# generated using pymatgen
data_Pr7SeI12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.95447144
_cell_length_b   9.95447110
_cell_length_c   9.95447180
_cell_angle_alpha   107.91414528
_cell_angle_beta   107.91415044
_cell_angle_gamma   107.91415398
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pr7SeI12
_chemical_formula_sum   'Pr7 Se1 I12'
_cell_volume   800.11743907
_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  0.96202084  0.89050973  0.68446405  1.0
  Pr  Pr1  1  0.03797916  0.10949027  0.31553595  1.0
  Pr  Pr2  1  0.10949027  0.31553595  0.03797916  1.0
  Pr  Pr3  1  0.31553595  0.03797916  0.10949027  1.0
  Pr  Pr4  1  0.50000000  0.50000000  0.50000000  1.0
  Pr  Pr5  1  0.89050973  0.68446405  0.96202084  1.0
  Pr  Pr6  1  0.68446405  0.96202084  0.89050973  1.0
  Se  Se7  1  0.00000000  0.00000000  0.00000000  1.0
  I  I8  1  0.52348753  0.60799175  0.84850411  1.0
  I  I9  1  0.47651247  0.39200825  0.15149589  1.0
  I  I10  1  0.31310307  0.92183222  0.76964489  1.0
  I  I11  1  0.39200825  0.15149589  0.47651247  1.0
  I  I12  1  0.92183222  0.76964489  0.31310307  1.0
  I  I13  1  0.68689693  0.07816778  0.23035511  1.0
  I  I14  1  0.07816778  0.23035511  0.68689693  1.0
  I  I15  1  0.76964489  0.31310307  0.92183222  1.0
  I  I16  1  0.23035511  0.68689693  0.07816778  1.0
  I  I17  1  0.84850411  0.52348753  0.60799175  1.0
  I  I18  1  0.15149589  0.47651247  0.39200825  1.0
  I  I19  1  0.60799175  0.84850411  0.52348753  1.0