# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   18.12636763
_cell_length_b   14.44902749
_cell_length_c   49.05170388
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   110.61243867
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta
_chemical_formula_sum   Ta308
_cell_volume   12024.6244214
_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  0.898665  0.169266  0.297066  1
  Ta  Ta2  1  0.398665  0.169266  0.297066  1
  Ta  Ta3  1  0.645888  0.679377  0.301427  1
  Ta  Ta4  1  0.145888  0.679377  0.301427  1
  Ta  Ta5  1  0.760442  0.439598  0.276806  1
  Ta  Ta6  1  0.260442  0.439598  0.276806  1
  Ta  Ta7  1  0.562992  0.921368  0.322591  1
  Ta  Ta8  1  0.062992  0.921368  0.322591  1
  Ta  Ta9  1  0.579484  0.011950  0.273718  1
  Ta  Ta10  1  0.079484  0.011950  0.273718  1
  Ta  Ta11  1  0.726862  0.336466  0.323160  1
  Ta  Ta12  1  0.226862  0.336466  0.323160  1
  Ta  Ta13  1  0.816561  0.984091  0.269476  1
  Ta  Ta14  1  0.316561  0.984091  0.269476  1
  Ta  Ta15  1  0.483068  0.363010  0.328489  1
  Ta  Ta16  1  0.983068  0.363010  0.328489  1
  Ta  Ta17  1  0.519305  0.515046  0.291723  1
  Ta  Ta18  1  0.019305  0.515046  0.291723  1
  Ta  Ta19  1  0.789999  0.848428  0.308625  1
  Ta  Ta20  1  0.289999  0.848428  0.308625  1
  Ta  Ta21  1  0.585672  0.321164  0.289255  1
  Ta  Ta22  1  0.085672  0.321164  0.289255  1
  Ta  Ta23  1  0.722138  0.037645  0.310416  1
  Ta  Ta24  1  0.222138  0.037645  0.310416  1
  Ta  Ta25  1  0.719648  0.204784  0.283883  1
  Ta  Ta26  1  0.219648  0.204784  0.283883  1
  Ta  Ta27  1  0.577120  0.150674  0.314614  1
  Ta  Ta28  1  0.077120  0.150674  0.314614  1
  Ta  Ta29  1  0.490023  0.708675  0.288757  1
  Ta  Ta30  1  0.990023  0.708675  0.288757  1
  Ta  Ta31  1  0.822246  0.640513  0.306008  1
  Ta  Ta32  1  0.322246  0.640513  0.306008  1
  Ta  Ta33  1  0.883886  0.497754  0.323911  1
  Ta  Ta34  1  0.383886  0.497754  0.323911  1
  Ta  Ta35  1  0.425337  0.851311  0.276230  1
  Ta  Ta36  1  0.925337  0.851311  0.276230  1
  Ta  Ta37  1  0.662671  0.494061  0.313683  1
  Ta  Ta38  1  0.162671  0.494061  0.313683  1
  Ta  Ta39  1  0.650821  0.864491  0.279658  1
  Ta  Ta40  1  0.150821  0.864491  0.279658  1
  Ta  Ta41  1  0.871963  0.348837  0.284529  1
  Ta  Ta42  1  0.371963  0.348837  0.284529  1
  Ta  Ta43  1  0.436283  0.002723  0.309831  1
  Ta  Ta44  1  0.936283  0.002723  0.309831  1
  Ta  Ta45  1  0.991951  0.993535  0.364769  1
  Ta  Ta46  1  0.491951  0.993535  0.364769  1
  Ta  Ta47  1  0.741796  0.494331  0.364835  1
  Ta  Ta48  1  0.241796  0.494331  0.364835  1
  Ta  Ta49  1  0.832559  0.247309  0.338818  1
  Ta  Ta50  1  0.332559  0.247309  0.338818  1
  Ta  Ta51  1  0.650830  0.738786  0.390433  1
  Ta  Ta52  1  0.150830  0.738786  0.390433  1
  Ta  Ta53  1  0.667681  0.837637  0.340618  1
  Ta  Ta54  1  0.167681  0.837637  0.340618  1
  Ta  Ta55  1  0.815125  0.152356  0.389886  1
  Ta  Ta56  1  0.315125  0.152356  0.389886  1
  Ta  Ta57  1  0.911177  0.804433  0.334130  1
