# generated using pymatgen
data_Pr12Fe2I17
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.97827120
_cell_length_b   12.02083415
_cell_length_c   12.08127565
_cell_angle_alpha   93.52152306
_cell_angle_beta   104.56974030
_cell_angle_gamma   114.49668320
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pr12Fe2I17
_chemical_formula_sum   'Pr12 Fe2 I17'
_cell_volume   1253.46737452
_cell_formula_units_Z   1
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
  Pr  Pr0  1  0.05919064  0.51213954  0.32317533  1.0
  Pr  Pr1  1  0.98861450  0.81094522  0.58197520  1.0
  Pr  Pr2  1  0.64956873  0.24046939  0.28277580  1.0
  Pr  Pr3  1  0.01138550  0.18905478  0.41802480  1.0
  Pr  Pr4  1  0.22356660  0.66979909  0.98945127  1.0
  Pr  Pr5  1  0.26044046  0.98697253  0.89260734  1.0
  Pr  Pr6  1  0.35043127  0.75953061  0.71722420  1.0
  Pr  Pr7  1  0.94080936  0.48786046  0.67682467  1.0
  Pr  Pr8  1  0.73955954  0.01302747  0.10739266  1.0
  Pr  Pr9  1  0.14715109  0.28746100  0.15246319  1.0
  Pr  Pr10  1  0.77643340  0.33020091  0.01054873  1.0
  Pr  Pr11  1  0.85284891  0.71253900  0.84753681  1.0
  Fe  Fe12  1  0.10388533  0.73779860  0.78576022  1.0
  Fe  Fe13  1  0.89611467  0.26220140  0.21423978  1.0
  I  I14  1  0.78179692  0.52864341  0.41726965  1.0
  I  I15  1  0.63573442  0.41648853  0.75670656  1.0
  I  I16  1  0.84325223  0.89311816  0.32363065  1.0
  I  I17  1  0.32784864  0.21157207  0.37017935  1.0
  I  I18  1  0.15674777  0.10688184  0.67636935  1.0
  I  I19  1  0.59084934  0.05373874  0.84195006  1.0
  I  I20  1  0.75177022  0.17906361  0.53773773  1.0
  I  I21  1  0.54861608  0.70460575  0.95260301  1.0
  I  I22  1  0.36426558  0.58351147  0.24329344  1.0
  I  I23  1  0.21820308  0.47135659  0.58273035  1.0
  I  I24  1  0.05712367  0.36559939  0.89558011  1.0
  I  I25  1  0.45138392  0.29539425  0.04739699  1.0
  I  I26  1  -0.00000000  -0.00000000  -0.00000000  1.0
  I  I27  1  0.24822978  0.82093639  0.46226227  1.0
  I  I28  1  0.40915066  0.94626126  0.15804994  1.0
  I  I29  1  0.67215136  0.78842793  0.62982065  1.0
  I  I30  1  0.94287633  0.63440061  0.10441989  1.0