# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.86784145
_cell_length_b   32.95654686
_cell_length_c   50.02568597
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.06487701
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta
_chemical_formula_sum   Ta330
_cell_volume   12971.4962499
_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  0.860692  0.984464  0.291603  1
  Ta  Ta2  1  0.878686  0.644956  0.323394  1
  Ta  Ta3  1  0.896941  0.288251  0.351722  1
  Ta  Ta4  1  0.364337  0.109337  0.358644  1
  Ta  Ta5  1  0.262087  0.788709  0.303981  1
  Ta  Ta6  1  0.399906  0.462446  0.338775  1
  Ta  Ta7  1  0.813523  0.077892  0.302195  1
  Ta  Ta8  1  0.816950  0.727122  0.341215  1
  Ta  Ta9  1  0.799052  0.427890  0.288505  1
  Ta  Ta10  1  0.017815  0.216141  0.332895  1
  Ta  Ta11  1  0.923764  0.902943  0.280250  1
  Ta  Ta12  1  0.974269  0.564518  0.300869  1
  Ta  Ta13  1  0.643137  0.057517  0.349042  1
  Ta  Ta14  1  0.627946  0.761323  0.299847  1
  Ta  Ta15  1  0.642720  0.405737  0.331487  1
  Ta  Ta16  1  0.120540  0.209411  0.281226  1
  Ta  Ta17  1  0.182151  0.872673  0.311488  1
  Ta  Ta18  1  0.144857  0.517033  0.345065  1
  Ta  Ta19  1  0.552711  0.928453  0.287918  1
  Ta  Ta20  1  0.613910  0.595078  0.307711  1
  Ta  Ta21  1  0.645928  0.236528  0.337383  1
  Ta  Ta22  1  0.161655  0.052643  0.300772  1
  Ta  Ta23  1  0.160300  0.698576  0.332341  1
  Ta  Ta24  1  0.147273  0.340887  0.364395  1
  Ta  Ta25  1  0.466365  0.242706  0.288638  1
  Ta  Ta26  1  0.538784  0.846426  0.312128  1
  Ta  Ta27  1  0.513727  0.538460  0.349359  1
  Ta  Ta28  1  0.324134  0.019481  0.343947  1
  Ta  Ta29  1  0.355828  0.710227  0.285604  1
  Ta  Ta30  1  0.326185  0.367130  0.320878  1
  Ta  Ta31  1  0.086783  0.135977  0.312939  1
  Ta  Ta32  1  0.075656  0.782228  0.351096  1
  Ta  Ta33  1  0.066246  0.482451  0.295438  1
  Ta  Ta34  1  0.732014  0.147737  0.340461  1
  Ta  Ta35  1  0.682137  0.806379  0.356448  1
  Ta  Ta36  1  0.678445  0.505884  0.301867  1
  Ta  Ta37  1  0.960610  1.011545  0.338748  1
  Ta  Ta38  1  -0.011879  0.733968  0.292714  1
  Ta  Ta39  1  0.078694  0.420846  0.331001  1
  Ta  Ta40  1  0.746634  0.177158  0.292643  1
  Ta  Ta41  1  0.897894  0.818027  0.308878  1
  Ta  Ta42  1  0.828325  0.477776  0.344146  1
  Ta  Ta43  1  0.212543  0.965346  0.295219  1
  Ta  Ta44  1  0.247384  0.609666  0.331318  1
  Ta  Ta45  1  0.334059  0.269404  0.348836  1
  Ta  Ta46  1  0.521316  0.016701  0.297830  1
  Ta  Ta47  1  0.525069  0.675547  0.327488  1
  Ta  Ta48  1  0.581260  0.329256  0.362421  1
  Ta  Ta49  1  0.066442  0.938711  0.340116  1
  Ta  Ta50  1  0.239702  0.584335  0.382175  1
