# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.25732087
_cell_length_b   3.25732087
_cell_length_c   50.25755476
_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   Ta14
_cell_volume   533.239654838
_cell_formula_units_Z   14
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  0.507165  0.507165  0.309894  1
  Ta  Ta2  1  1.007165  0.007165  0.277256  1
  Ta  Ta3  1  0.507165  0.507165  0.375892  1
  Ta  Ta4  1  1.007165  0.007165  0.342245  1
  Ta  Ta5  1  0.507165  0.507165  0.442860  1
  Ta  Ta6  1  1.007165  0.007165  0.409394  1
  Ta  Ta7  1  0.507165  0.507165  0.509796  1
  Ta  Ta8  1  1.007165  0.007165  0.476325  1
  Ta  Ta9  1  0.507165  0.507165  0.576727  1
  Ta  Ta10  1  1.007165  0.007165  0.543260  1
  Ta  Ta11  1  0.507165  0.507165  0.643876  1
  Ta  Ta12  1  1.007165  0.007165  0.610228  1
  Ta  Ta13  1  0.507165  0.507165  0.708864  1
  Ta  Ta14  1  1.007165  0.007165  0.676227  1
