# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.81301464
_cell_length_b   31.74390717
_cell_length_c   55.25133921
_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   8441.51452622
_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  0.501566  0.286607  0.381882  1
  Ta  Ta2  1  0.501566  0.874335  0.332679  1
  Ta  Ta3  1  0.501566  0.447657  0.289941  1
  Ta  Ta4  1  0.001566  0.081127  0.358553  1
  Ta  Ta5  1  0.001566  0.666559  0.314913  1
  Ta  Ta6  1  0.001566  0.490591  0.405878  1
  Ta  Ta7  1  0.501566  0.071270  0.292307  1
  Ta  Ta8  1  0.501566  0.873366  0.384406  1
  Ta  Ta9  1  0.501566  0.462185  0.336845  1
  Ta  Ta10  1  0.501566  0.107821  0.428145  1
  Ta  Ta11  1  0.501566  0.696653  0.378275  1
  Ta  Ta12  1  0.501566  0.284628  0.330028  1
  Ta  Ta13  1  0.001566  0.129421  0.406095  1
  Ta  Ta14  1  0.001566  0.717800  0.357430  1
  Ta  Ta15  1  0.001566  0.309597  0.307505  1
  Ta  Ta16  1  0.001566  0.034016  0.309826  1
  Ta  Ta17  1  0.001566  0.851513  0.407005  1
  Ta  Ta18  1  0.001566  0.440697  0.359524  1
  Ta  Ta19  1  0.501566  0.208894  0.352403  1
  Ta  Ta20  1  0.501566  0.799107  0.303754  1
  Ta  Ta21  1  0.501566  0.617986  0.397973  1
  Ta  Ta22  1  0.501566  0.951821  0.360906  1
  Ta  Ta23  1  0.501566  0.539198  0.315995  1
  Ta  Ta24  1  0.501566  0.362739  0.414622  1
  Ta  Ta25  1  0.001566  0.995414  0.356595  1
  Ta  Ta26  1  0.001566  0.584170  0.310491  1
  Ta  Ta27  1  0.001566  0.402908  0.403751  1
  Ta  Ta28  1  0.001566  0.168101  0.362332  1
  Ta  Ta29  1  0.001566  0.761215  0.316073  1
  Ta  Ta30  1  0.001566  0.577877  0.408376  1
  Ta  Ta31  1  0.501566  0.977823  0.311020  1
  Ta  Ta32  1  0.501566  0.791493  0.408025  1
  Ta  Ta33  1  0.501566  0.380591  0.362283  1
  Ta  Ta34  1  0.501566  0.189570  0.404820  1
  Ta  Ta35  1  0.501566  0.778228  0.355937  1
  Ta  Ta36  1  0.501566  0.365017  0.312709  1
  Ta  Ta37  1  0.001566  0.226883  0.409957  1
  Ta  Ta38  1  0.001566  0.815278  0.361463  1
  Ta  Ta39  1  0.001566  0.404925  0.315229  1
  Ta  Ta40  1  0.001566  0.937788  0.316168  1
  Ta  Ta41  1  0.001566  0.754523  0.402278  1
  Ta  Ta42  1  0.001566  0.343378  0.353544  1
  Ta  Ta43  1  0.501566  0.025778  0.389654  1
  Ta  Ta44  1  0.501566  0.616667  0.341159  1
  Ta  Ta45  1  0.501566  0.197412  0.297369  1
  Ta  Ta46  1  0.501566  0.133629  0.329493  1
  Ta  Ta47  1  0.501566  0.952469  0.421595  1
  Ta  Ta48  1  0.501566  0.542468  0.373651  1
  Ta  Ta49  1  0.001566  0.126504  0.306170  1
  Ta  Ta50  1  0.001566  0.946482  0.400205  1
  Ta  Ta51  1  0.001566  0.533231  0.351779  1
  Ta  Ta52  1  0.001566  0.035979  0.411723  1
  Ta  Ta53  1  0.001566  0.623391  0.364131  1
  Ta  Ta54  1  0.001566  0.214820  0.317785  1
  Ta  Ta55  1  0.501566  0.044405  0.341076  1
  Ta  Ta56  1  0.501566  0.628217  0.293684  1
  Ta  Ta57  1  0.501566  0.453485  0.389080  1
  Ta  Ta58  1  0.501566  0.116431  0.377287  1
  Ta  Ta59  1  0.501566  0.708487  0.323996  1
  Ta  Ta60  1  0.501566  0.528495  0.422657  1
  Ta  Ta61  1  0.001566  0.312481  0.404891  1
  Ta  Ta62  1  0.001566  0.899546  0.359054  1
  Ta  Ta63  1  0.001566  0.489825  0.306929  1