  Ta  Ta51  1  0.174865  0.290785  0.305822  1
  Ta  Ta52  1  0.402256  0.926684  0.337496  1
  Ta  Ta53  1  0.723349  0.679670  0.282137  1
  Ta  Ta54  1  0.581576  0.315312  0.309707  1
  Ta  Ta55  1  0.371533  0.184102  0.324018  1
  Ta  Ta56  1  0.335840  0.837982  0.358293  1
  Ta  Ta57  1  0.339865  0.535292  0.298627  1
  Ta  Ta58  1  0.465920  0.103964  0.305914  1
  Ta  Ta59  1  0.426317  0.750231  0.344776  1
  Ta  Ta60  1  0.405874  0.442709  0.288749  1
  Ta  Ta61  1  0.671331  0.974079  0.339128  1
  Ta  Ta62  1  0.103994  0.648078  0.283311  1
  Ta  Ta63  1  0.911357  0.350752  0.316504  1
  Ta  Ta64  1  0.785486  0.899042  0.326710  1
  Ta  Ta65  1  0.870872  0.568172  0.353366  1
  Ta  Ta66  1  0.841476  0.264570  0.292979  1
  Ta  Ta67  1  0.861536  0.943767  0.383189  1
  Ta  Ta68  1  0.875997  0.596189  0.412859  1
  Ta  Ta69  1  0.894528  0.241662  0.442868  1
  Ta  Ta70  1  0.372007  0.062768  0.455810  1
  Ta  Ta71  1  0.409283  0.764105  0.398199  1
  Ta  Ta72  1  0.396997  0.417083  0.430239  1
  Ta  Ta73  1  0.814736  0.029537  0.395343  1
  Ta  Ta74  1  0.827886  0.684803  0.433179  1
  Ta  Ta75  1  0.839330  0.384000  0.373856  1
  Ta  Ta76  1  0.015671  0.168117  0.426218  1
  Ta  Ta77  1  0.975524  0.859505  0.363959  1
  Ta  Ta78  1  0.962473  0.514671  0.396958  1
  Ta  Ta79  1  0.650449  1.005173  0.443855  1
  Ta  Ta80  1  0.660867  0.705390  0.387194  1
  Ta  Ta81  1  0.644818  0.362451  0.419179  1
  Ta  Ta82  1  0.103292  0.160027  0.371597  1
  Ta  Ta83  1  0.147631  0.817811  0.407305  1
  Ta  Ta84  1  0.145171  0.470996  0.440156  1
  Ta  Ta85  1  0.610696  0.889858  0.372696  1
  Ta  Ta86  1  0.606685  0.547247  0.402736  1
  Ta  Ta87  1  0.640602  0.188328  0.430710  1
  Ta  Ta88  1  0.143699  1.001166  0.390510  1
  Ta  Ta89  1  0.147457  0.650139  0.424992  1
  Ta  Ta90  1  0.143457  0.296203  0.454974  1
  Ta  Ta91  1  0.457129  0.191246  0.378993  1
  Ta  Ta92  1  0.514375  0.838374  0.412452  1
  Ta  Ta93  1  0.520743  0.491613  0.444064  1
  Ta  Ta94  1  0.319525  0.978146  0.438643  1
  Ta  Ta95  1  0.339520  0.672842  0.377912  1
  Ta  Ta96  1  0.334335  0.318722  0.409900  1
  Ta  Ta97  1  0.095004  0.086532  0.408495  1
  Ta  Ta98  1  0.076368  0.742504  0.445088  1
  Ta  Ta99  1  0.083805  0.439561  0.384302  1
  Ta  Ta100  1  0.731758  0.123038  0.389077  1
  Ta  Ta101  1  0.655416  0.760606  0.448966  1
  Ta  Ta102  1  0.649444  0.456878  0.388478  1
  Ta  Ta103  1  0.007873  0.030592  0.449079  1
  Ta  Ta104  1  0.079268  0.724948  0.391004  1
  Ta  Ta105  1  0.082698  0.375108  0.421614  1
  Ta  Ta106  1  0.009721  0.082944  0.354758  1
  Ta  Ta107  1  0.826882  0.781728  0.402706  1
