# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.67339104
_cell_length_b   10.33315752
_cell_length_c   45.40813304
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   102.92096638
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta
_chemical_formula_sum   Ta54
_cell_volume   2137.27605449
_cell_formula_units_Z   54
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  0.385978  0.187902  0.306075  1
  Ta  Ta2  1  0.541324  0.498503  0.321568  1
  Ta  Ta3  1  0.234508  0.884265  0.290223  1
  Ta  Ta4  1  0.808254  0.032263  0.298103  1
  Ta  Ta5  1  0.963090  0.342202  0.313808  1
  Ta  Ta6  1  0.655795  0.726058  0.282842  1
  Ta  Ta7  1  0.859498  0.134813  0.354445  1
  Ta  Ta8  1  0.017453  0.450779  0.370244  1
  Ta  Ta9  1  0.701417  0.818363  0.337860  1
  Ta  Ta10  1  0.280470  0.976641  0.346234  1
  Ta  Ta11  1  0.438175  0.292238  0.362594  1
  Ta  Ta12  1  0.121094  0.657671  0.326773  1
  Ta  Ta13  1  0.332487  0.081085  0.404584  1
  Ta  Ta14  1  0.490519  0.397318  0.421032  1
  Ta  Ta15  1  0.173823  0.763586  0.386900  1
  Ta  Ta16  1  0.753268  0.922548  0.396101  1
  Ta  Ta17  1  0.911704  0.239604  0.412814  1
  Ta  Ta18  1  0.595533  0.606972  0.378471  1
  Ta  Ta19  1  0.805660  0.027836  0.454724  1
  Ta  Ta20  1  0.963559  0.343787  0.471434  1
  Ta  Ta21  1  0.647690  0.711792  0.437688  1
  Ta  Ta22  1  0.226542  0.869541  0.446160  1
  Ta  Ta23  1  0.384670  0.185928  0.463118  1
  Ta  Ta24  1  0.069130  0.554612  0.429235  1
  Ta  Ta25  1  0.278972  0.974877  0.505008  1
  Ta  Ta26  1  0.436674  0.290412  0.521811  1
  Ta  Ta27  1  0.121137  0.659095  0.488112  1
  Ta  Ta28  1  0.700037  0.816955  0.496561  1
  Ta  Ta29  1  0.857872  0.132736  0.513457  1
  Ta  Ta30  1  0.542335  0.501420  0.479758  1
  Ta  Ta31  1  0.752468  0.922291  0.555409  1
  Ta  Ta32  1  0.909879  0.237220  0.572334  1
  Ta  Ta33  1  0.594340  0.605903  0.538451  1
  Ta  Ta34  1  0.173349  0.763995  0.546845  1
  Ta  Ta35  1  0.331320  0.080040  0.563881  1
  Ta  Ta36  1  0.015450  0.448045  0.530135  1
  Ta  Ta37  1  0.225742  0.869284  0.605467  1
  Ta  Ta38  1  0.383476  0.184860  0.623098  1
  Ta  Ta39  1  0.067306  0.552227  0.588755  1
  Ta  Ta40  1  0.646523  0.710747  0.596985  1
  Ta  Ta41  1  0.805187  0.028246  0.614669  1
  Ta  Ta42  1  0.488490  0.394514  0.580537  1
  Ta  Ta43  1  0.698539  0.815191  0.655335  1
  Ta  Ta44  1  0.857916  0.134161  0.674796  1
  Ta  Ta45  1  0.540834  0.499594  0.638975  1
  Ta  Ta46  1  0.119512  0.657018  0.647124  1
  Ta  Ta47  1  0.277593  0.973468  0.663709  1
  Ta  Ta48  1  0.961556  0.341052  0.631325  1
  Ta  Ta49  1  0.170756  0.759569  0.703466  1
  Ta  Ta50  1  0.323214  0.065774  0.718727  1
  Ta  Ta51  1  0.015919  0.449630  0.687761  1
  Ta  Ta52  1  0.593032  0.603930  0.695494  1
  Ta  Ta53  1  0.744501  0.907567  0.711346  1
  Ta  Ta54  1  0.437685  0.293329  0.680001  1
