# generated using pymatgen
data_LaSmI4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.95812776
_cell_length_b   8.95812776
_cell_length_c   7.81792937
_cell_angle_alpha   68.27963424
_cell_angle_beta   68.27963424
_cell_angle_gamma   109.99039581
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaSmI4
_chemical_formula_sum   'La2 Sm2 I8'
_cell_volume   450.47655008
_cell_formula_units_Z   2
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  0.48663600  0.51336400  0.25000000  1.0
  La  La1  1  0.51336400  0.48663600  0.75000000  1.0
  Sm  Sm2  1  0.86883700  0.13116300  0.75000000  1.0
  Sm  Sm3  1  0.13116300  0.86883700  0.25000000  1.0
  I  I4  1  0.55387800  0.18012300  0.09771500  1.0
  I  I5  1  0.75372900  0.87369800  0.25518100  1.0
  I  I6  1  0.24627100  0.12630200  0.74481900  1.0
  I  I7  1  0.81987700  0.44612200  0.40228500  1.0
  I  I8  1  0.18012300  0.55387800  0.59771500  1.0
  I  I9  1  0.12630200  0.24627100  0.24481900  1.0
  I  I10  1  0.87369800  0.75372900  0.75518100  1.0
  I  I11  1  0.44612200  0.81987700  0.90228500  1.0