  Ta  Ta108  1  0.830056  0.434889  0.433745  1
  Ta  Ta109  1  0.237703  0.910347  0.393454  1
  Ta  Ta110  1  0.241336  0.561366  0.431050  1
  Ta  Ta111  1  0.325982  0.223860  0.438913  1
  Ta  Ta112  1  0.507618  0.975801  0.387326  1
  Ta  Ta113  1  0.521128  0.629213  0.420236  1
  Ta  Ta114  1  0.580773  0.283483  0.452142  1
  Ta  Ta115  1  0.236551  0.886938  0.445221  1
  Ta  Ta116  1  0.240520  0.538269  0.478876  1
  Ta  Ta117  1  0.148320  0.246961  0.393361  1
  Ta  Ta118  1  0.597271  0.920254  0.428522  1
  Ta  Ta119  1  0.607485  0.618742  0.365786  1
  Ta  Ta120  1  0.581404  0.264236  0.397487  1
  Ta  Ta121  1  0.369410  0.134783  0.418356  1
  Ta  Ta122  1  0.333334  0.795968  0.455107  1
  Ta  Ta123  1  0.334329  0.494125  0.393198  1
  Ta  Ta124  1  0.455931  0.054074  0.401258  1
  Ta  Ta125  1  0.405246  0.703282  0.436563  1
  Ta  Ta126  1  0.393464  0.398014  0.376549  1
  Ta  Ta127  1  0.965031  0.953066  0.434582  1
  Ta  Ta128  1  0.969207  0.651134  0.374200  1
  Ta  Ta129  1  0.896475  0.306079  0.406792  1
  Ta  Ta130  1  0.874001  0.870981  0.418211  1
  Ta  Ta131  1  0.875828  0.524958  0.450533  1
  Ta  Ta132  1  0.831822  0.211922  0.384165  1
  Ta  Ta133  1  0.874819  0.898380  0.475857  1
  Ta  Ta134  1  0.876026  0.551459  0.508063  1
  Ta  Ta135  1  0.893874  0.196820  0.534208  1
  Ta  Ta136  1  0.370550  0.018002  0.551521  1
  Ta  Ta137  1  0.404930  0.720457  0.491271  1
  Ta  Ta138  1  0.399614  0.372431  0.521545  1
  Ta  Ta139  1  0.819944  0.982567  0.492328  1
  Ta  Ta140  1  0.827511  0.641217  0.524965  1
  Ta  Ta141  1  0.834722  0.339764  0.464259  1
  Ta  Ta142  1  0.015393  0.122252  0.519878  1
  Ta  Ta143  1  0.960790  0.816947  0.459500  1
  Ta  Ta144  1  0.959585  0.468713  0.491124  1
  Ta  Ta145  1  0.646647  0.960920  0.540542  1
  Ta  Ta146  1  0.655705  0.663008  0.478853  1
  Ta  Ta147  1  0.644559  0.317627  0.509394  1
  Ta  Ta148  1  0.099793  0.111456  0.465957  1
  Ta  Ta149  1  0.143654  0.773710  0.502497  1
  Ta  Ta150  1  0.146203  0.425646  0.533353  1
  Ta  Ta151  1  0.602303  0.849996  0.466116  1
  Ta  Ta152  1  0.607302  0.502196  0.497642  1
  Ta  Ta153  1  0.640162  0.142842  0.523731  1
  Ta  Ta154  1  0.150310  0.955697  0.487295  1
  Ta  Ta155  1  0.147477  0.605439  0.518558  1
  Ta  Ta156  1  0.142471  0.251900  0.545360  1
  Ta  Ta157  1  0.454572  0.145003  0.472828  1
  Ta  Ta158  1  0.514952  0.794944  0.506454  1
  Ta  Ta159  1  0.523110  0.446307  0.537437  1
  Ta  Ta160  1  0.318625  0.932830  0.536028  1
  Ta  Ta161  1  0.336434  0.628176  0.471716  1
  Ta  Ta162  1  0.333236  0.274008  0.500215  1
  Ta  Ta163  1  0.096535  0.039943  0.503665  1
