# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.24625031
_cell_length_b   4.68582533
_cell_length_c   46.86799367
_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   Ta18
_cell_volume   712.926013493
_cell_formula_units_Z   18
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  0.508895  0.498585  0.299439  1
  Ta  Ta2  1  1.008895  0.998585  0.299439  1
  Ta  Ta3  1  0.508895  0.998585  0.347651  1
  Ta  Ta4  1  1.008895  0.498585  0.347651  1
  Ta  Ta5  1  0.508895  0.498585  0.397945  1
  Ta  Ta6  1  0.008895  0.998585  0.397945  1
  Ta  Ta7  1  0.508895  0.998585  0.448222  1
  Ta  Ta8  1  0.008895  0.498585  0.448222  1
  Ta  Ta9  1  0.508895  0.498585  0.498481  1
  Ta  Ta10  1  0.008895  0.998585  0.498481  1
  Ta  Ta11  1  0.508895  0.998585  0.548740  1
  Ta  Ta12  1  1.008895  0.498585  0.548740  1
  Ta  Ta13  1  0.508895  0.498585  0.599017  1
  Ta  Ta14  1  1.008895  0.998585  0.599017  1
  Ta  Ta15  1  0.508895  0.998585  0.649311  1
  Ta  Ta16  1  0.008895  0.498585  0.649311  1
  Ta  Ta17  1  0.508895  0.498585  0.697524  1
  Ta  Ta18  1  0.008895  0.998585  0.697524  1
