# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.74971426
_cell_length_b   21.08442764
_cell_length_c   49.21317720
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   89.95059411
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta
_chemical_formula_sum   Ta264
_cell_volume   11154.2398528
_cell_formula_units_Z   264
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  0.004446  0.722333  0.323334  1
  Ta  Ta2  1  0.992945  0.149132  0.291002  1
  Ta  Ta3  1  0.493712  0.934392  0.307364  1
  Ta  Ta4  1  0.499675  0.506481  0.344529  1
  Ta  Ta5  1  0.802392  0.791137  0.297211  1
  Ta  Ta6  1  0.820362  0.362709  0.327792  1
  Ta  Ta7  1  0.182329  0.084642  0.316477  1
  Ta  Ta8  1  0.173290  0.650794  0.352146  1
  Ta  Ta9  1  0.199773  0.956117  0.303782  1
  Ta  Ta10  1  0.175249  0.523625  0.335261  1
  Ta  Ta11  1  0.738401  0.903530  0.317252  1
  Ta  Ta12  1  0.745816  0.481183  0.351457  1
  Ta  Ta13  1  0.293547  0.732065  0.316560  1
  Ta  Ta14  1  0.316540  0.313136  0.355538  1
  Ta  Ta15  1  0.749853  0.118108  0.299524  1
  Ta  Ta16  1  0.755489  0.693471  0.334684  1
  Ta  Ta17  1  0.671118  0.153433  0.350926  1
  Ta  Ta18  1  0.663925  0.576864  0.310847  1
  Ta  Ta19  1  0.330436  0.861831  0.334326  1
  Ta  Ta20  1  0.329364  0.297640  0.302443  1
  Ta  Ta21  1  0.944579  0.021784  0.330858  1
  Ta  Ta22  1  0.927370  0.462206  0.304616  1
  Ta  Ta23  1  0.134937  0.956700  0.361325  1
  Ta  Ta24  1  0.131694  0.382675  0.329067  1
  Ta  Ta25  1  0.012823  0.877093  0.324533  1
  Ta  Ta26  1  0.021749  0.309355  0.292772  1
  Ta  Ta27  1  0.943976  0.145772  0.351327  1
  Ta  Ta28  1  0.925318  0.583488  0.322285  1
  Ta  Ta29  1  0.486015  0.095951  0.310231  1
  Ta  Ta30  1  0.498754  0.673142  0.343908  1
  Ta  Ta31  1  0.538251  0.786731  0.304321  1
  Ta  Ta32  1  0.555793  0.365734  0.339795  1
  Ta  Ta33  1  0.585542  0.818274  0.354361  1
  Ta  Ta34  1  0.566653  0.244242  0.319650  1
  Ta  Ta35  1  0.364720  0.172987  0.345516  1
  Ta  Ta36  1  0.371949  0.590362  0.310621  1
  Ta  Ta37  1  0.661803  0.022814  0.334234  1
  Ta  Ta38  1  0.646975  0.447140  0.299558  1
  Ta  Ta39  1  0.359447  0.007586  0.344119  1
  Ta  Ta40  1  0.362630  0.431710  0.310522  1
  Ta  Ta41  1  0.847935  0.809453  0.353814  1
  Ta  Ta42  1  0.839227  0.235545  0.315982  1
  Ta  Ta43  1  0.139529  0.221911  0.327107  1
  Ta  Ta44  1  0.144560  0.628881  0.294800  1
  Ta  Ta45  1  0.005899  0.868646  0.395614  1
  Ta  Ta46  1  0.995175  0.295725  0.360318  1
  Ta  Ta47  1  0.497261  0.082324  0.378114  1
