# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.36569613
_cell_length_b   7.36182609
_cell_length_c   48.42780282
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   78.46304097
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta
_chemical_formula_sum   Ta64
_cell_volume   2572.94044443
_cell_formula_units_Z   64
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  0.914857  0.915745  0.288498  1
  Ta  Ta2  1  0.417086  0.417951  0.288508  1
  Ta  Ta3  1  0.316527  0.813346  0.312314  1
  Ta  Ta4  1  0.812499  0.317423  0.312315  1
  Ta  Ta5  1  0.479982  0.480785  0.342321  1
  Ta  Ta6  1  0.165830  0.166746  0.287594  1
  Ta  Ta7  1  0.069882  0.562618  0.312995  1
  Ta  Ta8  1  0.561800  0.070680  0.312993  1
  Ta  Ta9  1  0.730451  0.731200  0.338957  1
  Ta  Ta10  1  0.231669  0.232463  0.341557  1
  Ta  Ta11  1  0.145894  0.648904  0.368606  1
  Ta  Ta12  1  0.648142  0.146650  0.368606  1
  Ta  Ta13  1  0.314067  0.314790  0.396894  1
  Ta  Ta14  1  0.982421  0.983243  0.340915  1
  Ta  Ta15  1  0.895518  0.399784  0.368277  1
  Ta  Ta16  1  0.399038  0.896258  0.368273  1
  Ta  Ta17  1  0.564776  0.565496  0.396783  1
  Ta  Ta18  1  0.064265  0.064977  0.396580  1
  Ta  Ta19  1  0.979992  0.481456  0.424327  1
  Ta  Ta20  1  0.480777  0.980669  0.424325  1
  Ta  Ta21  1  0.147052  0.147693  0.452348  1
  Ta  Ta22  1  0.813312  0.814021  0.395935  1
  Ta  Ta23  1  0.730598  0.230930  0.424376  1
  Ta  Ta24  1  0.230252  0.731277  0.424376  1
  Ta  Ta25  1  0.397188  0.397832  0.452446  1
  Ta  Ta26  1  0.896793  0.897432  0.452119  1
  Ta  Ta27  1  0.813487  0.314091  0.480204  1
  Ta  Ta28  1  0.313485  0.814092  0.480203  1
  Ta  Ta29  1  0.979903  0.980472  0.508013  1
  Ta  Ta30  1  0.647210  0.647855  0.452381  1
  Ta  Ta31  1  0.563576  0.064011  0.480191  1
  Ta  Ta32  1  0.063406  0.564182  0.480192  1
  Ta  Ta33  1  0.230151  0.230721  0.508175  1
  Ta  Ta34  1  0.730114  0.730685  0.508157  1
  Ta  Ta35  1  0.646432  0.147098  0.536024  1
  Ta  Ta36  1  0.146565  0.646965  0.536024  1
  Ta  Ta37  1  0.813135  0.813631  0.563997  1
  Ta  Ta38  1  0.480186  0.480757  0.508234  1
  Ta  Ta39  1  0.396663  0.896901  0.536010  1
  Ta  Ta40  1  0.896369  0.397196  0.536011  1
  Ta  Ta41  1  0.062830  0.063325  0.563714  1
  Ta  Ta42  1  0.563360  0.563860  0.564165  1
  Ta  Ta43  1  0.479935  0.979335  0.591769  1
  Ta  Ta44  1  0.978876  0.480394  0.591771  1
  Ta  Ta45  1  0.646705  0.647137  0.620405  1
  Ta  Ta46  1  0.313422  0.313922  0.564097  1
  Ta  Ta47  1  0.229839  0.729481  0.591820  1
  Ta  Ta48  1  0.729022  0.230300  0.591821  1
  Ta  Ta49  1  0.896708  0.897134  0.619861  1
  Ta  Ta50  1  0.397202  0.397634  0.620311  1
  Ta  Ta51  1  0.313324  0.810117  0.647677  1
  Ta  Ta52  1  0.809734  0.313712  0.647680  1
  Ta  Ta53  1  0.480631  0.481030  0.677620  1
  Ta  Ta54  1  0.145581  0.145997  0.619011  1
  Ta  Ta55  1  0.059547  0.564964  0.647279  1
  Ta  Ta56  1  0.564583  0.059925  0.647278  1
  Ta  Ta57  1  0.731504  0.731831  0.676912  1
  Ta  Ta58  1  0.232681  0.233019  0.673017  1
  Ta  Ta59  1  0.130323  0.639790  0.702238  1
  Ta  Ta60  1  0.639495  0.130636  0.702236  1
  Ta  Ta61  1  0.290396  0.290577  0.725758  1
  Ta  Ta62  1  0.983440  0.983787  0.675389  1
  Ta  Ta63  1  0.896401  0.376786  0.702164  1
  Ta  Ta64  1  0.376535  0.896629  0.702160  1
