# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   18.25585753
_cell_length_b   14.10349708
_cell_length_c   48.52390390
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   110.35155639
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta
_chemical_formula_sum   Ta308
_cell_volume   11713.6283062
_cell_formula_units_Z   308
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  0.438693  0.953644  0.291355  1
  Ta  Ta2  1  0.924988  0.930167  0.290511  1
  Ta  Ta3  1  0.708056  0.503320  0.294657  1
  Ta  Ta4  1  0.162273  0.574566  0.281784  1
  Ta  Ta5  1  0.960952  0.633940  0.333882  1
  Ta  Ta6  1  0.301072  0.772018  0.283375  1
  Ta  Ta7  1  0.545603  0.224287  0.334936  1
  Ta  Ta8  1  0.049539  0.247462  0.330709  1
  Ta  Ta9  1  0.863355  0.656253  0.292745  1
  Ta  Ta10  1  0.333368  0.600086  0.294254  1
  Ta  Ta11  1  0.558594  0.348734  0.291639  1
  Ta  Ta12  1  0.018822  0.360116  0.281806  1
  Ta  Ta13  1  0.831546  0.246425  0.271684  1
  Ta  Ta14  1  0.259174  0.221087  0.291694  1
  Ta  Ta15  1  0.635126  0.778852  0.317090  1
  Ta  Ta16  1  0.126405  0.733852  0.320131  1
  Ta  Ta17  1  0.762172  0.121618  0.314697  1
  Ta  Ta18  1  0.278096  0.090775  0.324452  1
  Ta  Ta19  1  0.719007  0.646148  0.331976  1
  Ta  Ta20  1  0.225008  0.634274  0.331759  1
  Ta  Ta21  1  0.573791  0.591994  0.295528  1
  Ta  Ta22  1  0.017798  0.599384  0.283521  1
  Ta  Ta23  1  0.878817  0.446519  0.301638  1
  Ta  Ta24  1  0.392374  0.435994  0.304541  1
  Ta  Ta25  1  0.551283  0.456513  0.335447  1
  Ta  Ta26  1  0.052287  0.475351  0.326741  1
  Ta  Ta27  1  0.901401  0.277437  0.321597  1
  Ta  Ta28  1  0.404083  0.268810  0.325734  1
  Ta  Ta29  1  0.580453  0.126141  0.294731  1
  Ta  Ta30  1  0.077068  0.133167  0.292675  1
  Ta  Ta31  1  0.783841  0.909261  0.325699  1
  Ta  Ta32  1  0.271135  0.885828  0.322183  1
  Ta  Ta33  1  0.624694  0.960223  0.305335  1
  Ta  Ta34  1  0.138799  0.970610  0.303669  1
  Ta  Ta35  1  0.784588  0.991349  0.277641  1
  Ta  Ta36  1  0.292839  0.998052  0.276977  1
  Ta  Ta37  1  0.718860  0.304952  0.306198  1
  Ta  Ta38  1  0.194225  0.388089  0.306387  1
  Ta  Ta39  1  0.758271  0.757527  0.285890  1
  Ta  Ta40  1  0.160708  0.798292  0.270316  1
  Ta  Ta41  1  0.487385  0.784915  0.296326  1
  Ta  Ta42  1  0.011101  0.802761  0.298999  1
  Ta  Ta43  1  0.425742  0.163441  0.283799  1
  Ta  Ta44  1  0.930417  0.145112  0.281077  1
  Ta  Ta45  1  0.537586  0.803745  0.357899  1
  Ta  Ta46  1  0.041480  0.806655  0.359112  1
  Ta  Ta47  1  0.792256  0.307660  0.357309  1
  Ta  Ta48  1  0.283460  0.310046  0.354027  1
  Ta  Ta49  1  0.043851  0.454141  0.401188  1
  Ta  Ta50  1  0.461474  0.627177  0.331203  1
  Ta  Ta51  1  0.620091  0.026664  0.399359  1
  Ta  Ta52  1  0.121212  0.031393  0.397778  1
  Ta  Ta53  1  0.929237  0.460056  0.362203  1
  Ta  Ta54  1  0.425514  0.454714  0.363446  1
  Ta  Ta55  1  0.656360  0.148206  0.351749  1
  Ta  Ta56  1  0.155361  0.152171  0.344650  1