  Ta  Ta64  1  0.001566  0.848768  0.310171  1
  Ta  Ta65  1  0.001566  0.669013  0.406731  1
  Ta  Ta66  1  0.001566  0.259317  0.359649  1
  Ta  Ta67  1  0.501566  0.517255  0.524957  1
  Ta  Ta68  1  0.501566  0.105613  0.478201  1
  Ta  Ta69  1  0.501566  0.695895  0.429333  1
  Ta  Ta70  1  0.001566  0.311306  0.501718  1
  Ta  Ta71  1  0.001566  0.900887  0.453617  1
  Ta  Ta72  1  0.001566  0.721913  0.549295  1
  Ta  Ta73  1  0.501566  0.283049  0.432616  1
  Ta  Ta74  1  0.501566  0.103832  0.528477  1
  Ta  Ta75  1  0.501566  0.693679  0.480027  1
  Ta  Ta76  1  0.501566  0.339599  0.570730  1
  Ta  Ta77  1  0.501566  0.929086  0.522887  1
  Ta  Ta78  1  0.501566  0.518913  0.474690  1
  Ta  Ta79  1  0.001566  0.360596  0.548253  1
  Ta  Ta80  1  0.001566  0.950026  0.500508  1
  Ta  Ta81  1  0.001566  0.539896  0.452567  1
  Ta  Ta82  1  0.001566  0.262070  0.455117  1
  Ta  Ta83  1  0.001566  0.082883  0.550523  1
  Ta  Ta84  1  0.001566  0.672755  0.502430  1
  Ta  Ta85  1  0.501566  0.439478  0.493569  1
  Ta  Ta86  1  0.501566  0.028065  0.445930  1
  Ta  Ta87  1  0.501566  0.849622  0.541453  1
  Ta  Ta88  1  0.501566  0.183294  0.509852  1
  Ta  Ta89  1  0.501566  0.773109  0.461425  1
  Ta  Ta90  1  0.501566  0.594832  0.557111  1
  Ta  Ta91  1  0.001566  0.223686  0.499329  1
  Ta  Ta92  1  0.001566  0.813309  0.451113  1
  Ta  Ta93  1  0.001566  0.634534  0.546672  1
  Ta  Ta94  1  0.001566  0.399001  0.504065  1
  Ta  Ta95  1  0.001566  0.988297  0.456300  1
  Ta  Ta96  1  0.001566  0.809450  0.551775  1
  Ta  Ta97  1  0.501566  0.201964  0.456717  1
  Ta  Ta98  1  0.501566  0.022650  0.551765  1
  Ta  Ta99  1  0.501566  0.612719  0.503721  1
  Ta  Ta100  1  0.501566  0.420763  0.546598  1
  Ta  Ta101  1  0.501566  0.010081  0.499280  1
  Ta  Ta102  1  0.501566  0.600117  0.451258  1
  Ta  Ta103  1  0.001566  0.457780  0.552175  1
  Ta  Ta104  1  0.001566  0.046907  0.505407  1
  Ta  Ta105  1  0.001566  0.637046  0.457075  1
  Ta  Ta106  1  0.001566  0.165041  0.451011  1
  Ta  Ta107  1  0.001566  0.985707  0.545876  1
  Ta  Ta108  1  0.001566  0.575891  0.497652  1
  Ta  Ta109  1  0.501566  0.259132  0.533393  1
  Ta  Ta110  1  0.501566  0.848898  0.485369  1
  Ta  Ta111  1  0.501566  0.438886  0.437763  1
  Ta  Ta112  1  0.501566  0.363515  0.470101  1
  Ta  Ta113  1  0.501566  0.183852  0.565874  1
  Ta  Ta114  1  0.501566  0.773852  0.517512  1
  Ta  Ta115  1  0.001566  0.355785  0.448533  1
  Ta  Ta116  1  0.001566  0.176761  0.544155  1
  Ta  Ta117  1  0.001566  0.766391  0.495848  1
  Ta  Ta118  1  0.001566  0.266745  0.554979  1
  Ta  Ta119  1  0.001566  0.856362  0.507030  1
  Ta  Ta120  1  0.001566  0.445953  0.459269  1
  Ta  Ta121  1  0.501566  0.273915  0.484711  1
  Ta  Ta122  1  0.501566  0.863244  0.436564  1
  Ta  Ta123  1  0.501566  0.684435  0.532299  1
  Ta  Ta124  1  0.501566  0.348693  0.518710  1
  Ta  Ta125  1  0.501566  0.938361  0.470636  1
  Ta  Ta126  1  0.501566  0.759567  0.566332  1
  Ta  Ta127  1  0.001566  0.543793  0.547730  1
  Ta  Ta128  1  0.001566  0.132627  0.500942  1
  Ta  Ta129  1  0.001566  0.722464  0.452398  1
  Ta  Ta130  1  0.001566  0.079065  0.455396  1
  Ta  Ta131  1  0.001566  0.900260  0.550472  1
