# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.48040599
_cell_length_b   25.48768579
_cell_length_c   48.37475970
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   89.93752326
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta
_chemical_formula_sum   Ta330
_cell_volume   12921.9207704
_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  0.254217  0.544849  0.308412  1
  Ta  Ta2  1  0.269045  0.923249  0.343175  1
  Ta  Ta3  1  0.253241  0.193247  0.284643  1
  Ta  Ta4  1  0.799664  0.374376  0.296324  1
  Ta  Ta5  1  0.761291  0.733768  0.327027  1
  Ta  Ta6  1  0.764720  0.086646  0.354643  1
  Ta  Ta7  1  0.534797  0.212938  0.278069  1
  Ta  Ta8  1  0.551285  0.570526  0.301089  1
  Ta  Ta9  1  0.516611  0.932523  0.332098  1
  Ta  Ta10  1  0.968072  0.539464  0.317846  1
  Ta  Ta11  1  0.944628  0.893943  0.345267  1
  Ta  Ta12  1  0.945471  0.173115  0.288956  1
  Ta  Ta13  1  0.613298  0.300573  0.308577  1
  Ta  Ta14  1  0.596687  0.654706  0.335972  1
  Ta  Ta15  1  0.620299  0.940607  0.279892  1
  Ta  Ta16  1  0.999807  0.452090  0.287825  1
  Ta  Ta17  1  0.943513  0.807843  0.312416  1
  Ta  Ta18  1  0.947382  0.156674  0.341813  1
  Ta  Ta19  1  0.091800  0.336228  0.356663  1
  Ta  Ta20  1  0.110862  0.636157  0.303161  1
  Ta  Ta21  1  0.076595  0.981455  0.322278  1
  Ta  Ta22  1  0.450816  0.479585  0.323678  1
  Ta  Ta23  1  0.410240  0.834636  0.347815  1
  Ta  Ta24  1  0.414422  0.109278  0.292872  1
  Ta  Ta25  1  0.096142  0.352651  0.302759  1
  Ta  Ta26  1  0.060712  0.718519  0.336782  1
  Ta  Ta27  1  0.086250  0.068092  0.359740  1
  Ta  Ta28  1  0.529170  0.397757  0.289781  1
  Ta  Ta29  1  0.497869  0.753532  0.317090  1
  Ta  Ta30  1  0.515204  0.114247  0.348392  1
  Ta  Ta31  1  0.734523  0.482417  0.319114  1
  Ta  Ta32  1  0.695369  0.840860  0.358357  1
  Ta  Ta33  1  0.690126  0.131468  0.300904  1
  Ta  Ta34  1  0.776910  0.320814  0.358281  1
  Ta  Ta35  1  0.797018  0.610078  0.299470  1
  Ta  Ta36  1  0.761271  0.960767  0.330188  1
  Ta  Ta37  1  0.703096  0.563472  0.356958  1
  Ta  Ta38  1  0.683830  0.846241  0.304976  1
  Ta  Ta39  1  0.712179  0.212768  0.332830  1
  Ta  Ta40  1  0.904464  0.278956  0.314844  1
  Ta  Ta41  1  0.903800  0.639043  0.345981  1
  Ta  Ta42  1  0.900547  0.920449  0.289420  1
  Ta  Ta43  1  0.145073  0.457817  0.333705  1
  Ta  Ta44  1  0.127475  0.821484  0.357492  1
  Ta  Ta45  1  0.135677  0.094367  0.301903  1
  Ta  Ta46  1  0.348040  0.386638  0.344253  1
  Ta  Ta47  1  0.384994  0.652295  0.293500  1
  Ta  Ta48  1  0.332118  0.036386  0.329587  1
  Ta  Ta49  1  0.277655  0.425572  0.289152  1
  Ta  Ta50  1  0.236239  0.760883  0.306897  1