  Ta  Ta57  1  0.911179  0.076392  0.331228  1
  Ta  Ta58  1  0.410773  0.064392  0.332927  1
  Ta  Ta59  1  0.700220  0.561385  0.384598  1
  Ta  Ta60  1  0.210232  0.580380  0.389840  1
  Ta  Ta61  1  0.851966  0.938289  0.379827  1
  Ta  Ta62  1  0.347657  0.940873  0.378919  1
  Ta  Ta63  1  0.796597  0.452318  0.397866  1
  Ta  Ta64  1  0.294577  0.450144  0.399566  1
  Ta  Ta65  1  0.664403  0.391416  0.349722  1
  Ta  Ta66  1  0.152270  0.414371  0.359453  1
  Ta  Ta67  1  0.966247  0.279035  0.372482  1
  Ta  Ta68  1  0.467400  0.274384  0.375329  1
  Ta  Ta69  1  0.628776  0.276569  0.397193  1
  Ta  Ta70  1  0.123589  0.262884  0.395074  1
  Ta  Ta71  1  0.988938  0.099107  0.384995  1
  Ta  Ta72  1  0.487817  0.096001  0.387711  1
  Ta  Ta73  1  0.682417  0.952375  0.358520  1
  Ta  Ta74  1  0.183289  0.948013  0.358974  1
  Ta  Ta75  1  0.854114  0.692767  0.382192  1
  Ta  Ta76  1  0.358050  0.699268  0.383073  1
  Ta  Ta77  1  0.717141  0.780521  0.372677  1
  Ta  Ta78  1  0.215999  0.776636  0.373354  1
  Ta  Ta79  1  0.881902  0.799349  0.335123  1
  Ta  Ta80  1  0.381420  0.796059  0.334753  1
  Ta  Ta81  1  0.811799  0.121140  0.371804  1
  Ta  Ta82  1  0.308753  0.133288  0.377260  1
  Ta  Ta83  1  0.807657  0.526458  0.340712  1
  Ta  Ta84  1  0.311614  0.525220  0.346576  1
  Ta  Ta85  1  0.581871  0.630594  0.364021  1
  Ta  Ta86  1  0.082471  0.618502  0.367534  1
  Ta  Ta87  1  0.520112  0.980912  0.343269  1
  Ta  Ta88  1  0.019278  0.983912  0.340870  1
  Ta  Ta89  1  0.627893  0.629142  0.426693  1
  Ta  Ta90  1  0.124737  0.628438  0.428860  1
  Ta  Ta91  1  0.875787  0.125802  0.425440  1
  Ta  Ta92  1  0.375963  0.127493  0.427331  1
  Ta  Ta93  1  0.128027  0.266810  0.467043  1
  Ta  Ta94  1  0.545273  0.455067  0.400108  1
  Ta  Ta95  1  0.705134  0.841391  0.465445  1
  Ta  Ta96  1  0.203569  0.841931  0.466469  1
  Ta  Ta97  1  0.011472  0.278197  0.431195  1
  Ta  Ta98  1  0.511916  0.282783  0.432866  1
  Ta  Ta99  1  0.741764  0.967087  0.419212  1
  Ta  Ta100  1  0.240751  0.969553  0.420086  1
  Ta  Ta101  1  0.971641  0.878425  0.400037  1
  Ta  Ta102  1  0.470288  0.878109  0.400221  1
  Ta  Ta103  1  0.784553  0.377343  0.452790  1
  Ta  Ta104  1  0.287432  0.383631  0.455004  1
  Ta  Ta105  1  0.931834  0.751819  0.447015  1
  Ta  Ta106  1  0.432071  0.750667  0.446820  1
  Ta  Ta107  1  0.878238  0.266404  0.466393  1
  Ta  Ta108  1  0.378975  0.268696  0.467246  1
  Ta  Ta109  1  0.739433  0.205263  0.416318  1
  Ta  Ta110  1  0.237556  0.213803  0.420547  1
  Ta  Ta111  1  0.047333  0.092471  0.438809  1
  Ta  Ta112  1  0.548241  0.092883  0.439755  1
  Ta  Ta113  1  0.707683  0.089521  0.463010  1
  Ta  Ta114  1  0.207557  0.086937  0.464626  1
  Ta  Ta115  1  0.067374  0.915023  0.454737  1
  Ta  Ta116  1  0.568237  0.913229  0.454194  1
  Ta  Ta117  1  0.780806  0.772220  0.424203  1
  Ta  Ta118  1  0.280190  0.774694  0.425167  1
  Ta  Ta119  1  0.936752  0.510714  0.449935  1
  Ta  Ta120  1  0.437999  0.513134  0.449284  1
