# generated using pymatgen
data_Pr2Sm2B4I5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.85494974
_cell_length_b   9.85494872
_cell_length_c   10.05262767
_cell_angle_alpha   75.34160127
_cell_angle_beta   75.34160186
_cell_angle_gamma   25.22648651
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pr2Sm2B4I5
_chemical_formula_sum   'Pr2 Sm2 B4 I5'
_cell_volume   401.86799313
_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  0.13380006  0.13380006  0.93184323  1.0
  Pr  Pr1  1  0.86789855  0.86789855  0.06694047  1.0
  Sm  Sm2  1  0.50289388  0.50289388  0.75452055  1.0
  Sm  Sm3  1  0.49896846  0.49896846  0.24425087  1.0
  B  B4  1  0.31609086  0.68561413  0.99946532  1.0
  B  B5  1  0.68561413  0.31609086  0.99946532  1.0
  B  B6  1  0.00083001  0.00083001  0.09622308  1.0
  B  B7  1  0.00084505  0.00084505  0.90270493  1.0
  I  I8  1  0.67406089  0.67406089  0.67877734  1.0
  I  I9  1  0.32758569  0.32758569  0.32017995  1.0
  I  I10  1  0.32773953  0.32773953  0.84782567  1.0
  I  I11  1  0.67401726  0.67401726  0.15050627  1.0
  I  I12  1  0.00395663  0.00395663  0.49749600  1.0