# generated using pymatgen
data_NaNd6GaI12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.92200130
_cell_length_b   9.92200093
_cell_length_c   9.92200133
_cell_angle_alpha   106.89741899
_cell_angle_beta   106.89743148
_cell_angle_gamma   106.89742353
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaNd6GaI12
_chemical_formula_sum   'Na1 Nd6 Ga1 I12'
_cell_volume   815.73923725
_cell_formula_units_Z   1
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
  Na  Na0  1  0.50000000  0.50000000  0.50000000  1.0
  Nd  Nd1  1  0.32206037  0.10554626  0.03252959  1.0
  Nd  Nd2  1  0.03252959  0.32206037  0.10554626  1.0
  Nd  Nd3  1  0.10554626  0.03252959  0.32206037  1.0
  Nd  Nd4  1  0.89445274  0.96747041  0.67793963  1.0
  Nd  Nd5  1  0.96747041  0.67793963  0.89445274  1.0
  Nd  Nd6  1  0.67793963  0.89445374  0.96746941  1.0
  Ga  Ga7  1  0.00000000  0.00000000  0.00000000  1.0
  I  I8  1  0.68607371  0.23454389  0.07909610  1.0
  I  I9  1  0.37873764  0.45921788  0.14772027  1.0
  I  I10  1  0.07909610  0.68607371  0.23454389  1.0
  I  I11  1  0.76545511  0.92090390  0.31392629  1.0
  I  I12  1  0.45921788  0.14772127  0.37873664  1.0
  I  I13  1  0.14772127  0.37873664  0.45921788  1.0
  I  I14  1  0.85227973  0.62126336  0.54078312  1.0
  I  I15  1  0.54078212  0.85227973  0.62126336  1.0
  I  I16  1  0.23454389  0.07909610  0.68607371  1.0
  I  I17  1  0.92090390  0.31392629  0.76545511  1.0
  I  I18  1  0.62126336  0.54078312  0.85227973  1.0
  I  I19  1  0.31392629  0.76545511  0.92090390  1.0