  Ta  Ta121  1  0.799888  0.592246  0.439160  1
  Ta  Ta122  1  0.297194  0.592211  0.440624  1
  Ta  Ta123  1  0.966319  0.626555  0.403172  1
  Ta  Ta124  1  0.463714  0.621103  0.401188  1
  Ta  Ta125  1  0.895556  0.947618  0.442163  1
  Ta  Ta126  1  0.395522  0.948067  0.442009  1
  Ta  Ta127  1  0.888368  0.341457  0.411840  1
  Ta  Ta128  1  0.387727  0.342534  0.412531  1
  Ta  Ta129  1  0.663507  0.442083  0.434348  1
  Ta  Ta130  1  0.163259  0.433075  0.432269  1
  Ta  Ta131  1  0.603293  0.804191  0.411316  1
  Ta  Ta132  1  0.104187  0.805583  0.412367  1
  Ta  Ta133  1  0.710820  0.443786  0.494229  1
  Ta  Ta134  1  0.207515  0.441278  0.495118  1
  Ta  Ta135  1  0.957593  0.943571  0.494967  1
  Ta  Ta136  1  0.459234  0.941365  0.493803  1
  Ta  Ta137  1  0.211206  0.081296  0.534291  1
  Ta  Ta138  1  0.629313  0.268365  0.466924  1
  Ta  Ta139  1  0.788703  0.659808  0.533325  1
  Ta  Ta140  1  0.286437  0.656074  0.533355  1
  Ta  Ta141  1  0.092904  0.096052  0.499696  1
  Ta  Ta142  1  0.594549  0.096229  0.500016  1
  Ta  Ta143  1  0.825852  0.784569  0.486628  1
  Ta  Ta144  1  0.324870  0.783115  0.486884  1
  Ta  Ta145  1  0.050912  0.694795  0.469065  1
  Ta  Ta146  1  0.553106  0.693888  0.467978  1
  Ta  Ta147  1  0.868997  0.193658  0.521608  1
  Ta  Ta148  1  0.368052  0.192836  0.521008  1
  Ta  Ta149  1  0.013432  0.565895  0.514757  1
  Ta  Ta150  1  0.514682  0.567187  0.514430  1
  Ta  Ta151  1  0.961158  0.083452  0.535884  1
  Ta  Ta152  1  0.461168  0.081064  0.534028  1
  Ta  Ta153  1  0.819783  0.025192  0.484486  1
  Ta  Ta154  1  0.320422  0.022901  0.485207  1
  Ta  Ta155  1  0.127437  0.907092  0.507444  1
  Ta  Ta156  1  0.630654  0.907164  0.506120  1
  Ta  Ta157  1  0.789565  0.904121  0.530000  1
  Ta  Ta158  1  0.289264  0.901967  0.530734  1
  Ta  Ta159  1  0.148743  0.728583  0.522409  1
  Ta  Ta160  1  0.651249  0.729110  0.521731  1
  Ta  Ta161  1  0.862670  0.588218  0.491754  1
  Ta  Ta162  1  0.362121  0.587767  0.491994  1
  Ta  Ta163  1  0.020447  0.324420  0.516874  1
  Ta  Ta164  1  0.519028  0.326901  0.515563  1
  Ta  Ta165  1  0.881278  0.407292  0.506977  1
  Ta  Ta166  1  0.380824  0.408312  0.507400  1
  Ta  Ta167  1  0.048765  0.441497  0.470165  1
  Ta  Ta168  1  0.550375  0.449104  0.470376  1
  Ta  Ta169  1  0.975634  0.764220  0.510605  1
  Ta  Ta170  1  0.477618  0.762291  0.509492  1
  Ta  Ta171  1  0.971252  0.155810  0.479776  1
  Ta  Ta172  1  0.471854  0.155502  0.480045  1
  Ta  Ta173  1  0.746860  0.252813  0.501380  1
  Ta  Ta174  1  0.245040  0.253326  0.501573  1
  Ta  Ta175  1  0.690128  0.622197  0.479121  1
  Ta  Ta176  1  0.187567  0.619983  0.480151  1
  Ta  Ta177  1  0.791001  0.257055  0.561402  1
  Ta  Ta178  1  0.293501  0.256686  0.561289  1
  Ta  Ta179  1  0.038710  0.759977  0.562726  1
  Ta  Ta180  1  0.540267  0.757090  0.561803  1
  Ta  Ta181  1  0.294285  0.893401  0.601206  1
  Ta  Ta182  1  0.712004  0.081112  0.533972  1
  Ta  Ta183  1  0.869161  0.474324  0.600763  1
