# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.88755704
_cell_length_b   10.51387511
_cell_length_c   52.22352540
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.06762976
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta
_chemical_formula_sum   Ta110
_cell_volume   4330.83073309
_cell_formula_units_Z   110
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  0.895521  0.277955  0.301809  1
  Ta  Ta2  1  0.395265  0.766332  0.345119  1
  Ta  Ta3  1  0.818162  0.577866  0.302830  1
  Ta  Ta4  1  0.985394  0.016322  0.298518  1
  Ta  Ta5  1  0.639544  0.587370  0.346282  1
  Ta  Ta6  1  0.142241  0.940839  0.342190  1
  Ta  Ta7  1  0.625093  0.110746  0.295870  1
  Ta  Ta8  1  0.152626  0.454777  0.302830  1
  Ta  Ta9  1  0.485394  0.016322  0.343309  1
  Ta  Ta10  1  0.331245  0.445273  0.346282  1
  Ta  Ta11  1  0.075267  0.754688  0.301809  1
  Ta  Ta12  1  0.681804  0.839962  0.304894  1
  Ta  Ta13  1  0.081372  0.627384  0.346046  1
  Ta  Ta14  1  0.831806  0.820254  0.347832  1
  Ta  Ta15  1  0.288984  0.192681  0.304894  1
  Ta  Ta16  1  0.554941  0.394745  0.301545  1
  Ta  Ta17  1  0.138982  0.212389  0.347832  1
  Ta  Ta18  1  0.575523  0.266312  0.345119  1
  Ta  Ta19  1  0.345695  0.921897  0.295870  1
  Ta  Ta20  1  0.415847  0.637898  0.301545  1
  Ta  Ta21  1  0.889417  0.405259  0.346046  1
  Ta  Ta22  1  0.828547  0.091804  0.342190  1
  Ta  Ta23  1  0.890887  0.267866  0.391049  1
  Ta  Ta24  1  0.394688  0.764205  0.436467  1
  Ta  Ta25  1  0.830374  0.587346  0.391490  1
  Ta  Ta26  1  0.985394  0.016322  0.389965  1
  Ta  Ta27  1  0.641346  0.586676  0.436713  1
  Ta  Ta28  1  0.137413  0.935155  0.436049  1
  Ta  Ta29  1  0.637008  0.096672  0.389777  1
  Ta  Ta30  1  0.140414  0.445297  0.391490  1
  Ta  Ta31  1  0.485394  0.016322  0.436127  1
  Ta  Ta32  1  0.329442  0.445967  0.436713  1
  Ta  Ta33  1  0.079901  0.764777  0.391049  1
  Ta  Ta34  1  0.650737  0.826703  0.391331  1
  Ta  Ta35  1  0.076760  0.629105  0.436701  1
  Ta  Ta36  1  0.819166  0.826349  0.436591  1
  Ta  Ta37  1  0.320051  0.205940  0.391331  1
  Ta  Ta38  1  0.576477  0.403424  0.391104  1
  Ta  Ta39  1  0.151623  0.206294  0.436591  1
  Ta  Ta40  1  0.576100  0.268438  0.436467  1
  Ta  Ta41  1  0.333780  0.935971  0.389777  1
  Ta  Ta42  1  0.394311  0.629219  0.391104  1
  Ta  Ta43  1  0.894028  0.403538  0.436701  1
  Ta  Ta44  1  0.833375  0.097488  0.436049  1
  Ta  Ta45  1  0.894949  0.268735  0.482119  1
  Ta  Ta46  1  0.395081  0.763899  0.527699  1
  Ta  Ta47  1  0.829067  0.586517  0.482179  1
  Ta  Ta48  1  0.985394  0.016322  0.481996  1
  Ta  Ta49  1  0.641734  0.586514  0.527639  1
  Ta  Ta50  1  0.136967  0.934199  0.527828  1
  Ta  Ta51  1  0.636625  0.098868  0.481987  1