  Ta  Ta164  1  0.077537  0.698174  0.537562  1
  Ta  Ta165  1  0.082188  0.394611  0.475852  1
  Ta  Ta166  1  0.734654  0.074809  0.484476  1
  Ta  Ta167  1  0.657991  0.718405  0.543008  1
  Ta  Ta168  1  0.651669  0.412171  0.479468  1
  Ta  Ta169  1  0.008145  0.985239  0.545729  1
  Ta  Ta170  1  0.077282  0.681276  0.483027  1
  Ta  Ta171  1  0.082158  0.330541  0.512497  1
  Ta  Ta172  1  0.733503  0.097998  0.436706  1
  Ta  Ta173  1  0.824268  0.738508  0.495623  1
  Ta  Ta174  1  0.829819  0.390228  0.525658  1
  Ta  Ta175  1  0.236315  0.864246  0.494473  1
  Ta  Ta176  1  0.242901  0.515057  0.526411  1
  Ta  Ta177  1  0.324749  0.179005  0.530732  1
  Ta  Ta178  1  0.507852  0.930728  0.482282  1
  Ta  Ta179  1  0.520476  0.584230  0.513955  1
  Ta  Ta180  1  0.579852  0.238923  0.542712  1
  Ta  Ta181  1  0.233640  0.841685  0.543100  1
  Ta  Ta182  1  0.241597  0.492854  0.574418  1
  Ta  Ta183  1  0.147244  0.201362  0.484800  1
  Ta  Ta184  1  0.598139  0.876372  0.523894  1
  Ta  Ta185  1  0.606435  0.573916  0.460274  1
  Ta  Ta186  1  0.579222  0.219047  0.488500  1
  Ta  Ta187  1  0.369262  0.088853  0.513246  1
  Ta  Ta188  1  0.335043  0.750088  0.548877  1
  Ta  Ta189  1  0.336122  0.448133  0.486685  1
  Ta  Ta190  1  0.460558  1.007820  0.497182  1
  Ta  Ta191  1  0.407927  0.658889  0.529178  1
  Ta  Ta192  1  0.396581  0.352664  0.467046  1
  Ta  Ta193  1  0.959517  0.908196  0.530660  1
  Ta  Ta194  1  0.961150  0.607033  0.467329  1
  Ta  Ta195  1  0.895383  0.261177  0.497468  1
  Ta  Ta196  1  0.872147  0.826995  0.513851  1
  Ta  Ta197  1  0.879307  0.479265  0.545463  1
  Ta  Ta198  1  0.830921  0.165380  0.477205  1
  Ta  Ta199  1  0.874587  0.851972  0.572113  1
  Ta  Ta200  1  0.884323  0.506395  0.604548  1
  Ta  Ta201  1  0.891629  0.153622  0.625991  1
  Ta  Ta202  1  0.363437  0.976621  0.648789  1
  Ta  Ta203  1  0.399912  0.673870  0.583791  1
  Ta  Ta204  1  0.386081  0.326904  0.612229  1
  Ta  Ta205  1  0.814389  0.941350  0.588870  1
  Ta  Ta206  1  0.818599  0.597018  0.614690  1
  Ta  Ta207  1  0.833231  0.295884  0.554727  1
  Ta  Ta208  1  0.009750  0.078125  0.614403  1
  Ta  Ta209  1  0.972209  0.773043  0.556199  1
  Ta  Ta210  1  0.975823  0.425980  0.586767  1
  Ta  Ta211  1  0.619295  0.922254  0.638522  1
  Ta  Ta212  1  0.654301  0.616390  0.569505  1
  Ta  Ta213  1  0.637528  0.273163  0.599481  1
  Ta  Ta214  1  0.098403  0.066466  0.561053  1
  Ta  Ta215  1  0.138783  0.728789  0.597637  1
  Ta  Ta216  1  0.144707  0.383894  0.627421  1
  Ta  Ta217  1  0.606710  0.804222  0.560139  1
  Ta  Ta218  1  0.617736  0.456976  0.591596  1