  Ta  Ta184  1  0.372674  0.473694  0.600490  1
  Ta  Ta185  1  0.176214  0.907341  0.567043  1
  Ta  Ta186  1  0.676960  0.908095  0.566799  1
  Ta  Ta187  1  0.907538  0.600149  0.554495  1
  Ta  Ta188  1  0.407728  0.598751  0.553926  1
  Ta  Ta189  1  0.133857  0.507787  0.535884  1
  Ta  Ta190  1  0.635758  0.509733  0.535139  1
  Ta  Ta191  1  0.949666  0.017482  0.594245  1
  Ta  Ta192  1  0.451629  1.008611  0.588582  1
  Ta  Ta193  1  0.097231  0.381177  0.582269  1
  Ta  Ta194  1  0.598579  0.380581  0.580927  1
  Ta  Ta195  1  0.041516  0.899646  0.604081  1
  Ta  Ta196  1  0.543796  0.897978  0.602438  1
  Ta  Ta197  1  0.903046  0.848428  0.553931  1
  Ta  Ta198  1  0.402217  0.839064  0.551979  1
  Ta  Ta199  1  0.210811  0.719775  0.574394  1
  Ta  Ta200  1  0.713402  0.724593  0.574161  1
  Ta  Ta201  1  0.872518  0.722693  0.598690  1
  Ta  Ta202  1  0.371245  0.718724  0.597430  1
  Ta  Ta203  1  0.235606  0.542867  0.589317  1
  Ta  Ta204  1  0.733621  0.545370  0.588903  1
  Ta  Ta205  1  0.943933  0.402437  0.559166  1
  Ta  Ta206  1  0.445810  0.402878  0.558897  1
  Ta  Ta207  1  0.098255  0.150277  0.587693  1
  Ta  Ta208  1  0.600223  0.141396  0.580348  1
  Ta  Ta209  1  0.962470  0.224457  0.575948  1
  Ta  Ta210  1  0.463507  0.222626  0.573910  1
  Ta  Ta211  1  0.130806  0.256054  0.538868  1
  Ta  Ta212  1  0.632471  0.264800  0.536160  1
  Ta  Ta213  1  0.058002  0.578244  0.576824  1
  Ta  Ta214  1  0.559911  0.578621  0.576986  1
  Ta  Ta215  1  0.057175  0.979065  0.550070  1
  Ta  Ta216  1  0.554893  0.967799  0.547461  1
  Ta  Ta217  1  0.828859  0.066578  0.569862  1
  Ta  Ta218  1  0.327849  0.066473  0.568768  1
  Ta  Ta219  1  0.772001  0.436851  0.546620  1
  Ta  Ta220  1  0.271560  0.435150  0.546685  1
  Ta  Ta221  1  0.854191  0.070726  0.634915  1
  Ta  Ta222  1  0.371314  0.071789  0.627146  1
  Ta  Ta223  1  0.122134  0.566927  0.627789  1
  Ta  Ta224  1  0.622394  0.575468  0.628862  1
  Ta  Ta225  1  0.382379  0.717899  0.669106  1
  Ta  Ta226  1  0.793194  0.898428  0.602946  1
  Ta  Ta227  1  0.913644  0.264246  0.671333  1
  Ta  Ta228  1  0.450820  0.285177  0.666695  1
  Ta  Ta229  1  0.259693  0.716141  0.636052  1
  Ta  Ta230  1  0.758130  0.726983  0.634647  1
  Ta  Ta231  1  0.986845  0.410185  0.621939  1
  Ta  Ta232  1  0.491880  0.413350  0.620719  1
  Ta  Ta233  1  0.224140  0.323741  0.601364  1
  Ta  Ta234  1  0.718648  0.319154  0.602846  1
  Ta  Ta235  1  0.034680  0.821528  0.660212  1
  Ta  Ta236  1  0.537011  0.844708  0.661220  1
  Ta  Ta237  1  0.181453  0.198289  0.648926  1
  Ta  Ta238  1  0.705480  0.193464  0.652983  1
  Ta  Ta239  1  0.122658  0.701853  0.668708  1
  Ta  Ta240  1  0.612994  0.710102  0.671524  1
  Ta  Ta241  1  0.985911  0.656960  0.619190  1
  Ta  Ta242  1  0.484092  0.662080  0.620871  1
  Ta  Ta243  1  0.305448  0.539843  0.642274  1
  Ta  Ta244  1  0.792973  0.542301  0.641675  1
  Ta  Ta245  1  0.961331  0.547604  0.665710  1
