# generated using pymatgen
data_Sm6IO12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.64194388
_cell_length_b   6.64194408
_cell_length_c   6.64194407
_cell_angle_alpha   98.62762628
_cell_angle_beta   98.62762765
_cell_angle_gamma   98.62762454
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm6IO12
_chemical_formula_sum   'Sm6 I1 O12'
_cell_volume   281.92238481
_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
  Sm  Sm0  1  0.61043497  0.31358898  0.14504205  1.0
  Sm  Sm1  1  0.14504105  0.61043597  0.31358898  1.0
  Sm  Sm2  1  0.68641002  0.85495795  0.38956403  1.0
  Sm  Sm3  1  0.31358898  0.14504105  0.61043497  1.0
  Sm  Sm4  1  0.85495895  0.38956403  0.68641102  1.0
  Sm  Sm5  1  0.38956403  0.68641102  0.85495795  1.0
  I  I6  1  0.00000000  0.00000000  0.00000000  1.0
  O  O7  1  0.70228471  0.93230121  0.03584111  1.0
  O  O8  1  0.96415889  0.29771429  0.06769779  1.0
  O  O9  1  0.43638356  0.59227194  0.17764155  1.0
  O  O10  1  0.06769779  0.96415889  0.29771529  1.0
  O  O11  1  0.82235745  0.56361744  0.40772806  1.0
  O  O12  1  0.59227194  0.17764155  0.43638256  1.0
  O  O13  1  0.40772806  0.82235745  0.56361644  1.0
  O  O14  1  0.17764155  0.43638256  0.59227194  1.0
  O  O15  1  0.93230221  0.03584111  0.70228471  1.0
  O  O16  1  0.56361644  0.40772806  0.82235845  1.0
  O  O17  1  0.03584111  0.70228471  0.93230221  1.0
  O  O18  1  0.29771429  0.06769779  0.96415789  1.0