  Ta  Ta58  1  0.411177  0.804433  0.334130  1
  Ta  Ta59  1  0.572849  0.182455  0.396224  1
  Ta  Ta60  1  0.072849  0.182455  0.396224  1
  Ta  Ta61  1  0.606293  0.332663  0.357080  1
  Ta  Ta62  1  0.106293  0.332663  0.357080  1
  Ta  Ta63  1  0.877235  0.656557  0.372861  1
  Ta  Ta64  1  0.377235  0.656557  0.372861  1
  Ta  Ta65  1  0.673036  0.136455  0.354249  1
  Ta  Ta66  1  0.173036  0.136455  0.354249  1
  Ta  Ta67  1  0.810955  0.851904  0.376779  1
  Ta  Ta68  1  0.310955  0.851904  0.376779  1
  Ta  Ta69  1  0.817691  0.018681  0.350424  1
  Ta  Ta70  1  0.317691  0.018681  0.350424  1
  Ta  Ta71  1  0.666498  0.969404  0.380179  1
  Ta  Ta72  1  0.166498  0.969404  0.380179  1
  Ta  Ta73  1  0.573360  0.535444  0.354354  1
  Ta  Ta74  1  0.073360  0.535444  0.354354  1
  Ta  Ta75  1  0.910971  0.449490  0.375231  1
  Ta  Ta76  1  0.410971  0.449490  0.375231  1
  Ta  Ta77  1  0.971984  0.312340  0.390539  1
  Ta  Ta78  1  0.471984  0.312340  0.390539  1
  Ta  Ta79  1  0.511269  0.674393  0.340055  1
  Ta  Ta80  1  0.011269  0.674393  0.340055  1
  Ta  Ta81  1  0.749851  0.309484  0.381888  1
  Ta  Ta82  1  0.249851  0.309484  0.381888  1
  Ta  Ta83  1  0.736289  0.679139  0.347820  1
  Ta  Ta84  1  0.236289  0.679139  0.347820  1
  Ta  Ta85  1  0.959085  0.167589  0.351620  1
  Ta  Ta86  1  0.459085  0.167589  0.351620  1
  Ta  Ta87  1  0.524351  0.820779  0.377927  1
  Ta  Ta88  1  0.024351  0.820779  0.377927  1
  Ta  Ta89  1  0.080870  0.810983  0.431880  1
  Ta  Ta90  1  0.580870  0.810983  0.431880  1
  Ta  Ta91  1  0.830836  0.311034  0.431809  1
  Ta  Ta92  1  0.330836  0.311034  0.431809  1
  Ta  Ta93  1  0.921732  0.065049  0.406238  1
  Ta  Ta94  1  0.421732  0.065049  0.406238  1
  Ta  Ta95  1  0.739784  0.556620  0.457251  1
  Ta  Ta96  1  0.239784  0.556620  0.457251  1
  Ta  Ta97  1  0.758041  0.652869  0.406953  1
  Ta  Ta98  1  0.258041  0.652869  0.406953  1
  Ta  Ta99  1  0.903558  0.968900  0.456765  1
  Ta  Ta100  1  0.403558  0.968900  0.456765  1
  Ta  Ta101  1  0.999212  0.622266  0.400654  1
  Ta  Ta102  1  0.499212  0.622266  0.400654  1
  Ta  Ta103  1  0.662038  0.999384  0.463239  1
  Ta  Ta104  1  0.162038  0.999384  0.463239  1
  Ta  Ta105  1  0.695089  0.148311  0.423927  1
  Ta  Ta106  1  0.195089  0.148311  0.423927  1
  Ta  Ta107  1  0.966471  0.473670  0.439708  1
  Ta  Ta108  1  0.466471  0.473670  0.439708  1
  Ta  Ta109  1  0.761457  0.952808  0.420612  1
  Ta  Ta110  1  0.261457  0.952808  0.420612  1
  Ta  Ta111  1  0.900214  0.669051  0.443320  1
  Ta  Ta112  1  0.400214  0.669051  0.443320  1
  Ta  Ta113  1  0.906411  0.835954  0.417202  1
  Ta  Ta114  1  0.406411  0.835954  0.417202  1
  Ta  Ta115  1  0.755261  0.785577  0.446607  1
  Ta  Ta116  1  0.255261  0.785577  0.446607  1
  Ta  Ta117  1  0.661984  0.355316  0.421200  1
  Ta  Ta118  1  0.161984  0.355316  0.421200  1
  Ta  Ta119  1  0.999523  0.266681  0.442256  1
  Ta  Ta120  1  0.499523  0.266681  0.442256  1
