# generated using pymatgen
data_La3CoI3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.53513306
_cell_length_b   9.45352872
_cell_length_c   12.08408653
_cell_angle_alpha   86.49176973
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La3CoI3
_chemical_formula_sum   'La6 Co2 I6'
_cell_volume   517.11029579
_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  0.25000000  0.31646865  0.88034765  1.0
  La  La1  1  0.75000000  0.68353135  0.11965235  1.0
  La  La2  1  0.75000000  0.11341381  0.67909717  1.0
  La  La3  1  0.25000000  0.88658619  0.32090283  1.0
  La  La4  1  0.75000000  0.09498762  0.09120177  1.0
  La  La5  1  0.25000000  0.90501238  0.90879823  1.0
  Co  Co6  1  0.75000000  0.11738378  0.87202620  1.0
  Co  Co7  1  0.25000000  0.88261622  0.12797380  1.0
  I  I8  1  0.75000000  0.12847383  0.37689761  1.0
  I  I9  1  0.25000000  0.87152617  0.62310239  1.0
  I  I10  1  0.25000000  0.36137942  0.61421047  1.0
  I  I11  1  0.75000000  0.63862058  0.38578953  1.0
  I  I12  1  0.75000000  0.60804225  0.85797961  1.0
  I  I13  1  0.25000000  0.39195775  0.14202039  1.0