  Ta  Ta52  1  0.141721  0.446126  0.482179  1
  Ta  Ta53  1  0.485394  0.016322  0.527820  1
  Ta  Ta54  1  0.329054  0.446130  0.527639  1
  Ta  Ta55  1  0.075840  0.763908  0.482119  1
  Ta  Ta56  1  0.653022  0.827166  0.482099  1
  Ta  Ta57  1  0.076275  0.629138  0.527689  1
  Ta  Ta58  1  0.818200  0.826722  0.527717  1
  Ta  Ta59  1  0.317766  0.205477  0.482099  1
  Ta  Ta60  1  0.576017  0.403494  0.482127  1
  Ta  Ta61  1  0.152588  0.205921  0.527717  1
  Ta  Ta62  1  0.575707  0.268744  0.527699  1
  Ta  Ta63  1  0.334163  0.933775  0.481987  1
  Ta  Ta64  1  0.394771  0.629149  0.482127  1
  Ta  Ta65  1  0.894513  0.403505  0.527689  1
  Ta  Ta66  1  0.833821  0.098444  0.527828  1
  Ta  Ta67  1  0.894529  0.268428  0.573346  1
  Ta  Ta68  1  0.390967  0.764787  0.618774  1
  Ta  Ta69  1  0.829461  0.586681  0.573103  1
  Ta  Ta70  1  0.985394  0.016322  0.573686  1
  Ta  Ta71  1  0.640413  0.587362  0.618330  1
  Ta  Ta72  1  0.137395  0.936434  0.620041  1
  Ta  Ta73  1  0.637074  0.097893  0.573771  1
  Ta  Ta74  1  0.141327  0.445962  0.573103  1
  Ta  Ta75  1  0.485394  0.016322  0.619861  1
  Ta  Ta76  1  0.330375  0.445281  0.618330  1
  Ta  Ta77  1  0.076259  0.764215  0.573346  1
  Ta  Ta78  1  0.652037  0.826782  0.573223  1
  Ta  Ta79  1  0.076737  0.629195  0.618709  1
  Ta  Ta80  1  0.820558  0.826253  0.618468  1
  Ta  Ta81  1  0.318751  0.205861  0.573223  1
  Ta  Ta82  1  0.576506  0.403525  0.573121  1
  Ta  Ta83  1  0.150230  0.206390  0.618468  1
  Ta  Ta84  1  0.579821  0.267856  0.618774  1
  Ta  Ta85  1  0.333714  0.934751  0.573771  1
  Ta  Ta86  1  0.394282  0.629118  0.573121  1
  Ta  Ta87  1  0.894051  0.403448  0.618709  1
  Ta  Ta88  1  0.833393  0.096209  0.620041  1
  Ta  Ta89  1  0.895223  0.266278  0.664685  1
  Ta  Ta90  1  0.395626  0.754672  0.708020  1
  Ta  Ta91  1  0.831215  0.587327  0.663530  1
  Ta  Ta92  1  0.985394  0.016322  0.666496  1
  Ta  Ta93  1  0.652672  0.577898  0.706994  1
  Ta  Ta94  1  0.125141  0.921929  0.713940  1
  Ta  Ta95  1  0.641999  0.092078  0.667670  1
  Ta  Ta96  1  0.139573  0.445316  0.663530  1
  Ta  Ta97  1  0.485394  0.016322  0.711351  1
  Ta  Ta98  1  0.318116  0.454745  0.706994  1
  Ta  Ta99  1  0.075565  0.766365  0.664685  1
  Ta  Ta100  1  0.639396  0.820659  0.661943  1
  Ta  Ta101  1  0.055072  0.637919  0.708258  1
  Ta  Ta102  1  0.788952  0.839895  0.704929  1
  Ta  Ta103  1  0.331392  0.211985  0.661943  1
  Ta  Ta104  1  0.581077  0.405190  0.663781  1
  Ta  Ta105  1  0.181837  0.192748  0.704929  1
  Ta  Ta106  1  0.575162  0.277971  0.708020  1
  Ta  Ta107  1  0.328789  0.940566  0.667670  1
  Ta  Ta108  1  0.389711  0.627453  0.663781  1
  Ta  Ta109  1  0.915716  0.394724  0.708258  1
  Ta  Ta110  1  0.845647  0.110714  0.713940  1
