# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.33212959
_cell_length_b   14.23582272
_cell_length_c   50.18457580
_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   Ta90
_cell_volume   3809.37322273
_cell_formula_units_Z   90
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  0.002258  0.950265  0.300356  1
  Ta  Ta2  1  0.502258  0.460533  0.298373  1
  Ta  Ta3  1  0.002258  0.287790  0.413804  1
  Ta  Ta4  1  0.502258  0.054673  0.394719  1
  Ta  Ta5  1  0.502258  0.359330  0.347036  1
  Ta  Ta6  1  0.002258  0.119396  0.325304  1
  Ta  Ta7  1  0.502258  0.856451  0.395788  1
  Ta  Ta8  1  0.502258  0.552829  0.347134  1
  Ta  Ta9  1  0.002258  0.620266  0.414901  1
  Ta  Ta10  1  0.002258  0.793155  0.327726  1
  Ta  Ta11  1  0.002258  0.119234  0.382865  1
  Ta  Ta12  1  0.502258  0.155421  0.344603  1
  Ta  Ta13  1  0.502258  0.251059  0.394069  1
  Ta  Ta14  1  0.002258  0.288439  0.356745  1
  Ta  Ta15  1  0.502258  0.751706  0.348354  1
  Ta  Ta16  1  0.502258  0.656499  0.396061  1
  Ta  Ta17  1  0.002258  0.789898  0.385037  1
  Ta  Ta18  1  0.002258  0.621237  0.358182  1
  Ta  Ta19  1  0.502258  0.857158  0.304539  1
  Ta  Ta20  1  0.002258  0.956148  0.413696  1
  Ta  Ta21  1  0.002258  0.457638  0.327880  1
  Ta  Ta22  1  0.502258  0.555377  0.443328  1
  Ta  Ta23  1  0.254048  0.642272  0.304211  1
  Ta  Ta24  1  0.250929  0.954971  0.351482  1
  Ta  Ta25  1  0.252090  0.454635  0.390643  1
  Ta  Ta26  1  0.250654  0.282727  0.303923  1
  Ta  Ta27  1  0.753587  0.954971  0.351482  1
  Ta  Ta28  1  0.753862  0.282727  0.303923  1
  Ta  Ta29  1  0.750468  0.642272  0.304211  1
  Ta  Ta30  1  0.752426  0.454635  0.390643  1
  Ta  Ta31  1  0.002258  0.453546  0.442881  1
  Ta  Ta32  1  0.502258  0.955656  0.442810  1
  Ta  Ta33  1  0.002258  0.792652  0.558886  1
  Ta  Ta34  1  0.502258  0.555133  0.538371  1
  Ta  Ta35  1  0.502258  0.856561  0.490500  1
  Ta  Ta36  1  0.002258  0.620038  0.471695  1
  Ta  Ta37  1  0.502258  0.353803  0.538413  1
  Ta  Ta38  1  0.502258  0.053765  0.490352  1
  Ta  Ta39  1  0.002258  0.116976  0.558798  1
  Ta  Ta40  1  0.002258  0.287723  0.471195  1
  Ta  Ta41  1  0.002258  0.622660  0.528392  1
  Ta  Ta42  1  0.502258  0.658493  0.490692  1
  Ta  Ta43  1  0.502258  0.755117  0.539293  1
  Ta  Ta44  1  0.002258  0.790523  0.501571  1
  Ta  Ta45  1  0.502258  0.251162  0.490423  1
  Ta  Ta46  1  0.502258  0.154319  0.539162  1
  Ta  Ta47  1  0.002258  0.286587  0.528168  1
  Ta  Ta48  1  0.002258  0.118939  0.501368  1
  Ta  Ta49  1  0.502258  0.351586  0.442449  1
  Ta  Ta50  1  0.002258  0.454488  0.556049  1
  Ta  Ta51  1  0.002258  0.954870  0.472046  1
  Ta  Ta52  1  0.502258  0.056154  0.588372  1
  Ta  Ta53  1  0.251784  0.137131  0.442399  1
  Ta  Ta54  1  0.252700  0.453958  0.495090  1
  Ta  Ta55  1  0.253046  0.954878  0.534838  1
  Ta  Ta56  1  0.251839  0.772449  0.443198  1
  Ta  Ta57  1  0.751816  0.453958  0.495090  1
  Ta  Ta58  1  0.752677  0.772449  0.443198  1
  Ta  Ta59  1  0.752732  0.137131  0.442399  1
  Ta  Ta60  1  0.751470  0.954878  0.534838  1
  Ta  Ta61  1  0.002258  0.954844  0.588692  1
  Ta  Ta62  1  0.502258  0.454681  0.584863  1
  Ta  Ta63  1  0.002258  0.339903  0.703609  1
  Ta  Ta64  1  0.502258  0.053464  0.685972  1
  Ta  Ta65  1  0.502258  0.347427  0.630241  1
  Ta  Ta66  1  0.002258  0.120559  0.617204  1
  Ta  Ta67  1  0.502258  0.856002  0.685962  1
  Ta  Ta68  1  0.502258  0.561971  0.630243  1
  Ta  Ta69  1  0.002258  0.569557  0.703603  1
  Ta  Ta70  1  0.002258  0.788992  0.617214  1
  Ta  Ta71  1  0.002258  0.134110  0.674960  1
  Ta  Ta72  1  0.502258  0.154667  0.637784  1
  Ta  Ta73  1  0.502258  0.271462  0.683924  1
  Ta  Ta74  1  0.002258  0.290909  0.645141  1
  Ta  Ta75  1  0.502258  0.754762  0.637781  1
  Ta  Ta76  1  0.502258  0.637989  0.683921  1
  Ta  Ta77  1  0.002258  0.775357  0.674956  1
  Ta  Ta78  1  0.002258  0.618551  0.645137  1
  Ta  Ta79  1  0.502258  0.853456  0.588403  1
  Ta  Ta80  1  0.002258  0.954731  0.693007  1
  Ta  Ta81  1  0.002258  0.454707  0.612153  1
  Ta  Ta82  1  0.502258  0.454734  0.714976  1
  Ta  Ta83  1  0.251278  0.641251  0.585841  1
  Ta  Ta84  1  0.253480  0.954763  0.641797  1
  Ta  Ta85  1  0.250535  0.454717  0.668257  1
  Ta  Ta86  1  0.251268  0.268115  0.585831  1
  Ta  Ta87  1  0.751036  0.954763  0.641797  1
  Ta  Ta88  1  0.753248  0.268115  0.585831  1
  Ta  Ta89  1  0.753238  0.641251  0.585841  1
  Ta  Ta90  1  0.753981  0.454717  0.668257  1
