# generated using pymatgen
data_La2Ru2I
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.33604162
_cell_length_b   4.33604162
_cell_length_c   17.86771215
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99998325
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2Ru2I
_chemical_formula_sum   'La4 Ru4 I2'
_cell_volume   290.92868046
_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  0.10508096  1.0
  La  La1  1  0.00000000  -0.00000000  0.89491904  1.0
  La  La2  1  0.00000000  -0.00000000  0.60508096  1.0
  La  La3  1  -0.00000000  -0.00000000  0.39491904  1.0
  Ru  Ru4  1  0.33333300  0.66666700  0.50600612  1.0
  Ru  Ru5  1  0.66666700  0.33333300  0.49399388  1.0
  Ru  Ru6  1  0.66666700  0.33333300  0.00600612  1.0
  Ru  Ru7  1  0.33333300  0.66666700  0.99399388  1.0
  I  I8  1  0.33333300  0.66666700  0.25000000  1.0
  I  I9  1  0.66666700  0.33333300  0.75000000  1.0