# generated using pymatgen
data_YbSm6AlI12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.89080876
_cell_length_b   9.89080890
_cell_length_c   9.89080922
_cell_angle_alpha   107.20520945
_cell_angle_beta   107.20520236
_cell_angle_gamma   107.20520058
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YbSm6AlI12
_chemical_formula_sum   'Yb1 Sm6 Al1 I12'
_cell_volume   801.27216826
_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
  Yb  Yb0  1  0.00000000  0.00000000  0.00000000  1.0
  Sm  Sm1  1  0.81494705  0.52963153  0.60396101  1.0
  Sm  Sm2  1  0.52963153  0.60396101  0.81494705  1.0
  Sm  Sm3  1  0.18505295  0.47036847  0.39603899  1.0
  Sm  Sm4  1  0.47036847  0.39603899  0.18505295  1.0
  Sm  Sm5  1  0.60396101  0.81494705  0.52963153  1.0
  Sm  Sm6  1  0.39603899  0.18505295  0.47036847  1.0
  Al  Al7  1  0.50000000  0.50000000  0.50000000  1.0
  I  I8  1  0.72816158  0.18162840  0.57346400  1.0
  I  I9  1  0.96455493  0.88404662  0.65741007  1.0
  I  I10  1  0.57346400  0.72816158  0.18162840  1.0
  I  I11  1  0.11595338  0.34258993  0.03544507  1.0
  I  I12  1  0.65741007  0.96455493  0.88404662  1.0
  I  I13  1  0.88404662  0.65741007  0.96455493  1.0
  I  I14  1  0.03544507  0.11595338  0.34258993  1.0
  I  I15  1  0.81837160  0.42653600  0.27183842  1.0
  I  I16  1  0.34258993  0.03544507  0.11595338  1.0
  I  I17  1  0.27183842  0.81837160  0.42653600  1.0
  I  I18  1  0.18162840  0.57346400  0.72816158  1.0
  I  I19  1  0.42653600  0.27183842  0.81837160  1.0