# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.30002396
_cell_length_b   14.20228166
_cell_length_c   50.06673579
_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   3768.64501657
_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  0.502912  0.769953  0.362424  1
  Ta  Ta2  1  0.002912  0.339779  0.400400  1
  Ta  Ta3  1  0.252650  0.437427  0.355368  1
  Ta  Ta4  1  0.002912  0.640494  0.352777  1
  Ta  Ta5  1  0.002912  0.734921  0.399537  1
  Ta  Ta6  1  0.502912  0.937427  0.332964  1
  Ta  Ta7  1  0.251429  0.124302  0.309925  1
  Ta  Ta8  1  0.754395  0.750553  0.309925  1
  Ta  Ta9  1  0.002912  0.032924  0.350910  1
  Ta  Ta10  1  0.002912  0.841931  0.350910  1
  Ta  Ta11  1  0.002912  0.541937  0.307617  1
  Ta  Ta12  1  0.502912  0.437427  0.301630  1
  Ta  Ta13  1  0.002912  0.234360  0.352777  1
  Ta  Ta14  1  0.502912  0.278398  0.331119  1
  Ta  Ta15  1  0.502912  0.604640  0.389110  1
  Ta  Ta16  1  0.002912  0.332917  0.307617  1
  Ta  Ta17  1  0.753175  0.437427  0.355368  1
  Ta  Ta18  1  0.753235  0.937427  0.395157  1
  Ta  Ta19  1  0.002912  0.937427  0.302713  1
  Ta  Ta20  1  0.754395  0.124302  0.309925  1
  Ta  Ta21  1  0.252590  0.937427  0.395157  1
  Ta  Ta22  1  0.502912  0.101859  0.419679  1
  Ta  Ta23  1  0.251429  0.750553  0.309925  1
  Ta  Ta24  1  0.502912  0.772996  0.419679  1
  Ta  Ta25  1  0.502912  0.270215  0.389110  1
  Ta  Ta26  1  0.002912  0.535076  0.400400  1
  Ta  Ta27  1  0.502912  0.104901  0.362424  1
  Ta  Ta28  1  0.002912  0.139934  0.399537  1
  Ta  Ta29  1  0.502912  0.596457  0.331119  1
  Ta  Ta30  1  0.502912  0.437427  0.417699  1
  Ta  Ta31  1  0.502912  0.270549  0.506285  1
  Ta  Ta32  1  0.002912  0.839036  0.543996  1
  Ta  Ta33  1  0.252476  0.937427  0.499992  1
  Ta  Ta34  1  0.002912  0.140844  0.496059  1
  Ta  Ta35  1  0.002912  0.235908  0.543431  1
  Ta  Ta36  1  0.502912  0.437427  0.477597  1
  Ta  Ta37  1  0.253388  0.619483  0.447720  1
  Ta  Ta38  1  0.752437  0.255371  0.447720  1
  Ta  Ta39  1  0.002912  0.535034  0.494856  1
  Ta  Ta40  1  0.002912  0.339820  0.494856  1
  Ta  Ta41  1  0.002912  0.041666  0.447736  1
  Ta  Ta42  1  0.502912  0.937427  0.447727  1
  Ta  Ta43  1  0.002912  0.734011  0.496059  1
  Ta  Ta44  1  0.502912  0.772759  0.475825  1
  Ta  Ta45  1  0.502912  0.106130  0.533097  1
  Ta  Ta46  1  0.002912  0.833189  0.447736  1
  Ta  Ta47  1  0.753349  0.937427  0.499992  1
  Ta  Ta48  1  0.753399  0.437427  0.539602  1
  Ta  Ta49  1  0.002912  0.437427  0.447625  1
  Ta  Ta50  1  0.752437  0.619483  0.447720  1
  Ta  Ta51  1  0.252426  0.437427  0.539602  1
  Ta  Ta52  1  0.502912  0.600457  0.564105  1
  Ta  Ta53  1  0.253388  0.255371  0.447720  1
  Ta  Ta54  1  0.502912  0.274398  0.564105  1
  Ta  Ta55  1  0.502912  0.768724  0.533097  1
  Ta  Ta56  1  0.002912  0.035818  0.543996  1
  Ta  Ta57  1  0.502912  0.604305  0.506285  1
  Ta  Ta58  1  0.002912  0.638947  0.543431  1
  Ta  Ta59  1  0.502912  0.102095  0.475825  1
  Ta  Ta60  1  0.502912  0.937427  0.561008  1
  Ta  Ta61  1  0.502912  0.771081  0.649491  1
  Ta  Ta62  1  0.002912  0.338984  0.689477  1
  Ta  Ta63  1  0.252128  0.437427  0.645633  1
  Ta  Ta64  1  0.002912  0.639190  0.641428  1
  Ta  Ta65  1  0.002912  0.746408  0.686262  1
  Ta  Ta66  1  0.502912  0.937427  0.619289  1
  Ta  Ta67  1  0.253265  0.121748  0.591204  1
  Ta  Ta68  1  0.752560  0.753106  0.591204  1
  Ta  Ta69  1  0.002912  0.039504  0.636866  1
  Ta  Ta70  1  0.002912  0.835350  0.636866  1
  Ta  Ta71  1  0.002912  0.541132  0.592426  1
  Ta  Ta72  1  0.502912  0.437427  0.592695  1
  Ta  Ta73  1  0.002912  0.235665  0.641428  1
  Ta  Ta74  1  0.502912  0.273934  0.621175  1
  Ta  Ta75  1  0.502912  0.613158  0.677381  1
  Ta  Ta76  1  0.002912  0.333723  0.592426  1
  Ta  Ta77  1  0.753697  0.437427  0.645633  1
  Ta  Ta78  1  0.753993  0.937427  0.675411  1
  Ta  Ta79  1  0.002912  0.937427  0.590783  1
  Ta  Ta80  1  0.752560  0.121748  0.591204  1
  Ta  Ta81  1  0.251832  0.937427  0.675411  1
  Ta  Ta82  1  0.502912  0.067268  0.704764  1
  Ta  Ta83  1  0.253265  0.753106  0.591204  1
  Ta  Ta84  1  0.502912  0.807587  0.704764  1
  Ta  Ta85  1  0.502912  0.261696  0.677381  1
  Ta  Ta86  1  0.002912  0.535871  0.689477  1
  Ta  Ta87  1  0.502912  0.103774  0.649491  1
  Ta  Ta88  1  0.002912  0.128446  0.686262  1
  Ta  Ta89  1  0.502912  0.600920  0.621175  1
  Ta  Ta90  1  0.502912  0.437427  0.697449  1
