# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.34134790
_cell_length_b   22.50795934
_cell_length_c   54.58546301
_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   Ta180
_cell_volume   6562.41946311
_cell_formula_units_Z   180
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  0.001391  0.102098  0.333309  1
  Ta  Ta2  1  0.001391  0.703462  0.251631  1
  Ta  Ta3  1  0.501391  0.802219  0.374803  1
  Ta  Ta4  1  0.501391  0.404334  0.288520  1
  Ta  Ta5  1  0.001391  0.982377  0.322106  1
  Ta  Ta6  1  0.001391  0.382323  0.405549  1
  Ta  Ta7  1  0.501391  0.828730  0.324945  1
  Ta  Ta8  1  0.501391  0.229439  0.408577  1
  Ta  Ta9  1  0.501391  0.976563  0.260249  1
  Ta  Ta10  1  0.501391  0.374248  0.339408  1
  Ta  Ta11  1  0.001391  0.821163  0.261842  1
  Ta  Ta12  1  0.001391  0.221485  0.343004  1
  Ta  Ta13  1  0.501391  0.709714  0.341908  1
  Ta  Ta14  1  0.501391  0.309023  0.258243  1
  Ta  Ta15  1  0.501391  0.894613  0.407995  1
  Ta  Ta16  1  0.501391  0.492925  0.324936  1
  Ta  Ta17  1  0.001391  0.581037  0.378100  1
  Ta  Ta18  1  0.001391  0.177546  0.293235  1
  Ta  Ta19  1  0.001391  0.022836  0.371918  1
  Ta  Ta20  1  0.001391  0.623986  0.287243  1
  Ta  Ta21  1  0.001391  0.861144  0.309467  1
  Ta  Ta22  1  0.001391  0.260396  0.393185  1
  Ta  Ta23  1  0.501391  0.855905  0.274199  1
  Ta  Ta24  1  0.501391  0.256142  0.357346  1
  Ta  Ta25  1  0.501391  0.947092  0.308217  1
  Ta  Ta26  1  0.501391  0.347903  0.391159  1
  Ta  Ta27  1  0.001391  0.945837  0.272488  1
  Ta  Ta28  1  0.001391  0.342768  0.355699  1
  Ta  Ta29  1  0.501391  0.013958  0.391683  1
  Ta  Ta30  1  0.501391  0.613079  0.309214  1
  Ta  Ta31  1  0.501391  0.589896  0.358733  1
  Ta  Ta32  1  0.501391  0.193136  0.274497  1
  Ta  Ta33  1  0.001391  0.662418  0.337931  1
  Ta  Ta34  1  0.001391  0.264487  0.259094  1
  Ta  Ta35  1  0.001391  0.941978  0.411803  1
  Ta  Ta36  1  0.001391  0.542798  0.328450  1
  Ta  Ta37  1  0.501391  0.041121  0.341901  1
  Ta  Ta38  1  0.501391  0.646415  0.262628  1
  Ta  Ta39  1  0.001391  0.782506  0.349343  1
  Ta  Ta40  1  0.001391  0.383870  0.269590  1
  Ta  Ta41  1  0.001391  0.821967  0.400223  1
  Ta  Ta42  1  0.001391  0.422788  0.317315  1
  Ta  Ta43  1  0.501391  0.562438  0.408419  1
  Ta  Ta44  1  0.501391  0.162865  0.323772  1
  Ta  Ta45  1  0.250983  0.911658  0.359607  1
  Ta  Ta46  1  0.250883  0.514927  0.279272  1
  Ta  Ta47  1  0.250192  0.738823  0.295410  1
  Ta  Ta48  1  0.251845  0.139296  0.378717  1
  Ta  Ta49  1  0.255548  0.064114  0.289139  1
  Ta  Ta50  1  0.251970  0.464581  0.370966  1
  Ta  Ta51  1  0.250950  0.692229  0.390175  1
  Ta  Ta52  1  0.251671  0.292121  0.305352  1
  Ta  Ta53  1  0.752591  0.738823  0.295410  1
  Ta  Ta54  1  0.750938  0.139296  0.378717  1
  Ta  Ta55  1  0.751833  0.692229  0.390175  1
  Ta  Ta56  1  0.751112  0.292121  0.305352  1
  Ta  Ta57  1  0.751799  0.911658  0.359607  1