  Ta  Ta51  1  0.260764  0.142844  0.344136  1
  Ta  Ta52  1  0.344663  0.304533  0.307963  1
  Ta  Ta53  1  0.310700  0.666359  0.343849  1
  Ta  Ta54  1  0.338589  0.971825  0.288759  1
  Ta  Ta55  1  0.917377  0.410618  0.340602  1
  Ta  Ta56  1  0.931026  0.706329  0.288260  1
  Ta  Ta57  1  0.885496  0.050367  0.308867  1
  Ta  Ta58  1  0.615109  0.394126  0.340932  1
  Ta  Ta59  1  0.639547  0.686705  0.281967  1
  Ta  Ta60  1  0.590355  0.032624  0.309163  1
  Ta  Ta61  1  0.424816  0.574156  0.351585  1
  Ta  Ta62  1  0.414260  0.860626  0.293773  1
  Ta  Ta63  1  0.441486  0.210856  0.327323  1
  Ta  Ta64  1  0.132876  0.587381  0.355762  1
  Ta  Ta65  1  0.154058  0.873206  0.302609  1
  Ta  Ta66  1  0.128545  0.232035  0.326822  1
  Ta  Ta67  1  0.265326  0.619964  0.401471  1
  Ta  Ta68  1  0.262011  0.976038  0.433507  1
  Ta  Ta69  1  0.272952  0.266885  0.369660  1
  Ta  Ta70  1  0.772523  0.443338  0.384545  1
  Ta  Ta71  1  0.761359  0.799569  0.416761  1
  Ta  Ta72  1  0.767877  0.154404  0.447010  1
  Ta  Ta73  1  0.524216  0.292292  0.362991  1
  Ta  Ta74  1  0.514649  0.646556  0.393212  1
  Ta  Ta75  1  0.516963  0.002757  0.426644  1
  Ta  Ta76  1  0.944011  0.602540  0.405607  1
  Ta  Ta77  1  0.942029  0.960133  0.436068  1
  Ta  Ta78  1  0.946232  0.247427  0.374839  1
  Ta  Ta79  1  0.597486  0.370252  0.399525  1
  Ta  Ta80  1  0.594554  0.723754  0.430666  1
  Ta  Ta81  1  0.590567  0.012545  0.368156  1
  Ta  Ta82  1  0.951510  0.514368  0.371455  1
  Ta  Ta83  1  0.942746  0.871474  0.401685  1
  Ta  Ta84  1  0.946594  0.226968  0.432035  1
  Ta  Ta85  1  0.089809  0.404500  0.447574  1
  Ta  Ta86  1  0.081975  0.691888  0.389332  1
  Ta  Ta87  1  0.085354  0.049183  0.417703  1
  Ta  Ta88  1  0.442345  0.547268  0.415242  1
  Ta  Ta89  1  0.434590  0.902264  0.446697  1
  Ta  Ta90  1  0.442462  0.193062  0.385200  1
  Ta  Ta91  1  0.094478  0.425561  0.390898  1
  Ta  Ta92  1  0.083899  0.782821  0.420373  1
  Ta  Ta93  1  0.087253  0.138189  0.451453  1
  Ta  Ta94  1  0.524998  0.471518  0.377954  1
  Ta  Ta95  1  0.509126  0.824704  0.409209  1
  Ta  Ta96  1  0.516851  0.182340  0.441329  1
  Ta  Ta97  1  0.711766  0.550932  0.415222  1
  Ta  Ta98  1  0.702097  0.907234  0.447052  1
  Ta  Ta99  1  0.708797  0.193712  0.387072  1
  Ta  Ta100  1  0.769926  0.386975  0.450513  1
  Ta  Ta101  1  0.764104  0.675723  0.388988  1
  Ta  Ta102  1  0.766148  0.032365  0.420384  1
  Ta  Ta103  1  0.704837  0.633375  0.451569  1
  Ta  Ta104  1  0.712304  0.925874  0.391557  1
  Ta  Ta105  1  0.710164  0.279662  0.420370  1
  Ta  Ta106  1  0.907707  0.352758  0.405251  1
  Ta  Ta107  1  0.900461  0.708164  0.435799  1