  Ta  Ta219  1  0.638617  0.099054  0.617895  1
  Ta  Ta220  1  0.139512  0.907021  0.584735  1
  Ta  Ta221  1  0.158755  0.558792  0.614808  1
  Ta  Ta222  1  0.136593  0.209423  0.635770  1
  Ta  Ta223  1  0.454008  0.099993  0.566899  1
  Ta  Ta224  1  0.489364  0.745242  0.601996  1
  Ta  Ta225  1  0.508360  0.397607  0.631047  1
  Ta  Ta226  1  0.301310  0.885789  0.630769  1
  Ta  Ta227  1  0.338222  0.581907  0.565876  1
  Ta  Ta228  1  0.331076  0.229370  0.590555  1
  Ta  Ta229  1  0.093112  0.995758  0.600174  1
  Ta  Ta230  1  0.077636  0.650322  0.628496  1
  Ta  Ta231  1  0.082490  0.350793  0.567263  1
  Ta  Ta232  1  0.730498  0.030242  0.580927  1
  Ta  Ta233  1  0.680249  0.676809  0.631972  1
  Ta  Ta234  1  0.657560  0.369533  0.572468  1
  Ta  Ta235  1  0.001403  0.945395  0.643409  1
  Ta  Ta236  1  0.083875  0.634902  0.574800  1
  Ta  Ta237  1  0.082963  0.285328  0.602542  1
  Ta  Ta238  1  0.734434  0.052199  0.532447  1
  Ta  Ta239  1  0.826634  0.686686  0.584591  1
  Ta  Ta240  1  0.835002  0.341334  0.615013  1
  Ta  Ta241  1  0.297493  0.816718  0.589389  1
  Ta  Ta242  1  0.305187  0.467514  0.620527  1
  Ta  Ta243  1  0.323613  0.135802  0.622510  1
  Ta  Ta244  1  0.522825  0.886866  0.579774  1
  Ta  Ta245  1  0.529219  0.539309  0.608915  1
  Ta  Ta246  1  0.580961  0.195458  0.633187  1
  Ta  Ta247  1  0.027546  0.813892  0.615472  1
  Ta  Ta248  1  0.031521  0.474905  0.648978  1
  Ta  Ta249  1  0.145139  0.156898  0.576677  1
  Ta  Ta250  1  0.611608  0.828328  0.620098  1
  Ta  Ta251  1  0.609861  0.528270  0.555087  1
  Ta  Ta252  1  0.577818  0.174727  0.579887  1
  Ta  Ta253  1  0.365027  0.045492  0.609208  1
  Ta  Ta254  1  0.323424  0.701129  0.647555  1
  Ta  Ta255  1  0.340513  0.402650  0.579074  1
  Ta  Ta256  1  0.449517  0.963761  0.593721  1
  Ta  Ta257  1  0.423676  0.616456  0.622235  1
  Ta  Ta258  1  0.397467  0.308498  0.557522  1
  Ta  Ta259  1  0.885240  0.876910  0.627895  1
  Ta  Ta260  1  0.966325  0.560692  0.561823  1
  Ta  Ta261  1  0.892110  0.217161  0.588016  1
  Ta  Ta262  1  0.800393  0.762260  0.605653  1
  Ta  Ta263  1  0.818306  0.418149  0.636447  1
  Ta  Ta264  1  0.829126  0.120607  0.570586  1
  Ta  Ta265  1  0.862871  0.803886  0.664848  1
  Ta  Ta266  1  0.888805  0.458449  0.696486  1
  Ta  Ta267  1  0.913999  0.120224  0.716816  1
  Ta  Ta268  1  0.326681  0.930798  0.739260  1
  Ta  Ta269  1  0.518628  0.655987  0.679524  1
  Ta  Ta270  1  0.386980  0.272918  0.703205  1
  Ta  Ta271  1  0.801552  0.893804  0.684129  1
  Ta  Ta272  1  0.777557  0.542107  0.705743  1
  Ta  Ta273  1  0.829585  0.252556  0.644327  1
  Ta  Ta274  1  0.014790  0.040685  0.709187  1