  Ta  Ta48  1  0.500641  0.656405  0.412939  1
  Ta  Ta49  1  0.823991  0.938069  0.368483  1
  Ta  Ta50  1  0.811201  0.510821  0.406968  1
  Ta  Ta51  1  0.171442  0.226356  0.387136  1
  Ta  Ta52  1  0.185220  0.800319  0.421547  1
  Ta  Ta53  1  0.179354  0.099369  0.371331  1
  Ta  Ta54  1  0.182225  0.672679  0.407177  1
  Ta  Ta55  1  0.746445  0.053610  0.388001  1
  Ta  Ta56  1  0.743271  0.627780  0.426977  1
  Ta  Ta57  1  0.321712  0.886247  0.388929  1
  Ta  Ta58  1  0.318582  0.458595  0.425426  1
  Ta  Ta59  1  0.750179  0.268142  0.370072  1
  Ta  Ta60  1  0.761551  0.841206  0.408360  1
  Ta  Ta61  1  0.678426  0.299650  0.424140  1
  Ta  Ta62  1  0.686812  0.724530  0.388407  1
  Ta  Ta63  1  0.319814  0.013561  0.403674  1
  Ta  Ta64  1  0.316760  0.440469  0.370113  1
  Ta  Ta65  1  0.922087  0.177934  0.404423  1
  Ta  Ta66  1  0.934408  0.601887  0.374974  1
  Ta  Ta67  1  0.129097  0.107671  0.431790  1
  Ta  Ta68  1  0.137036  0.531158  0.398100  1
  Ta  Ta69  1  0.995007  0.031867  0.396612  1
  Ta  Ta70  1  0.993866  0.459842  0.363542  1
  Ta  Ta71  1  0.947120  0.298291  0.422641  1
  Ta  Ta72  1  0.955236  0.724474  0.387779  1
  Ta  Ta73  1  0.501036  0.247043  0.380960  1
  Ta  Ta74  1  0.510393  0.819881  0.415027  1
  Ta  Ta75  1  0.550862  0.938927  0.369704  1
  Ta  Ta76  1  0.546446  0.514619  0.405484  1
  Ta  Ta77  1  0.571472  0.966256  0.422601  1
  Ta  Ta78  1  0.560862  0.392105  0.392377  1
  Ta  Ta79  1  0.360271  0.318245  0.416356  1
  Ta  Ta80  1  0.369283  0.745434  0.379251  1
  Ta  Ta81  1  0.655422  0.169490  0.408876  1
  Ta  Ta82  1  0.668534  0.597456  0.370067  1
  Ta  Ta83  1  0.354714  0.157461  0.413137  1
  Ta  Ta84  1  0.358210  0.583324  0.377480  1
  Ta  Ta85  1  0.845496  0.956668  0.428620  1
  Ta  Ta86  1  0.825876  0.383911  0.388564  1
  Ta  Ta87  1  0.136153  0.369249  0.396300  1
  Ta  Ta88  1  0.144920  0.793429  0.361314  1
  Ta  Ta89  1  0.998802  0.020053  0.465968  1
  Ta  Ta90  1  0.995751  0.442203  0.431587  1
  Ta  Ta91  1  0.498407  0.230234  0.449917  1
  Ta  Ta92  1  0.502434  0.807251  0.483871  1
  Ta  Ta93  1  0.817154  0.089742  0.440823  1
  Ta  Ta94  1  0.832063  0.669802  0.478746  1
  Ta  Ta95  1  0.175359  0.373364  0.457319  1
  Ta  Ta96  1  0.179412  0.950100  0.490818  1
  Ta  Ta97  1  0.175309  0.247380  0.442317  1
  Ta  Ta98  1  0.194759  0.817015  0.476873  1
  Ta  Ta99  1  0.754512  0.206996  0.460595  1
  Ta  Ta100  1  0.813220  0.798166  0.492070  1
  Ta  Ta101  1  0.307009  0.033325  0.457926  1
  Ta  Ta102  1  0.311438  0.600585  0.494354  1