  Ta  Ta121  1  0.060919  0.129821  0.457689  1
  Ta  Ta122  1  0.560919  0.129821  0.457689  1
  Ta  Ta123  1  0.600543  0.492354  0.406051  1
  Ta  Ta124  1  0.100543  0.492354  0.406051  1
  Ta  Ta125  1  0.838101  0.125752  0.448730  1
  Ta  Ta126  1  0.338101  0.125752  0.448730  1
  Ta  Ta127  1  0.823866  0.496403  0.414847  1
  Ta  Ta128  1  0.323866  0.496403  0.414847  1
  Ta  Ta129  1  0.048500  0.985410  0.419105  1
  Ta  Ta130  1  0.548500  0.985410  0.419105  1
  Ta  Ta131  1  0.612695  0.636857  0.444721  1
  Ta  Ta132  1  0.112695  0.636857  0.444721  1
  Ta  Ta133  1  0.169587  0.627938  0.498689  1
  Ta  Ta134  1  0.669587  0.627938  0.498689  1
  Ta  Ta135  1  0.919587  0.127938  0.498689  1
  Ta  Ta136  1  0.419587  0.127938  0.498689  1
  Ta  Ta137  1  0.010563  0.882109  0.473300  1
  Ta  Ta138  1  0.510563  0.882109  0.473300  1
  Ta  Ta139  1  0.828612  0.373767  0.524078  1
  Ta  Ta140  1  0.328612  0.373767  0.524078  1
  Ta  Ta141  1  0.846967  0.470084  0.473734  1
  Ta  Ta142  1  0.346967  0.470084  0.473734  1
  Ta  Ta143  1  0.992207  0.785792  0.523644  1
  Ta  Ta144  1  0.492207  0.785792  0.523644  1
  Ta  Ta145  1  0.088225  0.439524  0.467298  1
  Ta  Ta146  1  0.588225  0.439524  0.467298  1
  Ta  Ta147  1  0.750949  0.816352  0.530081  1
  Ta  Ta148  1  0.250949  0.816352  0.530081  1
  Ta  Ta149  1  0.783866  0.964993  0.490789  1
  Ta  Ta150  1  0.283866  0.964993  0.490789  1
  Ta  Ta151  1  0.055308  0.290883  0.506589  1
  Ta  Ta152  1  0.555308  0.290883  0.506589  1
  Ta  Ta153  1  0.850097  0.769767  0.487301  1
  Ta  Ta154  1  0.350097  0.769767  0.487301  1
  Ta  Ta155  1  0.989077  0.486109  0.510077  1
  Ta  Ta156  1  0.489077  0.486109  0.510077  1
  Ta  Ta157  1  0.995128  0.653136  0.484010  1
  Ta  Ta158  1  0.495128  0.653136  0.484010  1
  Ta  Ta159  1  0.844046  0.602740  0.513368  1
  Ta  Ta160  1  0.344046  0.602740  0.513368  1
  Ta  Ta161  1  0.750805  0.172402  0.488123  1
  Ta  Ta162  1  0.250805  0.172402  0.488123  1
  Ta  Ta163  1  0.088369  0.083474  0.509255  1
  Ta  Ta164  1  0.588369  0.083474  0.509255  1
  Ta  Ta165  1  0.149707  0.946455  0.524583  1
  Ta  Ta166  1  0.649707  0.946455  0.524583  1
  Ta  Ta167  1  0.689467  0.309421  0.472795  1
  Ta  Ta168  1  0.189467  0.309421  0.472795  1
  Ta  Ta169  1  0.926698  0.942628  0.515616  1
  Ta  Ta170  1  0.426698  0.942628  0.515616  1
  Ta  Ta171  1  0.912477  0.313248  0.481762  1
  Ta  Ta172  1  0.412477  0.313248  0.481762  1
  Ta  Ta173  1  0.137628  0.802055  0.485906  1
  Ta  Ta174  1  0.637628  0.802055  0.485906  1
  Ta  Ta175  1  0.701547  0.453821  0.511472  1
  Ta  Ta176  1  0.201547  0.453821  0.511472  1
  Ta  Ta177  1  0.258304  0.444893  0.565498  1
  Ta  Ta178  1  0.758304  0.444893  0.565498  1
  Ta  Ta179  1  0.008338  0.944842  0.565569  1
  Ta  Ta180  1  0.508338  0.944842  0.565569  1
  Ta  Ta181  1  0.099390  0.699256  0.540127  1
  Ta  Ta182  1  0.599390  0.699256  0.540127  1
  Ta  Ta183  1  0.917443  0.190827  0.591140  1
