# generated using pymatgen
data_La(SmB8)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.17950005
_cell_length_b   7.17950005
_cell_length_c   5.79610200
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   109.89398935
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La(SmB8)3
_chemical_formula_sum   'La1 Sm3 B24'
_cell_volume   280.93242453
_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
  La  La0  1  0.00000000  0.00000000  0.00000000  1.0
  Sm  Sm1  1  0.74851800  0.25148200  0.50000000  1.0
  Sm  Sm2  1  0.50000000  0.50000000  0.00000000  1.0
  Sm  Sm3  1  0.25148200  0.74851800  0.50000000  1.0
  B  B4  1  0.17631300  0.32508100  0.65116200  1.0
  B  B5  1  0.92549300  0.57449600  0.15110800  1.0
  B  B6  1  0.67491900  0.82368700  0.65116200  1.0
  B  B7  1  0.42550400  0.07450700  0.15110800  1.0
  B  B8  1  0.17631300  0.32508100  0.34883800  1.0
  B  B9  1  0.92549300  0.57449600  0.84889200  1.0
  B  B10  1  0.67491900  0.82368700  0.34883800  1.0
  B  B11  1  0.42550400  0.07450700  0.84889200  1.0
  B  B12  1  0.40032800  0.40032800  0.50000000  1.0
  B  B13  1  0.14975200  0.65015100  0.00000000  1.0
  B  B14  1  0.89955700  0.89955700  0.50000000  1.0
  B  B15  1  0.65015100  0.14975200  0.00000000  1.0
  B  B16  1  0.32508100  0.17631300  0.65116200  1.0
  B  B17  1  0.07450700  0.42550400  0.15110800  1.0
  B  B18  1  0.82368700  0.67491900  0.65116200  1.0
  B  B19  1  0.57449600  0.92549300  0.15110800  1.0
  B  B20  1  0.10044300  0.10044300  0.50000000  1.0
  B  B21  1  0.85024800  0.34984900  0.00000000  1.0
  B  B22  1  0.59967200  0.59967200  0.50000000  1.0
  B  B23  1  0.34984900  0.85024800  0.00000000  1.0
  B  B24  1  0.32508100  0.17631300  0.34883800  1.0
  B  B25  1  0.07450700  0.42550400  0.84889200  1.0
  B  B26  1  0.82368700  0.67491900  0.34883800  1.0
  B  B27  1  0.57449600  0.92549300  0.84889200  1.0