  Ta  Ta275  1  0.976094  0.727394  0.648939  1
  Ta  Ta276  1  0.975539  0.380737  0.677955  1
  Ta  Ta277  1  0.627635  0.874176  0.729389  1
  Ta  Ta278  1  0.617356  0.580266  0.663355  1
  Ta  Ta279  1  0.653650  0.229479  0.687997  1
  Ta  Ta280  1  0.096667  0.025586  0.657986  1
  Ta  Ta281  1  0.132899  0.679999  0.694098  1
  Ta  Ta282  1  0.128012  0.328023  0.717899  1
  Ta  Ta283  1  0.585103  0.752557  0.660508  1
  Ta  Ta284  1  0.616078  0.403856  0.687830  1
  Ta  Ta285  1  0.640660  0.066569  0.713329  1
  Ta  Ta286  1  0.124012  0.862754  0.675328  1
  Ta  Ta287  1  0.152417  0.510687  0.704905  1
  Ta  Ta288  1  0.183603  0.178324  0.722884  1
  Ta  Ta289  1  0.455869  0.058246  0.662988  1
  Ta  Ta290  1  0.458321  0.715114  0.711904  1
  Ta  Ta291  1  0.498232  0.349144  0.723784  1
  Ta  Ta292  1  0.293209  0.846508  0.721721  1
  Ta  Ta293  1  0.339443  0.528813  0.660771  1
  Ta  Ta294  1  0.330658  0.187992  0.677974  1
  Ta  Ta295  1  0.093271  0.953521  0.695124  1
  Ta  Ta296  1  0.055596  0.593878  0.715597  1
  Ta  Ta297  1  0.073062  0.306544  0.657814  1
  Ta  Ta298  1  0.725362  0.987709  0.682521  1
  Ta  Ta299  1  0.715125  0.633710  0.719960  1
  Ta  Ta300  1  0.647977  0.324512  0.659589  1
  Ta  Ta301  1  0.003351  0.894638  0.731055  1
  Ta  Ta302  1  0.240607  0.606809  0.670978  1
  Ta  Ta303  1  0.056878  0.245991  0.692592  1
  Ta  Ta304  1  0.728509  1.009502  0.630676  1
  Ta  Ta305  1  0.876936  0.635535  0.672352  1
  Ta  Ta306  1  0.789662  0.307476  0.703875  1
  Ta  Ta307  1  0.283137  0.790918  0.643080  1
  Ta  Ta308  1  0.294680  0.439935  0.671953  1
  Ta  Ta309  1  0.308807  0.098746  0.711868  1
  Ta  Ta310  1  0.511522  0.842873  0.673044  1
  Ta  Ta311  1  0.508616  0.482408  0.707792  1
  Ta  Ta312  1  0.574101  0.161424  0.721974  1
  Ta  Ta313  1  0.205273  0.770275  0.691932  1
  Ta  Ta314  1  0.223709  0.414667  0.719245  1
  Ta  Ta315  1  0.144777  0.115928  0.667923  1
  Ta  Ta316  1  0.585974  0.791763  0.711967  1
  Ta  Ta317  1  0.646134  0.486154  0.653986  1
  Ta  Ta318  1  0.581658  0.134183  0.672414  1
  Ta  Ta319  1  0.364258  1.006539  0.704961  1
  Ta  Ta320  1  0.344713  0.641184  0.730258  1
  Ta  Ta321  1  0.335494  0.352047  0.674388  1
  Ta  Ta322  1  0.426283  0.919256  0.688426  1
  Ta  Ta323  1  0.435781  0.569137  0.711339  1
  Ta  Ta324  1  0.392874  0.264177  0.648342  1
  Ta  Ta325  1  0.921609  0.816495  0.716833  1
  Ta  Ta326  1  0.958981  0.551652  0.660975  1
  Ta  Ta327  1  0.901112  0.175441  0.678627  1
  Ta  Ta328  1  0.816588  0.722143  0.698297  1
  Ta  Ta329  1  0.853182  0.385514  0.730198  1
  Ta  Ta330  1  0.828001  0.078847  0.666171  1