  Ta  Ta108  1  0.900088  -0.001675  0.373938  1
  Ta  Ta109  1  0.132145  0.529926  0.420959  1
  Ta  Ta110  1  0.124049  0.886275  0.450895  1
  Ta  Ta111  1  0.128214  0.176480  0.390221  1
  Ta  Ta112  1  0.331019  0.456966  0.437308  1
  Ta  Ta113  1  0.310535  0.750129  0.375068  1
  Ta  Ta114  1  0.317882  0.108181  0.408030  1
  Ta  Ta115  1  0.275202  0.498435  0.375155  1
  Ta  Ta116  1  0.259827  0.855688  0.403832  1
  Ta  Ta117  1  0.265821  0.210957  0.436104  1
  Ta  Ta118  1  0.329866  0.374447  0.401157  1
  Ta  Ta119  1  0.325789  0.728969  0.430526  1
  Ta  Ta120  1  0.331195  0.019283  0.381541  1
  Ta  Ta121  1  0.906404  0.477004  0.431368  1
  Ta  Ta122  1  0.897510  0.769250  0.371570  1
  Ta  Ta123  1  0.903826  0.121122  0.401027  1
  Ta  Ta124  1  0.598804  0.459711  0.433696  1
  Ta  Ta125  1  0.580328  0.746807  0.371632  1
  Ta  Ta126  1  0.585760  0.101999  0.404161  1
  Ta  Ta127  1  0.435101  0.636724  0.449170  1
  Ta  Ta128  1  0.445390  0.923812  0.388051  1
  Ta  Ta129  1  0.442502  0.282413  0.419501  1
  Ta  Ta130  1  0.127019  0.654300  0.446857  1
  Ta  Ta131  1  0.123030  0.946918  0.386586  1
  Ta  Ta132  1  0.132839  0.299938  0.416365  1
  Ta  Ta133  1  0.262212  0.687412  0.492152  1
  Ta  Ta134  1  0.263964  0.044912  0.523995  1
  Ta  Ta135  1  0.267387  0.333203  0.462781  1
  Ta  Ta136  1  0.768334  0.510074  0.477176  1
  Ta  Ta137  1  0.764538  0.867282  0.507804  1
  Ta  Ta138  1  0.767504  0.220942  0.538335  1
  Ta  Ta139  1  0.518533  0.359937  0.456229  1
  Ta  Ta140  1  0.511994  0.714797  0.485473  1
  Ta  Ta141  1  0.515348  0.071392  0.518446  1
  Ta  Ta142  1  0.946321  0.669440  0.495923  1
  Ta  Ta143  1  0.942716  0.026998  0.527742  1
  Ta  Ta144  1  0.947393  0.315164  0.466223  1
  Ta  Ta145  1  0.595707  0.436898  0.492811  1
  Ta  Ta146  1  0.600148  0.791069  0.522423  1
  Ta  Ta147  1  0.594555  0.081605  0.462876  1
  Ta  Ta148  1  0.945976  0.581288  0.462343  1
  Ta  Ta149  1  0.943109  0.938820  0.492897  1
  Ta  Ta150  1  0.946723  0.293168  0.523256  1
  Ta  Ta151  1  0.085865  0.470392  0.538905  1
  Ta  Ta152  1  0.083688  0.760051  0.477230  1
  Ta  Ta153  1  0.086267  0.116173  0.508589  1
  Ta  Ta154  1  0.431642  0.612418  0.508061  1
  Ta  Ta155  1  0.432496  0.971082  0.539817  1
  Ta  Ta156  1  0.438249  0.259872  0.478483  1
  Ta  Ta157  1  0.088495  0.492145  0.481829  1
  Ta  Ta158  1  0.082133  0.848851  0.511654  1
  Ta  Ta159  1  0.088139  0.203914  0.542802  1
  Ta  Ta160  1  0.518294  0.537122  0.471238  1
  Ta  Ta161  1  0.512285  0.893069  0.502213  1
  Ta  Ta162  1  0.516059  0.249019  0.533716  1
  Ta  Ta163  1  0.701429  0.621869  0.509098  1
