# generated using pymatgen
data_BaSb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.42866250
_cell_length_b   11.92156711
_cell_length_c   12.69352549
_cell_angle_alpha   101.41346017
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaSb2
_chemical_formula_sum   'Ba6 Sb12'
_cell_volume   656.92205035
_cell_formula_units_Z   6
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
  Ba  Ba0  1  0.25000000  0.05752971  0.76729697  1.0
  Ba  Ba1  1  0.75000000  0.94247029  0.23270303  1.0
  Ba  Ba2  1  0.25000000  0.70973133  0.44345712  1.0
  Ba  Ba3  1  0.75000000  0.29026867  0.55654288  1.0
  Ba  Ba4  1  0.25000000  0.37465397  0.08340660  1.0
  Ba  Ba5  1  0.75000000  0.62534603  0.91659340  1.0
  Sb  Sb6  1  0.25000000  0.05456931  0.45400266  1.0
  Sb  Sb7  1  0.75000000  0.94543069  0.54599734  1.0
  Sb  Sb8  1  0.25000000  0.06911272  0.05209193  1.0
  Sb  Sb9  1  0.75000000  0.93088728  0.94790807  1.0
  Sb  Sb10  1  0.25000000  0.41287655  0.77098110  1.0
  Sb  Sb11  1  0.75000000  0.58712345  0.22901890  1.0
  Sb  Sb12  1  0.75000000  0.25291306  0.26733225  1.0
  Sb  Sb13  1  0.25000000  0.74708694  0.73266775  1.0
  Sb  Sb14  1  0.75000000  0.60423327  0.63535034  1.0
  Sb  Sb15  1  0.25000000  0.39576673  0.36464966  1.0
  Sb  Sb16  1  0.75000000  0.29649471  0.85688758  1.0
  Sb  Sb17  1  0.25000000  0.70350529  0.14311242  1.0