  Ta  Ta184  1  0.417443  0.190827  0.591140  1
  Ta  Ta185  1  0.935617  0.286976  0.540613  1
  Ta  Ta186  1  0.435617  0.286976  0.540613  1
  Ta  Ta187  1  0.081134  0.603007  0.590425  1
  Ta  Ta188  1  0.581134  0.603007  0.590425  1
  Ta  Ta189  1  0.177136  0.256491  0.534139  1
  Ta  Ta190  1  0.677136  0.256491  0.534139  1
  Ta  Ta191  1  0.839962  0.633610  0.596724  1
  Ta  Ta192  1  0.339962  0.633610  0.596724  1
  Ta  Ta193  1  0.872704  0.782206  0.557670  1
  Ta  Ta194  1  0.372704  0.782206  0.557670  1
  Ta  Ta195  1  0.144085  0.107565  0.573451  1
  Ta  Ta196  1  0.644085  0.107565  0.573451  1
  Ta  Ta197  1  0.938961  0.586825  0.554058  1
  Ta  Ta198  1  0.438961  0.586825  0.554058  1
  Ta  Ta199  1  0.077717  0.303068  0.576767  1
  Ta  Ta200  1  0.577717  0.303068  0.576767  1
  Ta  Ta201  1  0.083914  0.470299  0.550771  1
  Ta  Ta202  1  0.583914  0.470299  0.550771  1
  Ta  Ta203  1  0.932763  0.419921  0.580177  1
  Ta  Ta204  1  0.432763  0.419921  0.580177  1
  Ta  Ta205  1  0.839651  0.989195  0.555122  1
  Ta  Ta206  1  0.339651  0.989195  0.555122  1
  Ta  Ta207  1  0.177190  0.900560  0.576179  1
  Ta  Ta208  1  0.677190  0.900560  0.576179  1
  Ta  Ta209  1  0.238631  0.763522  0.591328  1
  Ta  Ta210  1  0.738631  0.763522  0.591328  1
  Ta  Ta211  1  0.778255  0.126055  0.539689  1
  Ta  Ta212  1  0.278255  0.126055  0.539689  1
  Ta  Ta213  1  0.015309  0.759473  0.582531  1
  Ta  Ta214  1  0.515309  0.759473  0.582531  1
  Ta  Ta215  1  1.001073  0.130124  0.548649  1
  Ta  Ta216  1  0.501073  0.130124  0.548649  1
  Ta  Ta217  1  0.226479  0.619019  0.552657  1
  Ta  Ta218  1  0.726479  0.619019  0.552657  1
  Ta  Ta219  1  0.790674  0.270466  0.578273  1
  Ta  Ta220  1  0.290674  0.270466  0.578273  1
  Ta  Ta221  1  0.347223  0.262340  0.632609  1
  Ta  Ta222  1  0.847223  0.262340  0.632609  1
  Ta  Ta223  1  0.097378  0.761545  0.632543  1
  Ta  Ta224  1  0.597378  0.761545  0.632543  1
  Ta  Ta225  1  0.188345  0.517089  0.606945  1
  Ta  Ta226  1  0.688345  0.517089  0.606945  1
  Ta  Ta227  1  0.006616  0.008566  0.658560  1
  Ta  Ta228  1  0.506616  0.008566  0.658560  1
  Ta  Ta229  1  0.024050  0.103520  0.607492  1
  Ta  Ta230  1  0.524050  0.103520  0.607492  1
  Ta  Ta231  1  0.171493  0.418239  0.656760  1
  Ta  Ta232  1  0.671493  0.418239  0.656760  1
  Ta  Ta233  1  0.266325  0.073421  0.601155  1
  Ta  Ta234  1  0.766325  0.073421  0.601155  1
  Ta  Ta235  1  0.927997  0.451443  0.663248  1
  Ta  Ta236  1  0.427997  0.451443  0.663248  1
  Ta  Ta237  1  0.961939  0.599319  0.624517  1
  Ta  Ta238  1  0.461939  0.599319  0.624517  1
  Ta  Ta239  1  0.232882  0.923213  0.640299  1
  Ta  Ta240  1  0.732882  0.923213  0.640299  1
  Ta  Ta241  1  0.028219  0.403972  0.620599  1
  Ta  Ta242  1  0.528219  0.403972  0.620599  1
  Ta  Ta243  1  0.166138  0.119421  0.643129  1
  Ta  Ta244  1  0.666138  0.119421  0.643129  1
  Ta  Ta245  1  0.172676  0.286472  0.617199  1