  Ta  Ta132  1  0.001566  0.490200  0.502286  1
  Ta  Ta133  1  0.501566  0.748503  0.670284  1
  Ta  Ta134  1  0.501566  0.336474  0.621389  1
  Ta  Ta135  1  0.501566  0.926781  0.573560  1
  Ta  Ta136  1  0.001566  0.541987  0.644549  1
  Ta  Ta137  1  0.001566  0.132131  0.597318  1
  Ta  Ta138  1  0.001566  0.956038  0.687946  1
  Ta  Ta139  1  0.501566  0.515106  0.574984  1
  Ta  Ta140  1  0.501566  0.339114  0.673207  1
  Ta  Ta141  1  0.501566  0.925838  0.624602  1
  Ta  Ta142  1  0.501566  0.552053  0.710856  1
  Ta  Ta143  1  0.501566  0.161901  0.668665  1
  Ta  Ta144  1  0.501566  0.749406  0.618517  1
  Ta  Ta145  1  0.001566  0.589186  0.693254  1
  Ta  Ta146  1  0.001566  0.181006  0.643997  1
  Ta  Ta147  1  0.001566  0.771245  0.595900  1
  Ta  Ta148  1  0.001566  0.493576  0.597027  1
  Ta  Ta149  1  0.001566  0.314104  0.695742  1
  Ta  Ta150  1  0.001566  0.904735  0.645497  1
  Ta  Ta151  1  0.501566  0.671086  0.642133  1
  Ta  Ta152  1  0.501566  0.259931  0.588976  1
  Ta  Ta153  1  0.501566  0.081972  0.685353  1
  Ta  Ta154  1  0.501566  0.414534  0.650723  1
  Ta  Ta155  1  0.501566  0.004614  0.604945  1
  Ta  Ta156  1  0.501566  0.823553  0.699329  1
  Ta  Ta157  1  0.001566  0.455140  0.640837  1
  Ta  Ta158  1  0.001566  0.044788  0.594598  1
  Ta  Ta159  1  0.001566  0.861399  0.686883  1
  Ta  Ta160  1  0.001566  0.627572  0.646374  1
  Ta  Ta161  1  0.001566  0.219655  0.599889  1
  Ta  Ta162  1  0.001566  0.038476  0.692744  1
  Ta  Ta163  1  0.501566  0.433435  0.598376  1
  Ta  Ta164  1  0.501566  0.259459  0.690655  1
  Ta  Ta165  1  0.501566  0.844371  0.646994  1
  Ta  Ta166  1  0.501566  0.645382  0.692136  1
  Ta  Ta167  1  0.501566  0.241579  0.641347  1
  Ta  Ta168  1  0.501566  0.831230  0.594869  1
  Ta  Ta169  1  0.001566  0.685167  0.686799  1
  Ta  Ta170  1  0.001566  0.279970  0.649483  1
  Ta  Ta171  1  0.001566  0.868149  0.600605  1
  Ta  Ta172  1  0.001566  0.396069  0.593294  1
  Ta  Ta173  1  0.001566  0.219225  0.687132  1
  Ta  Ta174  1  0.001566  0.807471  0.641451  1
  Ta  Ta175  1  0.501566  0.489723  0.673669  1
  Ta  Ta176  1  0.501566  0.080233  0.629398  1
  Ta  Ta177  1  0.501566  0.670441  0.581366  1
  Ta  Ta178  1  0.501566  0.597240  0.613383  1
  Ta  Ta179  1  0.501566  0.426053  0.705840  1
  Ta  Ta180  1  0.501566  0.004935  0.661515  1
  Ta  Ta181  1  0.001566  0.586951  0.591318  1
  Ta  Ta182  1  0.001566  0.408681  0.685389  1
  Ta  Ta183  1  0.001566  0.999001  0.638711  1
  Ta  Ta184  1  0.001566  0.496889  0.697034  1
  Ta  Ta185  1  0.001566  0.089018  0.651049  1
  Ta  Ta186  1  0.001566  0.676355  0.602753  1
  Ta  Ta187  1  0.501566  0.506718  0.625835  1
  Ta  Ta188  1  0.501566  0.094395  0.580479  1
  Ta  Ta189  1  0.501566  0.913794  0.678995  1
  Ta  Ta190  1  0.501566  0.578815  0.662023  1
  Ta  Ta191  1  0.501566  0.168792  0.614898  1
  Ta  Ta192  1  0.501566  0.994186  0.709152  1
  Ta  Ta193  1  0.001566  0.774018  0.692818  1
  Ta  Ta194  1  0.001566  0.364018  0.643542  1
  Ta  Ta195  1  0.001566  0.953609  0.596135  1
  Ta  Ta196  1  0.001566  0.310403  0.598376  1
  Ta  Ta197  1  0.001566  0.131842  0.694374  1
  Ta  Ta198  1  0.001566  0.723303  0.643891  1