  Ta  Ta103  1  0.753953  0.413805  0.445499  1
  Ta  Ta104  1  0.707590  0.004800  0.473892  1
  Ta  Ta105  1  0.666434  0.455567  0.497122  1
  Ta  Ta106  1  0.674579  0.881055  0.459756  1
  Ta  Ta107  1  0.315733  0.162761  0.474034  1
  Ta  Ta108  1  0.320122  0.586864  0.438889  1
  Ta  Ta109  1  0.933135  0.319912  0.476315  1
  Ta  Ta110  1  0.943119  0.747503  0.440858  1
  Ta  Ta111  1  0.130792  0.252923  0.502916  1
  Ta  Ta112  1  0.141627  0.678222  0.467643  1
  Ta  Ta113  1  0.995719  0.177537  0.469294  1
  Ta  Ta114  1  0.993968  0.604721  0.434305  1
  Ta  Ta115  1  0.968003  0.440549  0.495498  1
  Ta  Ta116  1  0.976104  0.868616  0.459321  1
  Ta  Ta117  1  0.503764  0.391558  0.452467  1
  Ta  Ta118  1  0.483436  0.961115  0.489519  1
  Ta  Ta119  1  0.532056  0.085618  0.442184  1
  Ta  Ta120  1  0.530153  0.654964  0.477081  1
  Ta  Ta121  1  0.606624  0.120539  0.492098  1
  Ta  Ta122  1  0.556994  0.533420  0.459155  1
  Ta  Ta123  1  0.358133  0.463338  0.486037  1
  Ta  Ta124  1  0.365701  0.893824  0.449136  1
  Ta  Ta125  1  0.654981  0.316310  0.485147  1
  Ta  Ta126  1  0.663063  0.744801  0.447839  1
  Ta  Ta127  1  0.357398  0.303288  0.483939  1
  Ta  Ta128  1  0.364997  0.730470  0.447221  1
  Ta  Ta129  1  0.858153  0.095097  0.503341  1
  Ta  Ta130  1  0.836421  0.531444  0.466676  1
  Ta  Ta131  1  0.136895  0.516155  0.465491  1
  Ta  Ta132  1  0.140389  0.944168  0.429728  1
  Ta  Ta133  1  1.000688  0.165386  0.539120  1
  Ta  Ta134  1  0.999933  0.592987  0.502449  1
  Ta  Ta135  1  0.497327  0.378585  0.521071  1
  Ta  Ta136  1  0.501306  0.955313  0.555309  1
  Ta  Ta137  1  0.820423  0.235445  0.514223  1
  Ta  Ta138  1  0.824353  0.812413  0.547739  1
  Ta  Ta139  1  0.167686  0.516121  0.526159  1
  Ta  Ta140  1  0.182758  0.095859  0.564262  1
  Ta  Ta141  1  0.186455  0.387559  0.512919  1
  Ta  Ta142  1  0.245002  0.978470  0.544555  1
  Ta  Ta143  1  0.805057  0.368865  0.528077  1
  Ta  Ta144  1  0.824293  0.938208  0.562972  1
  Ta  Ta145  1  0.292851  0.180550  0.531195  1
  Ta  Ta146  1  0.245726  0.772099  0.559556  1
  Ta  Ta147  1  0.688330  0.585367  0.510543  1
  Ta  Ta148  1  0.692479  0.152225  0.547181  1
  Ta  Ta149  1  0.679544  0.598937  0.566005  1
  Ta  Ta150  1  0.684048  0.022731  0.531188  1
  Ta  Ta151  1  0.325449  0.304507  0.545146  1
  Ta  Ta152  1  0.333285  0.730336  0.507816  1
  Ta  Ta153  1  0.858134  0.507723  0.537229  1
  Ta  Ta154  1  0.869338  0.932546  0.502278  1
  Ta  Ta155  1  0.056501  0.438351  0.563980  1
  Ta  Ta156  1  0.067055  0.865758  0.528862  1
