# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.73385129
_cell_length_b   31.64984331
_cell_length_c   55.33641066
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta
_chemical_formula_sum   Ta198
_cell_volume   8290.8137783
_cell_formula_units_Z   198
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  1.002669  0.338314  0.377904  1
  Ta  Ta2  1  1.002669  0.919458  0.324590  1
  Ta  Ta3  1  1.002669  0.486061  0.288391  1
  Ta  Ta4  1  0.502669  0.123258  0.357094  1
  Ta  Ta5  1  0.502669  0.709539  0.310977  1
  Ta  Ta6  1  0.502669  0.539628  0.401459  1
  Ta  Ta7  1  1.002669  0.255072  0.358775  1
  Ta  Ta8  1  1.002669  0.829859  0.334249  1
  Ta  Ta9  1  1.002669  0.667502  0.395755  1
  Ta  Ta10  1  1.002669  0.991489  0.352999  1
  Ta  Ta11  1  1.002669  0.580082  0.310943  1
  Ta  Ta12  1  1.002669  0.418699  0.423712  1
  Ta  Ta13  1  0.502669  0.211448  0.365283  1
  Ta  Ta14  1  0.502669  0.797877  0.310998  1
  Ta  Ta15  1  0.502669  0.626398  0.405801  1
  Ta  Ta16  1  0.502669  0.036660  0.347875  1
  Ta  Ta17  1  0.502669  0.625279  0.310212  1
  Ta  Ta18  1  0.502669  0.453545  0.404478  1
  Ta  Ta19  1  1.002669  0.128772  0.290211  1
  Ta  Ta20  1  1.002669  0.915996  0.377402  1
  Ta  Ta21  1  1.002669  0.504446  0.334686  1
  Ta  Ta22  1  1.002669  0.176423  0.434241  1
  Ta  Ta23  1  1.002669  0.744869  0.377956  1
  Ta  Ta24  1  1.002669  0.321128  0.325133  1
  Ta  Ta25  1  0.502669  0.076314  0.302688  1
  Ta  Ta26  1  0.502669  0.888854  0.404472  1
  Ta  Ta27  1  0.502669  0.476845  0.354460  1
  Ta  Ta28  1  0.502669  0.169492  0.408117  1
  Ta  Ta29  1  0.502669  0.770051  0.357584  1
  Ta  Ta30  1  0.502669  0.353840  0.307457  1
  Ta  Ta31  1  1.002669  0.060815  0.379801  1
  Ta  Ta32  1  1.002669  0.655801  0.338830  1
  Ta  Ta33  1  1.002669  0.228202  0.297753  1
  Ta  Ta34  1  1.002669  0.179755  0.335778  1
  Ta  Ta35  1  1.002669  0.006866  0.419578  1
  Ta  Ta36  1  1.002669  0.592647  0.370141  1
  Ta  Ta37  1  0.502669  0.078576  0.402285  1
  Ta  Ta38  1  0.502669  0.676790  0.360833  1
  Ta  Ta39  1  0.502669  0.251249  0.318063  1
  Ta  Ta40  1  0.502669  0.163204  0.310525  1
  Ta  Ta41  1  0.502669  0.983850  0.396170  1
  Ta  Ta42  1  0.502669  0.571565  0.350882  1
  Ta  Ta43  1  1.002669  0.023388  0.305632  1
  Ta  Ta44  1  1.002669  0.834423  0.432865  1
  Ta  Ta45  1  1.002669  0.424756  0.374558  1
  Ta  Ta46  1  0.002669  0.246364  0.410731  1
  Ta  Ta47  1  1.002669  0.830123  0.384515  1
  Ta  Ta48  1  1.002669  0.411916  0.325546  1
  Ta  Ta49  1  0.502669  0.977425  0.308833  1
  Ta  Ta50  1  0.502669  0.799584  0.407015  1
  Ta  Ta51  1  0.502669  0.390230  0.352277  1
  Ta  Ta52  1  0.502669  0.278114  0.400477  1
  Ta  Ta53  1  0.502669  0.857693  0.356299  1
  Ta  Ta54  1  0.502669  0.445447  0.306374  1
  Ta  Ta55  1  1.002669  0.093203  0.333868  1
  Ta  Ta56  1  1.002669  0.669323  0.291643  1
  Ta  Ta57  1  1.002669  0.508261  0.384035  1
  Ta  Ta58  1  1.002669  0.152107  0.383311  1
  Ta  Ta59  1  1.002669  0.741282  0.328390  1
  Ta  Ta60  1  1.002669  0.582476  0.418858  1
  Ta  Ta61  1  0.502669  0.884292  0.308775  1
  Ta  Ta62  1  0.502669  0.712664  0.410301  1
  Ta  Ta63  1  0.502669  0.306530  0.354212  1
