# generated using pymatgen
data_LaSiI
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.24120853
_cell_length_b   4.24120853
_cell_length_c   12.10889299
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00001138
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaSiI
_chemical_formula_sum   'La2 Si2 I2'
_cell_volume   188.63152482
_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  0.00000000  0.00000000  0.16965320  1.0
  La  La1  1  0.00000000  0.00000000  0.83034680  1.0
  Si  Si2  1  0.33333300  0.66666700  0.00553519  1.0
  Si  Si3  1  0.66666700  0.33333300  0.99446481  1.0
  I  I4  1  0.33333300  0.66666700  0.64966844  1.0
  I  I5  1  0.66666700  0.33333300  0.35033156  1.0