  Ta  Ta58  1  0.751899  0.514927  0.279272  1
  Ta  Ta59  1  0.747234  0.064114  0.289139  1
  Ta  Ta60  1  0.750812  0.464581  0.370966  1
  Ta  Ta61  1  0.001391  0.902248  0.500170  1
  Ta  Ta62  1  0.001391  0.501744  0.416749  1
  Ta  Ta63  1  0.501391  0.602255  0.542223  1
  Ta  Ta64  1  0.501391  0.202293  0.458230  1
  Ta  Ta65  1  0.001391  0.782909  0.489269  1
  Ta  Ta66  1  0.001391  0.183526  0.572702  1
  Ta  Ta67  1  0.501391  0.629050  0.492579  1
  Ta  Ta68  1  0.501391  0.029408  0.575856  1
  Ta  Ta69  1  0.501391  0.775139  0.424428  1
  Ta  Ta70  1  0.501391  0.175551  0.507847  1
  Ta  Ta71  1  0.001391  0.621137  0.427767  1
  Ta  Ta72  1  0.001391  0.021617  0.511104  1
  Ta  Ta73  1  0.501391  0.509695  0.509090  1
  Ta  Ta74  1  0.501391  0.109875  0.425105  1
  Ta  Ta75  1  0.501391  0.694617  0.575348  1
  Ta  Ta76  1  0.501391  0.294891  0.491379  1
  Ta  Ta77  1  0.001391  0.381721  0.545130  1
  Ta  Ta78  1  0.001391  0.981298  0.461418  1
  Ta  Ta79  1  0.001391  0.823211  0.538952  1
  Ta  Ta80  1  0.001391  0.422785  0.455416  1
  Ta  Ta81  1  0.001391  0.660822  0.477381  1
  Ta  Ta82  1  0.001391  0.061339  0.560708  1
  Ta  Ta83  1  0.501391  0.656354  0.441573  1
  Ta  Ta84  1  0.501391  0.056728  0.524889  1
  Ta  Ta85  1  0.501391  0.747842  0.475454  1
  Ta  Ta86  1  0.501391  0.148228  0.558808  1
  Ta  Ta87  1  0.001391  0.743298  0.439641  1
  Ta  Ta88  1  0.001391  0.143781  0.523032  1
  Ta  Ta89  1  0.501391  0.813986  0.558684  1
  Ta  Ta90  1  0.501391  0.414235  0.475217  1
  Ta  Ta91  1  0.501391  0.390344  0.525285  1
  Ta  Ta92  1  0.501391  0.990397  0.441676  1
  Ta  Ta93  1  0.001391  0.462348  0.505153  1
  Ta  Ta94  1  0.001391  0.062323  0.421459  1
  Ta  Ta95  1  0.001391  0.742176  0.578961  1
  Ta  Ta96  1  0.001391  0.342208  0.495370  1
  Ta  Ta97  1  0.501391  0.841525  0.508747  1
  Ta  Ta98  1  0.501391  0.440835  0.425183  1
  Ta  Ta99  1  0.001391  0.582256  0.516814  1
  Ta  Ta100  1  0.001391  0.182380  0.432843  1
  Ta  Ta101  1  0.001391  0.622138  0.567625  1
  Ta  Ta102  1  0.001391  0.222334  0.483634  1
  Ta  Ta103  1  0.501391  0.363762  0.575324  1
  Ta  Ta104  1  0.501391  0.962972  0.491606  1
  Ta  Ta105  1  0.251016  0.712017  0.526877  1
  Ta  Ta106  1  0.251034  0.311900  0.442990  1
  Ta  Ta107  1  0.251778  0.538758  0.462678  1
  Ta  Ta108  1  0.251788  0.939176  0.545987  1
  Ta  Ta109  1  0.251790  0.865318  0.454326  1
  Ta  Ta110  1  0.251750  0.265845  0.537786  1
  Ta  Ta111  1  0.251025  0.492659  0.557505  1
  Ta  Ta112  1  0.251017  0.092508  0.473534  1
  Ta  Ta113  1  0.751005  0.538758  0.462678  1
  Ta  Ta114  1  0.750994  0.939176  0.545987  1
  Ta  Ta115  1  0.751758  0.492659  0.557505  1
  Ta  Ta116  1  0.751766  0.092508  0.473534  1
  Ta  Ta117  1  0.751766  0.712017  0.526877  1
  Ta  Ta118  1  0.751748  0.311900  0.442990  1
  Ta  Ta119  1  0.750992  0.865318  0.454326  1