  Ta  Ta157  1  0.023420  0.317111  0.545656  1
  Ta  Ta158  1  0.031834  0.745330  0.509449  1
  Ta  Ta159  1  0.005920  0.581132  0.570589  1
  Ta  Ta160  1  0.003786  0.008085  0.535884  1
  Ta  Ta161  1  0.469650  0.530998  0.527803  1
  Ta  Ta162  1  0.467660  0.099633  0.563055  1
  Ta  Ta163  1  0.516520  0.224472  0.515420  1
  Ta  Ta164  1  0.495912  0.794276  0.552582  1
  Ta  Ta165  1  0.634034  0.291835  0.555733  1
  Ta  Ta166  1  0.641506  0.722509  0.518934  1
  Ta  Ta167  1  0.442665  0.652473  0.545788  1
  Ta  Ta168  1  0.393166  0.064754  0.513083  1
  Ta  Ta169  1  0.634799  0.455402  0.557652  1
  Ta  Ta170  1  0.642357  0.882480  0.521098  1
  Ta  Ta171  1  0.336796  0.441109  0.556975  1
  Ta  Ta172  1  0.344994  0.869471  0.519967  1
  Ta  Ta173  1  0.858785  0.241504  0.575207  1
  Ta  Ta174  1  0.862947  0.669714  0.539442  1
  Ta  Ta175  1  0.163383  0.654477  0.538267  1
  Ta  Ta176  1  0.141503  0.090371  0.501789  1
  Ta  Ta177  1  0.994322  0.317272  0.609065  1
  Ta  Ta178  1  0.004071  0.743514  0.573476  1
  Ta  Ta179  1  0.499197  0.529294  0.591957  1
  Ta  Ta180  1  0.502452  0.102665  0.627182  1
  Ta  Ta181  1  0.814197  0.385383  0.583341  1
  Ta  Ta182  1  0.828430  0.959308  0.618407  1
  Ta  Ta183  1  0.189236  0.675038  0.597953  1
  Ta  Ta184  1  0.178955  0.248703  0.635778  1
  Ta  Ta185  1  0.256580  0.558004  0.577915  1
  Ta  Ta186  1  0.253077  0.131977  0.617136  1
  Ta  Ta187  1  0.817662  0.513018  0.597666  1
  Ta  Ta188  1  0.820599  0.086246  0.634049  1
  Ta  Ta189  1  0.238671  0.344827  0.596328  1
  Ta  Ta190  1  0.248429  0.917634  0.635612  1
  Ta  Ta191  1  0.681152  0.727163  0.579490  1
  Ta  Ta192  1  0.677360  0.299414  0.615930  1
  Ta  Ta193  1  0.681740  0.745014  0.634710  1
  Ta  Ta194  1  0.679657  0.171726  0.601467  1
  Ta  Ta195  1  0.313220  0.461205  0.616455  1
  Ta  Ta196  1  0.321152  0.886115  0.581135  1
  Ta  Ta197  1  0.862406  0.654471  0.606817  1
  Ta  Ta198  1  0.870133  0.077952  0.573439  1
  Ta  Ta199  1  0.065590  0.583692  0.629830  1
  Ta  Ta200  1  0.077365  0.007465  0.600345  1
  Ta  Ta201  1  0.044614  0.461158  0.617061  1
  Ta  Ta202  1  0.052319  0.887067  0.582580  1
  Ta  Ta203  1  0.006825  0.725086  0.641328  1
  Ta  Ta204  1  0.004785  0.154250  0.608273  1
  Ta  Ta205  1  0.453488  0.670991  0.599480  1
  Ta  Ta206  1  0.450707  0.246251  0.635380  1
  Ta  Ta207  1  0.489679  0.365926  0.589806  1
  Ta  Ta208  1  0.498251  0.938682  0.624459  1
  Ta  Ta209  1  0.630757  0.440184  0.625663  1
  Ta  Ta210  1  0.639167  0.867421  0.588848  1
