# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.23685530
_cell_length_b   10.37177631
_cell_length_c   47.35293920
_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   Ta42
_cell_volume   1589.72999032
_cell_formula_units_Z   42
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  0.510372  0.007966  0.329384  1
  Ta  Ta2  1  0.510372  0.709638  0.309188  1
  Ta  Ta3  1  0.510372  0.416641  0.286008  1
  Ta  Ta4  1  0.010372  0.203436  0.305997  1
  Ta  Ta5  1  0.010372  0.905388  0.287141  1
  Ta  Ta6  1  0.010372  0.625318  0.267063  1
  Ta  Ta7  1  0.510372  0.907984  0.395911  1
  Ta  Ta8  1  0.510372  0.606343  0.373394  1
  Ta  Ta9  1  0.510372  0.305947  0.349287  1
  Ta  Ta10  1  0.010372  0.108800  0.372668  1
  Ta  Ta11  1  0.010372  0.809863  0.351405  1
  Ta  Ta12  1  0.010372  0.506793  0.328410  1
  Ta  Ta13  1  0.510372  0.804610  0.462895  1
  Ta  Ta14  1  0.510372  0.504649  0.440255  1
  Ta  Ta15  1  0.510372  0.206015  0.417803  1
  Ta  Ta16  1  0.010372  0.005842  0.440537  1
  Ta  Ta17  1  0.010372  0.705880  0.418153  1
  Ta  Ta18  1  0.010372  0.405176  0.395122  1
  Ta  Ta19  1  0.510372  0.702717  0.530152  1
  Ta  Ta20  1  0.510372  0.403564  0.507682  1
  Ta  Ta21  1  0.510372  0.104191  0.485256  1
  Ta  Ta22  1  0.010372  0.903174  0.507645  1
  Ta  Ta23  1  0.010372  0.603801  0.485218  1
  Ta  Ta24  1  0.010372  0.304648  0.462748  1
  Ta  Ta25  1  0.510372  0.602189  0.597778  1
  Ta  Ta26  1  0.510372  0.301485  0.574747  1
  Ta  Ta27  1  0.510372  1.001523  0.552363  1
  Ta  Ta28  1  0.010372  0.801350  0.575097  1
  Ta  Ta29  1  0.010372  0.502716  0.552645  1
  Ta  Ta30  1  0.010372  0.202755  0.530005  1
  Ta  Ta31  1  0.510372  0.500572  0.664490  1
  Ta  Ta32  1  0.510372  0.197502  0.641495  1
  Ta  Ta33  1  0.510372  0.898565  0.620232  1
  Ta  Ta34  1  0.010372  0.701418  0.643613  1
  Ta  Ta35  1  0.010372  0.401022  0.619506  1
  Ta  Ta36  1  0.010372  0.099381  0.596989  1
  Ta  Ta37  1  0.510372  0.382047  0.725837  1
  Ta  Ta38  1  0.510372  0.101977  0.705759  1
  Ta  Ta39  1  0.510372  0.803929  0.686903  1
  Ta  Ta40  1  0.010372  0.590724  0.706892  1
  Ta  Ta41  1  0.010372  0.297728  0.683712  1
  Ta  Ta42  1  0.010372  0.999399  0.663516  1
