# generated using pymatgen
data_PrNd7(SiI6)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.36572534
_cell_length_b   14.41560551
_cell_length_c   15.22081113
_cell_angle_alpha   89.91112986
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PrNd7(SiI6)2
_chemical_formula_sum   'Pr1 Nd7 Si2 I12'
_cell_volume   957.91411628
_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  0.50000000  0.38442080  0.84557176  1.0
  Nd  Nd1  1  0.50000000  0.11508774  0.34592383  1.0
  Nd  Nd2  1  0.50000000  0.88520841  0.65413457  1.0
  Nd  Nd3  1  0.50000000  0.61524009  0.15420315  1.0
  Nd  Nd4  1  0.00000000  0.11262158  0.57539134  1.0
  Nd  Nd5  1  0.00000000  0.88725026  0.42442667  1.0
  Nd  Nd6  1  0.00000000  0.61302948  0.92406616  1.0
  Nd  Nd7  1  0.00000000  0.38706354  0.07593419  1.0
  Si  Si8  1  0.50000000  0.99994721  0.49991665  1.0
  Si  Si9  1  0.50000000  0.50038177  0.00044859  1.0
  I  I10  1  0.50000000  0.24511616  0.16371311  1.0
  I  I11  1  0.50000000  0.75496076  0.83640976  1.0
  I  I12  1  0.50000000  0.74598825  0.33667076  1.0
  I  I13  1  0.50000000  0.25342865  0.66261468  1.0
  I  I14  1  0.00000000  0.25880600  0.41438441  1.0
  I  I15  1  0.00000000  0.74173866  0.58568354  1.0
  I  I16  1  0.00000000  0.75880313  0.08538639  1.0
  I  I17  1  0.00000000  0.23981577  0.91621191  1.0
  I  I18  1  0.00000000  0.99861387  0.24016757  1.0
  I  I19  1  0.00000000  0.00149872  0.75987442  1.0
  I  I20  1  0.00000000  0.49856199  0.25995929  1.0
  I  I21  1  0.00000000  0.50241516  0.73890926  1.0