  Ta  Ta64  1  0.502669  0.366543  0.402263  1
  Ta  Ta65  1  0.502669  0.941796  0.352736  1
  Ta  Ta66  1  0.502669  0.531302  0.304539  1
  Ta  Ta67  1  1.002669  0.576672  0.522918  1
  Ta  Ta68  1  1.002669  0.155013  0.479308  1
  Ta  Ta69  1  1.002669  0.747259  0.430561  1
  Ta  Ta70  1  0.502669  0.362342  0.500852  1
  Ta  Ta71  1  0.502669  0.950016  0.448839  1
  Ta  Ta72  1  0.502669  0.795188  0.555066  1
  Ta  Ta73  1  1.002669  0.494570  0.488845  1
  Ta  Ta74  1  1.002669  0.094497  0.427683  1
  Ta  Ta75  1  1.002669  0.940004  0.524985  1
  Ta  Ta76  1  1.002669  0.213125  0.522862  1
  Ta  Ta77  1  1.002669  0.821175  0.481406  1
  Ta  Ta78  1  1.002669  0.670316  0.551639  1
  Ta  Ta79  1  0.502669  0.450068  0.504771  1
  Ta  Ta80  1  0.502669  0.036957  0.448363  1
  Ta  Ta81  1  0.502669  0.882077  0.552679  1
  Ta  Ta82  1  0.502669  0.273146  0.499273  1
  Ta  Ta83  1  0.502669  0.862858  0.455067  1
  Ta  Ta84  1  0.502669  0.712342  0.559077  1
  Ta  Ta85  1  1.002669  0.331278  0.428999  1
  Ta  Ta86  1  1.002669  0.120612  0.523543  1
  Ta  Ta87  1  1.002669  0.736691  0.480378  1
  Ta  Ta88  1  1.002669  0.441092  0.576448  1
  Ta  Ta89  1  1.002669  0.028800  0.521662  1
  Ta  Ta90  1  1.002669  0.573483  0.472324  1
  Ta  Ta91  1  0.502669  0.301365  0.449648  1
  Ta  Ta92  1  0.502669  0.150975  0.546333  1
  Ta  Ta93  1  0.502669  0.711904  0.510408  1
  Ta  Ta94  1  0.502669  0.421546  0.551847  1
  Ta  Ta95  1  0.502669  0.992457  0.497473  1
  Ta  Ta96  1  0.502669  0.575876  0.447905  1
  Ta  Ta97  1  1.002669  0.302593  0.524821  1
  Ta  Ta98  1  1.002669  0.905249  0.477144  1
  Ta  Ta99  1  1.002669  0.502781  0.435259  1
  Ta  Ta100  1  1.002669  0.416798  0.473126  1
  Ta  Ta101  1  1.002669  0.268091  0.572562  1
  Ta  Ta102  1  1.002669  0.851564  0.528336  1
  Ta  Ta103  1  0.502669  0.331584  0.548601  1
  Ta  Ta104  1  0.502669  0.897169  0.502603  1
  Ta  Ta105  1  0.502669  0.482407  0.456040  1
  Ta  Ta106  1  0.502669  0.390207  0.451679  1
  Ta  Ta107  1  0.502669  0.241228  0.547602  1
  Ta  Ta108  1  0.502669  0.803746  0.505997  1
  Ta  Ta109  1  1.002669  0.246809  0.471823  1
  Ta  Ta110  1  1.002669  0.090088  0.569084  1
  Ta  Ta111  1  1.002669  0.660137  0.502144  1
  Ta  Ta112  1  1.002669  0.491044  0.537277  1
  Ta  Ta113  1  1.002669  0.067472  0.474994  1
  Ta  Ta114  1  1.002669  0.653097  0.446575  1
  Ta  Ta115  1  0.502669  0.215993  0.450511  1
  Ta  Ta116  1  0.502669  0.058248  0.546144  1
  Ta  Ta117  1  0.502669  0.621505  0.489845  1
  Ta  Ta118  1  0.502669  0.519130  0.555227  1
  Ta  Ta119  1  0.502669  0.089479  0.499523  1
  Ta  Ta120  1  0.502669  0.687592  0.458904  1
  Ta  Ta121  1  1.002669  0.332813  0.478176  1
  Ta  Ta122  1  1.002669  0.920490  0.426346  1
  Ta  Ta123  1  1.002669  0.757125  0.530264  1
  Ta  Ta124  1  1.002669  0.397725  0.524536  1
  Ta  Ta125  1  1.002669  0.985824  0.470054  1
  Ta  Ta126  1  1.002669  0.823527  0.575388  1
  Ta  Ta127  1  0.502669  0.125370  0.453224  1
  Ta  Ta128  1  0.502669  0.968486  0.548663  1
  Ta  Ta129  1  0.502669  0.538054  0.504032  1
  Ta  Ta130  1  0.502669  0.620365  0.541043  1
  Ta  Ta131  1  0.502669  0.184332  0.499164  1