  Ta  Ta120  1  0.751032  0.265845  0.537786  1
  Ta  Ta121  1  0.001391  0.702624  0.667207  1
  Ta  Ta122  1  0.001391  0.302705  0.583837  1
  Ta  Ta123  1  0.501391  0.399766  0.711939  1
  Ta  Ta124  1  0.501391  1.002131  0.625385  1
  Ta  Ta125  1  0.001391  0.583201  0.657509  1
  Ta  Ta126  1  0.001391  0.985595  0.736301  1
  Ta  Ta127  1  0.501391  0.430274  0.661073  1
  Ta  Ta128  1  0.501391  0.829388  0.739919  1
  Ta  Ta129  1  0.501391  0.575118  0.591905  1
  Ta  Ta130  1  0.501391  0.976623  0.675371  1
  Ta  Ta131  1  0.001391  0.422197  0.594974  1
  Ta  Ta132  1  0.001391  0.822359  0.678355  1
  Ta  Ta133  1  0.501391  0.311540  0.675405  1
  Ta  Ta134  1  0.501391  0.909798  0.592253  1
  Ta  Ta135  1  0.501391  0.495384  0.742096  1
  Ta  Ta136  1  0.501391  0.094860  0.658025  1
  Ta  Ta137  1  0.001391  0.176769  0.716220  1
  Ta  Ta138  1  0.001391  0.781712  0.628524  1
  Ta  Ta139  1  0.001391  0.627287  0.707288  1
  Ta  Ta140  1  0.001391  0.223375  0.622648  1
  Ta  Ta141  1  0.001391  0.461820  0.644803  1
  Ta  Ta142  1  0.001391  0.861078  0.727790  1
  Ta  Ta143  1  0.501391  0.456661  0.609350  1
  Ta  Ta144  1  0.501391  0.858316  0.692047  1
  Ta  Ta145  1  0.501391  0.548474  0.643154  1
  Ta  Ta146  1  0.501391  0.950464  0.725959  1
  Ta  Ta147  1  0.001391  0.544180  0.607316  1
  Ta  Ta148  1  0.001391  0.943937  0.690188  1
  Ta  Ta149  1  0.501391  0.611497  0.725939  1
  Ta  Ta150  1  0.501391  0.214846  0.641471  1
  Ta  Ta151  1  0.501391  0.190993  0.690513  1
  Ta  Ta152  1  0.501391  0.790558  0.608728  1
  Ta  Ta153  1  0.001391  0.260664  0.672723  1
  Ta  Ta154  1  0.001391  0.862471  0.588556  1
  Ta  Ta155  1  0.001391  0.539893  0.741271  1
  Ta  Ta156  1  0.001391  0.142061  0.663166  1
  Ta  Ta157  1  0.501391  0.641862  0.676721  1
  Ta  Ta158  1  0.501391  0.242200  0.591932  1
  Ta  Ta159  1  0.001391  0.381383  0.683057  1
  Ta  Ta160  1  0.001391  0.982535  0.600019  1
  Ta  Ta161  1  0.001391  0.420409  0.730736  1
  Ta  Ta162  1  0.001391  0.022644  0.650687  1
  Ta  Ta163  1  0.501391  0.168511  0.736638  1
  Ta  Ta164  1  0.501391  0.763657  0.658576  1
  Ta  Ta165  1  0.251656  0.512375  0.695086  1
  Ta  Ta166  1  0.250845  0.112471  0.610140  1
  Ta  Ta167  1  0.251830  0.339795  0.629554  1
  Ta  Ta168  1  0.255564  0.741023  0.711356  1
  Ta  Ta169  1  0.251845  0.665305  0.621770  1
  Ta  Ta170  1  0.251029  0.066899  0.704370  1
  Ta  Ta171  1  0.250283  0.288594  0.720977  1
  Ta  Ta172  1  0.251025  0.892937  0.640656  1
  Ta  Ta173  1  0.750952  0.339795  0.629554  1
  Ta  Ta174  1  0.747218  0.741023  0.711356  1
  Ta  Ta175  1  0.752499  0.288594  0.720977  1
  Ta  Ta176  1  0.751757  0.892937  0.640656  1
  Ta  Ta177  1  0.751126  0.512375  0.695086  1
  Ta  Ta178  1  0.751937  0.112471  0.610140  1
  Ta  Ta179  1  0.750937  0.665305  0.621770  1
  Ta  Ta180  1  0.751753  0.066899  0.704370  1