  Ta  Ta164  1  0.700724  0.975303  0.538579  1
  Ta  Ta165  1  0.706917  0.262398  0.476442  1
  Ta  Ta166  1  0.769928  0.453004  0.542347  1
  Ta  Ta167  1  0.763671  0.741273  0.481325  1
  Ta  Ta168  1  0.766582  0.098788  0.512482  1
  Ta  Ta169  1  0.696125  0.702540  0.551468  1
  Ta  Ta170  1  0.707436  -0.009001  0.482356  1
  Ta  Ta171  1  0.708766  0.345515  0.511592  1
  Ta  Ta172  1  0.905583  0.419296  0.496784  1
  Ta  Ta173  1  0.898547  0.774754  0.526484  1
  Ta  Ta174  1  0.902767  0.064816  0.466673  1
  Ta  Ta175  1  0.128915  0.595569  0.512266  1
  Ta  Ta176  1  0.126014  0.955346  0.542634  1
  Ta  Ta177  1  0.129811  0.242478  0.482190  1
  Ta  Ta178  1  0.330391  0.522216  0.531867  1
  Ta  Ta179  1  0.318576  0.812694  0.465422  1
  Ta  Ta180  1  0.325774  0.168857  0.498242  1
  Ta  Ta181  1  0.266563  0.563599  0.466695  1
  Ta  Ta182  1  0.261008  0.920801  0.496490  1
  Ta  Ta183  1  0.265699  0.276646  0.528054  1
  Ta  Ta184  1  0.327431  0.441823  0.494162  1
  Ta  Ta185  1  0.325590  0.797588  0.521114  1
  Ta  Ta186  1  0.326651  0.085385  0.462913  1
  Ta  Ta187  1  0.904428  0.544125  0.522571  1
  Ta  Ta188  1  0.899514  0.832887  0.462232  1
  Ta  Ta189  1  0.904451  0.189066  0.492548  1
  Ta  Ta190  1  0.599749  0.526746  0.526006  1
  Ta  Ta191  1  0.589128  0.814595  0.465076  1
  Ta  Ta192  1  0.594607  0.171660  0.496571  1
  Ta  Ta193  1  0.434792  0.705623  0.539460  1
  Ta  Ta194  1  0.437903  -0.006766  0.481597  1
  Ta  Ta195  1  0.439669  0.349550  0.512592  1
  Ta  Ta196  1  0.124110  0.723991  0.537031  1
  Ta  Ta197  1  0.126577  0.012053  0.478235  1
  Ta  Ta198  1  0.131573  0.367066  0.508758  1
  Ta  Ta199  1  0.267050  0.758518  0.582634  1
  Ta  Ta200  1  0.266821  0.110050  0.616193  1
  Ta  Ta201  1  0.267237  0.401050  0.556060  1
  Ta  Ta202  1  0.772716  0.571104  0.569122  1
  Ta  Ta203  1  0.765918  0.932242  0.601016  1
  Ta  Ta204  1  0.762578  0.286004  0.629017  1
  Ta  Ta205  1  0.518603  0.425622  0.549371  1
  Ta  Ta206  1  0.503920  0.791108  0.575479  1
  Ta  Ta207  1  0.516976  0.138088  0.611422  1
  Ta  Ta208  1  0.929875  0.739240  0.585343  1
  Ta  Ta209  1  0.943761  0.092716  0.619101  1
  Ta  Ta210  1  0.948278  0.381230  0.557472  1
  Ta  Ta211  1  0.597435  0.501402  0.585413  1
  Ta  Ta212  1  0.614143  0.853175  0.619037  1
  Ta  Ta213  1  0.595330  0.148366  0.555367  1
  Ta  Ta214  1  0.943156  0.647313  0.553132  1
  Ta  Ta215  1  0.942610  0.004672  0.585079  1
  Ta  Ta216  1  0.944244  0.357867  0.613564  1
  Ta  Ta217  1  0.090610  0.527667  0.634271  1
  Ta  Ta218  1  0.078451  0.826551  0.569060  1
