# generated using pymatgen
data_BaNa
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.61247902
_cell_length_b   12.61247902
_cell_length_c   12.61247902
_cell_angle_alpha   60.00000000
_cell_angle_beta   60.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaNa
_chemical_formula_sum   'Ba12 Na12'
_cell_volume   1418.68629155
_cell_formula_units_Z   12
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  0.59237682  0.22286953  0.59237682  1.0
  Ba  Ba1  1  0.52713047  0.15762318  0.15762318  1.0
  Ba  Ba2  1  0.59237682  0.59237682  0.59237682  1.0
  Ba  Ba3  1  0.15762318  0.15762318  0.52713047  1.0
  Ba  Ba4  1  0.22286953  0.59237682  0.59237682  1.0
  Ba  Ba5  1  0.15762318  0.52713047  0.15762318  1.0
  Ba  Ba6  1  0.59237682  0.59237682  0.22286953  1.0
  Ba  Ba7  1  0.15762318  0.15762318  0.15762318  1.0
  Ba  Ba8  1  0.37500000  0.37500000  0.37500000  1.0
  Ba  Ba9  1  0.37500000  0.37500000  0.87500000  1.0
  Ba  Ba10  1  0.37500000  0.87500000  0.37500000  1.0
  Ba  Ba11  1  0.87500000  0.37500000  0.37500000  1.0
  Na  Na12  1  0.21171305  0.78828695  0.78828695  1.0
  Na  Na13  1  0.96171305  0.96171305  0.53828695  1.0
  Na  Na14  1  0.78828695  0.21171305  0.21171305  1.0
  Na  Na15  1  0.53828695  0.53828695  0.96171305  1.0
  Na  Na16  1  0.78828695  0.21171305  0.78828695  1.0
  Na  Na17  1  0.53828695  0.96171305  0.96171305  1.0
  Na  Na18  1  0.21171305  0.78828695  0.21171305  1.0
  Na  Na19  1  0.96171305  0.53828695  0.53828695  1.0
  Na  Na20  1  0.78828695  0.78828695  0.21171305  1.0
  Na  Na21  1  0.96171305  0.53828695  0.96171305  1.0
  Na  Na22  1  0.21171305  0.21171305  0.78828695  1.0
  Na  Na23  1  0.53828695  0.96171305  0.53828695  1.0