  Ta  Ta132  1  0.502669  0.774781  0.457523  1
  Ta  Ta133  1  1.002669  0.820237  0.675606  1
  Ta  Ta134  1  1.002669  0.410082  0.624618  1
  Ta  Ta135  1  1.002669  0.999355  0.570305  1
  Ta  Ta136  1  0.502669  0.621184  0.643717  1
  Ta  Ta137  1  0.502669  0.208851  0.595798  1
  Ta  Ta138  1  0.502669  0.035896  0.691305  1
  Ta  Ta139  1  1.002669  0.748403  0.645453  1
  Ta  Ta140  1  1.002669  0.355732  0.573465  1
  Ta  Ta141  1  1.002669  0.156650  0.670509  1
  Ta  Ta142  1  1.002669  0.490425  0.645477  1
  Ta  Ta143  1  1.002669  0.064845  0.615158  1
  Ta  Ta144  1  1.002669  0.900294  0.692484  1
  Ta  Ta145  1  0.502669  0.705667  0.650148  1
  Ta  Ta146  1  0.502669  0.296331  0.596998  1
  Ta  Ta147  1  0.502669  0.122113  0.691312  1
  Ta  Ta148  1  0.502669  0.534482  0.640148  1
  Ta  Ta149  1  0.502669  0.121135  0.594105  1
  Ta  Ta150  1  0.502669  0.943796  0.686322  1
  Ta  Ta151  1  1.002669  0.591396  0.570948  1
  Ta  Ta152  1  1.002669  0.425269  0.678469  1
  Ta  Ta153  1  1.002669  0.984362  0.619373  1
  Ta  Ta154  1  1.002669  0.618960  0.710909  1
  Ta  Ta155  1  1.002669  0.247314  0.671035  1
  Ta  Ta156  1  1.002669  0.827843  0.623624  1
  Ta  Ta157  1  0.502669  0.569955  0.594687  1
  Ta  Ta158  1  0.502669  0.389729  0.694156  1
  Ta  Ta159  1  0.502669  0.997036  0.644844  1
  Ta  Ta160  1  0.502669  0.668846  0.696871  1
  Ta  Ta161  1  0.502669  0.271264  0.645886  1
  Ta  Ta162  1  0.502669  0.857254  0.602878  1
  Ta  Ta163  1  1.002669  0.565218  0.668502  1
  Ta  Ta164  1  1.002669  0.148258  0.620023  1
  Ta  Ta165  1  1.002669  0.740070  0.583313  1
  Ta  Ta166  1  1.002669  0.677556  0.614721  1
  Ta  Ta167  1  1.002669  0.517216  0.706474  1
  Ta  Ta168  1  1.002669  0.066957  0.662600  1
  Ta  Ta169  1  0.502669  0.582311  0.692405  1
  Ta  Ta170  1  0.502669  0.183651  0.644722  1
  Ta  Ta171  1  0.502669  0.758986  0.605449  1
  Ta  Ta172  1  0.502669  0.656047  0.594127  1
  Ta  Ta173  1  0.502669  0.493232  0.686537  1
  Ta  Ta174  1  0.502669  0.095171  0.642816  1
  Ta  Ta175  1  1.002669  0.516461  0.597007  1
  Ta  Ta176  1  1.002669  0.336924  0.672681  1
  Ta  Ta177  1  1.002669  0.912663  0.640817  1
  Ta  Ta178  1  1.002669  0.719889  0.694106  1
  Ta  Ta179  1  1.002669  0.321004  0.622787  1
  Ta  Ta180  1  1.002669  0.910627  0.579804  1
  Ta  Ta181  1  0.502669  0.471247  0.602378  1
  Ta  Ta182  1  0.502669  0.300517  0.692446  1
  Ta  Ta183  1  0.502669  0.883788  0.652385  1
  Ta  Ta184  1  0.502669  0.762387  0.691238  1
  Ta  Ta185  1  0.502669  0.357132  0.648040  1
  Ta  Ta186  1  0.502669  0.943672  0.601662  1
  Ta  Ta187  1  1.002669  0.592063  0.621366  1
  Ta  Ta188  1  1.002669  0.179644  0.571107  1
  Ta  Ta189  1  1.002669  0.986491  0.677432  1
  Ta  Ta190  1  1.002669  0.651570  0.665305  1
  Ta  Ta191  1  1.002669  0.233774  0.621424  1
  Ta  Ta192  1  1.002669  0.078929  0.708773  1
  Ta  Ta193  1  0.502669  0.383258  0.598961  1
  Ta  Ta194  1  0.502669  0.211938  0.691097  1
  Ta  Ta195  1  0.502669  0.800047  0.648368  1
  Ta  Ta196  1  0.502669  0.851233  0.698650  1
  Ta  Ta197  1  0.502669  0.440366  0.648845  1
  Ta  Ta198  1  0.502669  0.031752  0.594813  1