  Ta  Ta211  1  0.438539  0.793465  0.612648  1
  Ta  Ta212  1  0.428673  0.219336  0.582422  1
  Ta  Ta213  1  0.641585  0.602082  0.627440  1
  Ta  Ta214  1  0.645098  0.027853  0.592230  1
  Ta  Ta215  1  0.331205  0.588155  0.634858  1
  Ta  Ta216  1  0.343932  0.015927  0.596467  1
  Ta  Ta217  1  0.854818  0.392082  0.643468  1
  Ta  Ta218  1  0.863425  0.816318  0.608792  1
  Ta  Ta219  1  0.173715  0.802040  0.616686  1
  Ta  Ta220  1  0.154740  0.228933  0.576160  1
  Ta  Ta221  1  0.995292  0.462711  0.681564  1
  Ta  Ta222  1  0.003783  0.889804  0.645169  1
  Ta  Ta223  1  0.500240  0.678686  0.660492  1
  Ta  Ta224  1  0.506639  0.250781  0.697665  1
  Ta  Ta225  1  0.826650  0.534445  0.652707  1
  Ta  Ta226  1  0.823252  0.099110  0.688324  1
  Ta  Ta227  1  0.179091  0.823767  0.677629  1
  Ta  Ta228  1  0.197808  0.394287  0.707675  1
  Ta  Ta229  1  0.254678  0.704720  0.653460  1
  Ta  Ta230  1  0.262016  0.282252  0.687396  1
  Ta  Ta231  1  0.824140  0.661229  0.669500  1
  Ta  Ta232  1  0.803304  0.227276  0.700750  1
  Ta  Ta233  1  0.244575  0.491877  0.670190  1
  Ta  Ta234  1  0.228528  0.069887  0.702797  1
  Ta  Ta235  1  0.683716  0.872771  0.649650  1
  Ta  Ta236  1  0.706278  0.453096  0.688278  1
  Ta  Ta237  1  0.669885  0.887332  0.702613  1
  Ta  Ta238  1  0.670570  0.322926  0.670723  1
  Ta  Ta239  1  0.335846  0.608356  0.694069  1
  Ta  Ta240  1  0.327419  0.031934  0.654704  1
  Ta  Ta241  1  0.866467  0.801278  0.675257  1
  Ta  Ta242  1  0.863204  0.229894  0.643080  1
  Ta  Ta243  1  0.073875  0.721381  0.700003  1
  Ta  Ta244  1  0.056717  0.166366  0.671438  1
  Ta  Ta245  1  0.074450  0.601186  0.682515  1
  Ta  Ta246  1  0.055034  0.039599  0.652759  1
  Ta  Ta247  1  0.976551  0.867739  0.712718  1
  Ta  Ta248  1  0.987311  0.308673  0.680128  1
  Ta  Ta249  1  0.443679  0.819593  0.665276  1
  Ta  Ta250  1  0.462026  0.398533  0.700502  1
  Ta  Ta251  1  0.501093  0.512370  0.660994  1
  Ta  Ta252  1  0.511727  0.088690  0.694884  1
  Ta  Ta253  1  0.627837  0.594760  0.694402  1
  Ta  Ta254  1  0.635590  0.012309  0.660269  1
  Ta  Ta255  1  0.428831  0.940163  0.685428  1
  Ta  Ta256  1  0.415139  0.367228  0.650408  1
  Ta  Ta257  1  0.636495  0.753347  0.694525  1
  Ta  Ta258  1  0.641547  0.176365  0.661382  1
  Ta  Ta259  1  0.352090  0.738313  0.705470  1
  Ta  Ta260  1  0.338817  0.162730  0.670931  1
  Ta  Ta261  1  0.855321  0.556210  0.710088  1
  Ta  Ta262  1  0.863520  0.963421  0.679345  1
  Ta  Ta263  1  0.151161  0.953132  0.690330  1
  Ta  Ta264  1  0.152334  0.376347  0.650989  1
