# generated using pymatgen
data_La3PbI3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.29230617
_cell_length_b   11.29317981
_cell_length_c   11.29317981
_cell_angle_alpha   109.45882392
_cell_angle_beta   109.47898709
_cell_angle_gamma   109.47898709
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La3PbI3
_chemical_formula_sum   'La12 Pb4 I12'
_cell_volume   1108.60393572
_cell_formula_units_Z   4
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  0.75000000  0.24246780  0.25753220  1.0
  La  La1  1  0.49247487  0.74998988  0.00747882  1.0
  La  La2  1  0.01503364  0.25751632  0.00751632  1.0
  La  La3  1  0.25746332  0.00749253  0.01496993  1.0
  La  La4  1  0.24253668  0.25750561  0.75002920  1.0
  La  La5  1  0.25746332  0.74997080  0.24249439  1.0
  La  La6  1  0.24253668  0.48503007  0.49250747  1.0
  La  La7  1  0.48496636  0.49248368  0.24248368  1.0
  La  La8  1  0.75000000  0.00753220  0.49246780  1.0
  La  La9  1  0.49247487  0.24248500  0.48499505  1.0
  La  La10  1  0.00752513  0.01500495  0.25751500  1.0
  La  La11  1  0.00752513  0.49252118  0.75001012  1.0
  Pb  Pb12  1  0.00002785  0.25001393  0.50001393  1.0
  Pb  Pb13  1  0.25000000  0.50000754  -0.00000754  1.0
  Pb  Pb14  1  0.49997215  -0.00001393  0.24998607  1.0
  Pb  Pb15  1  0.25000000  0.24999246  0.25000754  1.0
  I  I16  1  0.75629940  0.74366274  0.24995518  1.0
  I  I17  1  0.50662891  0.25016819  0.99366697  1.0
  I  I18  1  0.25000000  0.99364379  0.50635621  1.0
  I  I19  1  0.51315302  0.50657651  0.75657651  1.0
  I  I20  1  0.50662891  0.75646072  0.51296194  1.0
  I  I21  1  0.75629940  0.51263667  0.50634423  1.0
  I  I22  1  0.74370060  0.25004482  0.75633726  1.0
  I  I23  1  0.25000000  0.75635621  0.74364379  1.0
  I  I24  1  0.98684698  0.74342349  0.99342349  1.0
  I  I25  1  0.99337109  0.50633303  0.24983181  1.0
  I  I26  1  0.99337109  0.98703806  0.74353928  1.0
  I  I27  1  0.74370060  0.99365577  0.98736333  1.0