# generated using pymatgen
data_PrSmB12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.83691526
_cell_length_b   5.83691526
_cell_length_c   4.12269079
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PrSmB12
_chemical_formula_sum   'Pr1 Sm1 B12'
_cell_volume   140.45834266
_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
  Pr  Pr0  1  -0.00000000  0.00000000  0.00000000  1.0
  Sm  Sm1  1  0.50000000  0.50000000  0.00000000  1.0
  B  B2  1  -0.00000000  0.50000000  0.19966572  1.0
  B  B3  1  0.50000000  -0.00000000  0.19966572  1.0
  B  B4  1  0.15047900  0.64998831  0.50000000  1.0
  B  B5  1  0.64998831  0.15047900  0.50000000  1.0
  B  B6  1  0.15047900  0.35001169  0.50000000  1.0
  B  B7  1  0.64998831  0.84952100  0.50000000  1.0
  B  B8  1  0.84952100  0.35001169  0.50000000  1.0
  B  B9  1  0.35001169  0.84952100  0.50000000  1.0
  B  B10  1  0.84952100  0.64998831  0.50000000  1.0
  B  B11  1  0.35001169  0.15047900  0.50000000  1.0
  B  B12  1  -0.00000000  0.50000000  0.80033428  1.0
  B  B13  1  0.50000000  0.00000000  0.80033428  1.0