# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.66432592
_cell_length_b   10.35398559
_cell_length_c   45.45740537
_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   2139.74929368
_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  0.073426  0.726277  0.283261  1
  Ta  Ta2  1  0.223115  0.027063  0.296598  1
  Ta  Ta3  1  0.379262  0.339833  0.312507  1
  Ta  Ta4  1  0.648281  0.876819  0.288616  1
  Ta  Ta5  1  0.801555  0.184240  0.304578  1
  Ta  Ta6  1  0.958644  0.498595  0.319796  1
  Ta  Ta7  1  0.537876  0.657037  0.326402  1
  Ta  Ta8  1  0.696954  0.975164  0.345627  1
  Ta  Ta9  1  0.854794  0.291050  0.361740  1
  Ta  Ta10  1  0.118217  0.817514  0.338074  1
  Ta  Ta11  1  0.275921  0.133210  0.353789  1
  Ta  Ta12  1  0.433883  0.449260  0.369586  1
  Ta  Ta13  1  0.011611  0.604778  0.378061  1
  Ta  Ta14  1  0.170240  0.921998  0.395913  1
  Ta  Ta15  1  0.328354  0.238335  0.412135  1
  Ta  Ta16  1  0.590425  0.762398  0.386667  1
  Ta  Ta17  1  0.749233  0.080048  0.403974  1
  Ta  Ta18  1  0.906923  0.395537  0.420347  1
  Ta  Ta19  1  0.485515  0.552780  0.428614  1
  Ta  Ta20  1  0.643298  0.868392  0.445573  1
  Ta  Ta21  1  0.801452  0.184758  0.462421  1
  Ta  Ta22  1  0.064220  0.710223  0.437051  1
  Ta  Ta23  1  0.222567  0.026948  0.454156  1
  Ta  Ta24  1  0.380263  0.342431  0.470716  1
  Ta  Ta25  1  0.959011  0.499985  0.479012  1
  Ta  Ta26  1  0.116792  0.815618  0.495777  1
  Ta  Ta27  1  0.274811  0.131700  0.512711  1
  Ta  Ta28  1  0.537820  0.657649  0.487327  1
  Ta  Ta29  1  0.695839  0.973731  0.504261  1
  Ta  Ta30  1  0.853619  0.289365  0.521026  1
  Ta  Ta31  1  0.432367  0.446918  0.529322  1
  Ta  Ta32  1  0.590063  0.762401  0.545883  1
  Ta  Ta33  1  0.748410  0.079126  0.562987  1
  Ta  Ta34  1  0.011179  0.604591  0.537618  1
  Ta  Ta35  1  0.169332  0.920957  0.554466  1
  Ta  Ta36  1  0.327115  0.236569  0.571425  1
  Ta  Ta37  1  0.905707  0.393812  0.579692  1
  Ta  Ta38  1  0.063397  0.709301  0.596065  1
  Ta  Ta39  1  0.222206  0.026951  0.613371  1
  Ta  Ta40  1  0.484276  0.551014  0.587904  1
  Ta  Ta41  1  0.642391  0.867351  0.604126  1
  Ta  Ta42  1  0.801020  0.184571  0.621978  1
  Ta  Ta43  1  0.378747  0.340089  0.630453  1
  Ta  Ta44  1  0.536709  0.656139  0.646249  1
  Ta  Ta45  1  0.694413  0.971835  0.661964  1
  Ta  Ta46  1  0.957836  0.498299  0.638298  1
  Ta  Ta47  1  0.115677  0.814185  0.654412  1
  Ta  Ta48  1  0.274754  0.132312  0.673637  1
  Ta  Ta49  1  0.853986  0.290754  0.680242  1
  Ta  Ta50  1  0.011075  0.605109  0.695460  1
  Ta  Ta51  1  0.164350  0.912531  0.711423  1
  Ta  Ta52  1  0.433368  0.449516  0.687531  1
  Ta  Ta53  1  0.589516  0.762286  0.703440  1
  Ta  Ta54  1  0.739204  0.063072  0.716777  1
