.634060  1
  Ta  Ta267  1  0.094194  0.131050  0.663154  1
  Ta  Ta268  1  0.646058  0.307613  0.667154  1
  Ta  Ta269  1  0.731153  0.634643  0.701499  1
  Ta  Ta270  1  0.550396  0.983271  0.646770  1
  Ta  Ta271  1  0.107665  0.367158  0.676098  1
  Ta  Ta272  1  0.194915  0.706584  0.710644  1
  Ta  Ta273  1  0.029662  0.042200  0.654182  1
  Ta  Ta274  1  0.177057  0.223584  0.660242  1
  Ta  Ta275  1  0.321745  0.549700  0.683131  1
  Ta  Ta276  1  0.106462  0.898289  0.633471  1
  Ta  Ta277  1  0.838106  0.369132  0.650763  1
  Ta  Ta278  1  0.934766  0.699346  0.685625  1
  Ta  Ta279  1  0.067696  0.049523  0.707564  1
  Ta  Ta280  1  0.446206  0.244627  0.689056  1
  Ta  Ta281  1  0.239788  0.599059  0.639005  1
  Ta  Ta282  1  0.360609  0.922327  0.667296  1
  Ta  Ta283  1  0.013080  0.519488  0.710276  1
  Ta  Ta284  1  0.842754  0.864008  0.664122  1
  Ta  Ta285  1  0.922621  0.185662  0.688965  1
  Ta  Ta286  1  0.349477  0.415469  0.655218  1
  Ta  Ta287  1  0.471498  0.732339  0.687644  1
  Ta  Ta288  1  0.274283  0.079047  0.632878  1
  Ta  Ta289  1  0.713071  0.227536  0.657088  1
  Ta  Ta290  1  0.753499  0.550857  0.687236  1
  Ta  Ta291  1  0.604170  0.898431  0.633671  1
  Ta  Ta292  1  0.623900  0.405971  0.678700  1
  Ta  Ta293  1  0.445183  0.749280  0.632823  1
  Ta  Ta294  1  0.548833  0.073067  0.661011  1
  Ta  Ta295  1  0.262999  0.308051  0.651506  1
  Ta  Ta296  1  0.400051  0.644069  0.686126  1
  Ta  Ta297  1  0.541268  1.013398  0.703548  1
  Ta  Ta298  1  0.960531  0.280571  0.681318  1
  Ta  Ta299  1  0.919127  0.622671  0.651659  1
  Ta  Ta300  1  0.875162  0.956313  0.637250  1
  Ta  Ta301  1  0.411015  0.342800  0.692710  1
  Ta  Ta302  1  0.201617  0.685775  0.654659  1
  Ta  Ta303  1  0.290874  1.010978  0.676248  1
  Ta  Ta304  1  0.940031  0.294586  0.629366  1
  Ta  Ta305  1  0.078575  0.612651  0.695497  1
  Ta  Ta306  1  0.043944  0.949108  0.682365  1
  Ta  Ta307  1  0.502408  0.498281  0.647481  1
  Ta  Ta308  1  0.508404  0.831155  0.673493  1
  Ta  Ta309  1  0.601747  0.157073  0.698431  1
  Ta  Ta310  1  0.930923  0.425205  0.699698  1
  Ta  Ta311  1  0.734367  0.769234  0.660126  1
  Ta  Ta312  1  0.814994  0.091155  0.688904  1
  Ta  Ta313  1  0.516042  0.478866  0.699494  1
  Ta  Ta314  1  0.342018  0.839277  0.628565  1
  Ta  Ta315  1  0.436953  0.163093  0.655442  1
  Ta  Ta316  1  0.811360  0.474692  0.665083  1
  Ta  Ta317  1  0.972261  0.783932  0.693019  1
  Ta  Ta318  1  0.755673  0.140128  0.643537  1
  Ta  Ta319  1  0.444058  0.254975  0.631108  1
  Ta  Ta320  1  0.572117  0.595820  0.655116  1
  Ta  Ta321  1  0.674458  0.926266  0.686951  1
  Ta  Ta322  1  0.509706  0.358332  0.629829  1
  Ta  Ta323  1  0.664244  0.683692  0.656053  1
  Ta  Ta324  1  0.803705  1.006562  0.683066  1
  Ta  Ta325  1  0.032828  0.435204  0.636701  1
  Ta  Ta326  1  0.213177  0.769436  0.665976  1
  Ta  Ta327  1  0.332151  0.092484  0.694105  1
  Ta  Ta328  1  0.026157  0.535596  0.655349  1
  Ta  Ta329  1  0.166929  0.855093  0.680976  1
  Ta  Ta330  1  0.258183  0.173168  0.705568  1
