# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.26176148
_cell_length_b   10.39433353
_cell_length_c   47.29987412
_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   1603.64720779
_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  0.506265  0.100170  0.276510  1
  Ta  Ta2  1  0.506265  0.689142  0.319716  1
  Ta  Ta3  1  0.506265  0.389810  0.295186  1
  Ta  Ta4  1  1.006265  0.189142  0.319716  1
  Ta  Ta5  1  1.006265  0.889810  0.295186  1
  Ta  Ta6  1  1.006265  0.600170  0.276510  1
  Ta  Ta7  1  0.506265  0.986390  0.340359  1
  Ta  Ta8  1  0.506265  0.586835  0.385327  1
  Ta  Ta9  1  0.506265  0.288414  0.363356  1
  Ta  Ta10  1  1.006265  0.086835  0.385327  1
  Ta  Ta11  1  1.006265  0.788414  0.363356  1
  Ta  Ta12  1  1.006265  0.486390  0.340359  1
  Ta  Ta13  1  0.506265  0.887153  0.407749  1
  Ta  Ta14  1  0.506265  0.486380  0.452266  1
  Ta  Ta15  1  0.506265  0.186545  0.429936  1
  Ta  Ta16  1  1.006265  0.986380  0.452266  1
  Ta  Ta17  1  1.006265  0.686545  0.429936  1
  Ta  Ta18  1  1.006265  0.387153  0.407749  1
  Ta  Ta19  1  0.506265  0.786001  0.474517  1
  Ta  Ta20  1  0.506265  0.385429  0.519086  1
  Ta  Ta21  1  0.506265  0.085715  0.496801  1
  Ta  Ta22  1  1.006265  0.885429  0.519086  1
  Ta  Ta23  1  1.006265  0.585715  0.496801  1
  Ta  Ta24  1  1.006265  0.286001  0.474517  1
  Ta  Ta25  1  0.506265  0.685049  0.541337  1
  Ta  Ta26  1  0.506265  0.284277  0.585854  1
  Ta  Ta27  1  0.506265  0.984884  0.563667  1
  Ta  Ta28  1  1.006265  0.784277  0.585854  1
  Ta  Ta29  1  1.006265  0.484884  0.563667  1
  Ta  Ta30  1  1.006265  0.185049  0.541337  1
  Ta  Ta31  1  0.506265  0.584595  0.608276  1
  Ta  Ta32  1  0.506265  0.185040  0.653244  1
  Ta  Ta33  1  0.506265  0.883016  0.630247  1
  Ta  Ta34  1  1.006265  0.685040  0.653244  1
  Ta  Ta35  1  1.006265  0.383016  0.630247  1
  Ta  Ta36  1  1.006265  0.084595  0.608276  1
  Ta  Ta37  1  0.506265  0.482288  0.673887  1
  Ta  Ta38  1  0.506265  0.071260  0.717093  1
  Ta  Ta39  1  0.506265  0.781620  0.698417  1
  Ta  Ta40  1  1.006265  0.571260  0.717093  1
  Ta  Ta41  1  1.006265  0.281620  0.698417  1
  Ta  Ta42  1  1.006265  0.982288  0.673887  1