  Ta  Ta219  1  0.087407  0.180901  0.599780  1
  Ta  Ta220  1  0.455568  0.686571  0.596949  1
  Ta  Ta221  1  0.438809  0.037763  0.633396  1
  Ta  Ta222  1  0.437648  0.326640  0.571635  1
  Ta  Ta223  1  0.093918  0.557990  0.573118  1
  Ta  Ta224  1  0.079240  0.914271  0.603807  1
  Ta  Ta225  1  0.086562  0.268675  0.632989  1
  Ta  Ta226  1  0.513324  0.601709  0.563949  1
  Ta  Ta227  1  0.513881  0.960132  0.595964  1
  Ta  Ta228  1  0.512115  0.311928  0.627498  1
  Ta  Ta229  1  0.729464  0.649622  0.604113  1
  Ta  Ta230  1  0.706100  0.037660  0.631085  1
  Ta  Ta231  1  0.706922  0.326877  0.567266  1
  Ta  Ta232  1  0.769352  0.527924  0.632913  1
  Ta  Ta233  1  0.769602  0.818679  0.570146  1
  Ta  Ta234  1  0.767514  0.165316  0.603949  1
  Ta  Ta235  1  0.690451  0.748713  0.612056  1
  Ta  Ta236  1  0.706358  0.057131  0.574757  1
  Ta  Ta237  1  0.710111  0.410256  0.601850  1
  Ta  Ta238  1  0.909745  0.483695  0.589006  1
  Ta  Ta239  1  0.890334  0.834692  0.622110  1
  Ta  Ta240  1  0.903662  0.130847  0.558406  1
  Ta  Ta241  1  0.120399  0.681169  0.599553  1
  Ta  Ta242  1  0.123136  0.020235  0.635199  1
  Ta  Ta243  1  0.130093  0.308779  0.573734  1
  Ta  Ta244  1  0.281339  0.609775  0.612284  1
  Ta  Ta245  1  0.310230  0.881166  0.557029  1
  Ta  Ta246  1  0.323238  0.234649  0.590203  1
  Ta  Ta247  1  0.260910  0.635062  0.556262  1
  Ta  Ta248  1  0.261342  0.987472  0.588982  1
  Ta  Ta249  1  0.265889  0.340423  0.620518  1
  Ta  Ta250  1  0.332967  0.510560  0.594271  1
  Ta  Ta251  1  0.332611  0.865344  0.613177  1
  Ta  Ta252  1  0.327218  0.152195  0.554543  1
  Ta  Ta253  1  0.952687  0.607023  0.615062  1
  Ta  Ta254  1  0.902082  0.904713  0.552752  1
  Ta  Ta255  1  0.904690  0.254394  0.583634  1
  Ta  Ta256  1  0.547199  0.582175  0.621126  1
  Ta  Ta257  1  0.585739  0.886327  0.557789  1
  Ta  Ta258  1  0.591939  0.237684  0.589048  1
  Ta  Ta259  1  0.440301  0.774667  0.634062  1
  Ta  Ta260  1  0.437657  0.060523  0.574081  1
  Ta  Ta261  1  0.441777  0.414955  0.607478  1
  Ta  Ta262  1  0.128159  0.792352  0.629186  1
  Ta  Ta263  1  0.128179  0.077987  0.569714  1
  Ta  Ta264  1  0.134058  0.431914  0.602297  1
  Ta  Ta265  1  0.267945  0.825574  0.672773  1
  Ta  Ta266  1  0.259243  0.178521  0.704691  1
  Ta  Ta267  1  0.249811  0.459442  0.655278  1
  Ta  Ta268  1  0.783005  0.641718  0.660937  1
  Ta  Ta269  1  0.772388  0.002604  0.692969  1
  Ta  Ta270  1  0.804949  0.378429  0.708311  1
  Ta  Ta271  1  0.535060  0.482019  0.648064  1
  Ta  Ta272  1  0.509295  0.854373  0.672484  1
  Ta  Ta273  1  0.516944  0.206320  0.702978  1
  Ta  Ta274  1  0.959226  0.808548  0.682718  1