  Ta  Ta246  1  0.672676  0.286472  0.617199  1
  Ta  Ta247  1  0.021483  0.237195  0.646954  1
  Ta  Ta248  1  0.521483  0.237195  0.646954  1
  Ta  Ta249  1  0.928203  0.806385  0.622148  1
  Ta  Ta250  1  0.428203  0.806385  0.622148  1
  Ta  Ta251  1  0.265814  0.720432  0.643024  1
  Ta  Ta252  1  0.765814  0.720432  0.643024  1
  Ta  Ta253  1  0.327905  0.581483  0.657323  1
  Ta  Ta254  1  0.827905  0.581483  0.657323  1
  Ta  Ta255  1  0.867190  0.943536  0.606840  1
  Ta  Ta256  1  0.367190  0.943536  0.606840  1
  Ta  Ta257  1  0.102885  0.576737  0.649558  1
  Ta  Ta258  1  0.602885  0.576737  0.649558  1
  Ta  Ta259  1  0.089324  0.946392  0.615490  1
  Ta  Ta260  1  0.589324  0.946392  0.615490  1
  Ta  Ta261  1  0.314824  0.435097  0.619451  1
  Ta  Ta262  1  0.814824  0.435097  0.619451  1
  Ta  Ta263  1  0.880089  0.088287  0.645758  1
  Ta  Ta264  1  0.380089  0.088287  0.645758  1
  Ta  Ta265  1  0.440509  0.086610  0.700312  1
  Ta  Ta266  1  0.940509  0.086610  0.700312  1
  Ta  Ta267  1  0.193286  0.576499  0.695952  1
  Ta  Ta268  1  0.693286  0.576499  0.695952  1
  Ta  Ta269  1  0.276182  0.334508  0.674787  1
  Ta  Ta270  1  0.776182  0.334508  0.674787  1
  Ta  Ta271  1  0.078733  0.816278  0.720572  1
  Ta  Ta272  1  0.578733  0.816278  0.720572  1
  Ta  Ta273  1  0.112312  0.919410  0.674218  1
  Ta  Ta274  1  0.612312  0.919410  0.674218  1
  Ta  Ta275  1  0.259690  0.243926  0.723660  1
  Ta  Ta276  1  0.759690  0.243926  0.723660  1
  Ta  Ta277  1  0.356106  0.892865  0.668890  1
  Ta  Ta278  1  0.856106  0.892865  0.668890  1
  Ta  Ta279  1  0.022614  0.271785  0.727902  1
  Ta  Ta280  1  0.522614  0.271785  0.727902  1
  Ta  Ta281  1  0.049175  0.407448  0.688753  1
  Ta  Ta282  1  0.549175  0.407448  0.688753  1
  Ta  Ta283  1  0.319869  0.740830  0.705655  1
  Ta  Ta284  1  0.819869  0.740830  0.705655  1
  Ta  Ta285  1  0.117036  0.218231  0.686962  1
  Ta  Ta286  1  0.617036  0.218231  0.686962  1
  Ta  Ta287  1  0.253502  0.934712  0.708124  1
  Ta  Ta288  1  0.753502  0.934712  0.708124  1
  Ta  Ta289  1  0.262054  0.105202  0.682764  1
  Ta  Ta290  1  0.762054  0.105202  0.682764  1
  Ta  Ta291  1  0.119526  0.051092  0.713495  1
  Ta  Ta292  1  0.619526  0.051092  0.713495  1
  Ta  Ta293  1  0.016928  0.615363  0.691370  1
  Ta  Ta294  1  0.516928  0.615363  0.691370  1
  Ta  Ta295  1  0.349151  0.547201  0.708621  1
  Ta  Ta296  1  0.849151  0.547201  0.708621  1
  Ta  Ta297  1  0.413838  0.404565  0.721148  1
  Ta  Ta298  1  0.913838  0.404565  0.721148  1
  Ta  Ta299  1  0.955288  0.758122  0.673467  1
  Ta  Ta300  1  0.455288  0.758122  0.673467  1
  Ta  Ta301  1  0.188353  0.391385  0.717720  1
  Ta  Ta302  1  0.688353  0.391385  0.717720  1
  Ta  Ta303  1  0.176503  0.761815  0.683695  1
  Ta  Ta304  1  0.676503  0.761815  0.683695  1
  Ta  Ta305  1  0.402892  0.253153  0.687547  1
  Ta  Ta306  1  0.902892  0.253153  0.687547  1
  Ta  Ta307  1  0.967211  0.907039  0.712850  1
  Ta  Ta308  1  0.467211  0.907039  0.712850  1