  Ta  Ta246  1  0.457305  0.543780  0.666653  1
  Ta  Ta247  1  0.321948  0.358067  0.658051  1
  Ta  Ta248  1  0.824048  0.378433  0.657328  1
  Ta  Ta249  1  0.017673  0.223685  0.631072  1
  Ta  Ta250  1  0.531922  0.219611  0.625419  1
  Ta  Ta251  1  0.180927  0.958841  0.651063  1
  Ta  Ta252  1  0.685684  0.955517  0.649017  1
  Ta  Ta253  1  0.045137  0.040131  0.645625  1
  Ta  Ta254  1  0.553438  0.045201  0.641802  1
  Ta  Ta255  1  0.209579  0.073466  0.603623  1
  Ta  Ta256  1  0.707596  0.072831  0.602123  1
  Ta  Ta257  1  0.155949  0.392187  0.640702  1
  Ta  Ta258  1  0.647902  0.393072  0.641623  1
  Ta  Ta259  1  0.139289  0.788444  0.616417  1
  Ta  Ta260  1  0.634887  0.784723  0.615266  1
  Ta  Ta261  1  0.908595  0.887869  0.640854  1
  Ta  Ta262  1  0.414755  0.886161  0.636649  1
  Ta  Ta263  1  0.851816  0.252691  0.613185  1
  Ta  Ta264  1  0.354441  0.251697  0.613468  1
  Ta  Ta265  1  0.964640  0.892525  0.700854  1
  Ta  Ta266  1  0.440116  0.903752  0.698022  1
  Ta  Ta267  1  0.214156  0.387489  0.693951  1
  Ta  Ta268  1  0.697883  0.394510  0.693830  1
  Ta  Ta269  1  0.534834  0.563613  0.719414  1
  Ta  Ta270  1  0.880714  0.709639  0.668090  1
  Ta  Ta271  1  0.027092  0.101706  0.728864  1
  Ta  Ta272  1  0.485867  0.099685  0.727986  1
  Ta  Ta273  1  0.348811  0.560372  0.705112  1
  Ta  Ta274  1  0.834184  0.532452  0.703377  1
  Ta  Ta275  1  0.072245  0.224849  0.685229  1
  Ta  Ta276  1  0.576470  0.227232  0.685211  1
  Ta  Ta277  1  0.296688  0.133380  0.668117  1
  Ta  Ta278  1  0.782182  0.074450  0.690572  1
  Ta  Ta279  1  0.084380  0.589549  0.715057  1
  Ta  Ta280  1  0.679907  0.734111  0.724363  1
  Ta  Ta281  1  0.291273  0.998872  0.710031  1
  Ta  Ta282  1  0.838235  0.952498  0.726518  1
  Ta  Ta283  1  0.198509  0.523901  0.732156  1
  Ta  Ta284  1  0.678386  0.531371  0.732206  1
  Ta  Ta285  1  0.060064  0.432312  0.677803  1
  Ta  Ta286  1  0.570097  0.458760  0.679937  1
  Ta  Ta287  1  0.393154  0.389394  0.707893  1
  Ta  Ta288  1  0.928988  0.419636  0.711210  1
  Ta  Ta289  1  0.060036  0.348947  0.726388  1
  Ta  Ta290  1  0.535229  0.340468  0.724652  1
  Ta  Ta291  1  0.388847  0.198168  0.714857  1
  Ta  Ta292  1  0.913348  0.194578  0.722520  1
  Ta  Ta293  1  0.120125  0.031973  0.694238  1
  Ta  Ta294  1  0.608265  0.054036  0.694587  1
  Ta  Ta295  1  0.264891  0.745382  0.707346  1
  Ta  Ta296  1  0.829054  0.728402  0.721099  1
  Ta  Ta297  1  0.136175  0.842680  0.706736  1
  Ta  Ta298  1  0.655625  0.896417  0.704908  1
  Ta  Ta299  1  0.289253  0.885179  0.666477  1
  Ta  Ta300  1  0.787191  0.861177  0.677953  1
  Ta  Ta301  1  0.230039  0.208870  0.709081  1
  Ta  Ta302  1  0.770344  0.260550  0.705095  1
  Ta  Ta303  1  0.207699  0.573661  0.679071  1
  Ta  Ta304  1  0.714704  0.610366  0.682680  1
  Ta  Ta305  1  0.980522  0.687526  0.708511  1
  Ta  Ta306  1  0.503700  0.735140  0.709054  1
  Ta  Ta307  1  0.935233  0.061880  0.682479  1
  Ta  Ta308  1  0.437730  0.077256  0.676181  1