  Ta  Ta275  1  0.947345  0.159481  0.705362  1
  Ta  Ta276  1  0.923466  0.442510  0.648990  1
  Ta  Ta277  1  0.601372  0.576871  0.681336  1
  Ta  Ta278  1  0.611317  0.920432  0.711497  1
  Ta  Ta279  1  0.601378  0.215124  0.650705  1
  Ta  Ta280  1  0.948682  0.718363  0.643743  1
  Ta  Ta281  1  0.945202  0.070985  0.675453  1
  Ta  Ta282  1  1.014278  0.444846  0.699117  1
  Ta  Ta283  1  0.066078  0.631179  0.717595  1
  Ta  Ta284  1  0.082178  0.894943  0.660972  1
  Ta  Ta285  1  0.080811  0.246719  0.687359  1
  Ta  Ta286  1  0.439293  0.749115  0.691585  1
  Ta  Ta287  1  0.414097  0.101361  0.723958  1
  Ta  Ta288  1  0.421324  0.387146  0.663865  1
  Ta  Ta289  1  0.089566  0.631917  0.663763  1
  Ta  Ta290  1  0.081346  0.980597  0.694482  1
  Ta  Ta291  1  0.057164  0.336370  0.716911  1
  Ta  Ta292  1  0.521677  0.670786  0.652674  1
  Ta  Ta293  1  0.524904  0.029264  0.688273  1
  Ta  Ta294  1  0.547160  0.407376  0.708488  1
  Ta  Ta295  1  0.703847  0.763022  0.665491  1
  Ta  Ta296  1  0.685364  0.118304  0.714039  1
  Ta  Ta297  1  0.690684  0.394236  0.656366  1
  Ta  Ta298  1  0.807825  0.602268  0.716422  1
  Ta  Ta299  1  0.767566  0.880051  0.666406  1
  Ta  Ta300  1  0.785617  0.239889  0.696259  1
  Ta  Ta301  1  0.693507  0.808918  0.713775  1
  Ta  Ta302  1  0.716068  0.123902  0.662546  1
  Ta  Ta303  1  0.731529  0.484598  0.692919  1
  Ta  Ta304  1  0.925941  0.551117  0.677172  1
  Ta  Ta305  1  0.894444  0.907526  0.710227  1
  Ta  Ta306  1  0.903634  0.197221  0.650077  1
  Ta  Ta307  1  0.156282  0.738234  0.695105  1
  Ta  Ta308  1  0.127361  0.088237  0.719729  1
  Ta  Ta309  1  0.126560  0.367441  0.665375  1
  Ta  Ta310  1  0.343576  0.638049  0.698517  1
  Ta  Ta311  1  0.310572  0.948131  0.648202  1
  Ta  Ta312  1  0.322452  0.298867  0.685792  1
  Ta  Ta313  1  0.267711  0.701412  0.647672  1
  Ta  Ta314  1  0.268587  0.052411  0.679272  1
  Ta  Ta315  1  0.266514  0.414026  0.708797  1
  Ta  Ta316  1  0.345515  0.566862  0.658445  1
  Ta  Ta317  1  0.344268  0.935587  0.700692  1
  Ta  Ta318  1  0.329325  0.218228  0.647585  1
  Ta  Ta319  1  0.889478  0.707565  0.700953  1
  Ta  Ta320  1  0.899804  0.966856  0.647290  1
  Ta  Ta321  1  0.903370  0.321627  0.670043  1
  Ta  Ta322  1  0.629309  0.683228  0.706358  1
  Ta  Ta323  1  0.585953  0.950081  0.653287  1
  Ta  Ta324  1  0.600267  0.308570  0.683498  1
  Ta  Ta325  1  0.404485  0.836082  0.723455  1
  Ta  Ta326  1  0.444652  0.127577  0.668785  1
  Ta  Ta327  1  0.427061  0.501515  0.699378  1
  Ta  Ta328  1  0.140429  0.864684  0.715762  1
  Ta  Ta329  1  0.129007  0.142968  0.660918  1
  Ta  Ta330  1  0.170239  0.535141  0.697223  1
