# generated using pymatgen
data_TbSm6CI12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.67061625
_cell_length_b   9.66181487
_cell_length_c   9.65847245
_cell_angle_alpha   107.65404110
_cell_angle_beta   107.66394856
_cell_angle_gamma   107.79636042
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TbSm6CI12
_chemical_formula_sum   'Tb1 Sm6 C1 I12'
_cell_volume   736.63781844
_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
  Tb  Tb0  1  0.71394688  0.97685866  0.90990480  1.0
  Sm  Sm1  1  0.46938632  0.46766074  0.46792357  1.0
  Sm  Sm2  1  0.10517982  0.29450078  0.04068316  1.0
  Sm  Sm3  1  0.03946422  0.10643126  0.29412348  1.0
  Sm  Sm4  1  0.28954393  0.03858885  0.10341777  1.0
  Sm  Sm5  1  0.91062144  0.71125846  0.97536567  1.0
  Sm  Sm6  1  0.97942759  0.90745442  0.71271107  1.0
  C  C7  1  0.98388453  0.99427242  0.99129134  1.0
  I  I8  1  0.47318988  0.38961542  0.13805781  1.0
  I  I9  1  0.14137296  0.47695752  0.39134390  1.0
  I  I10  1  0.38826569  0.13843877  0.47399314  1.0
  I  I11  1  0.53759136  0.61687955  0.84135718  1.0
  I  I12  1  0.83948175  0.53260471  0.61072697  1.0
  I  I13  1  0.61525584  0.84255891  0.54065973  1.0
  I  I14  1  0.77312158  0.31146832  0.92135922  1.0
  I  I15  1  0.92175072  0.77545580  0.31531406  1.0
  I  I16  1  0.31992779  0.92223712  0.77623641  1.0
  I  I17  1  0.23426449  0.68714667  0.07805518  1.0
  I  I18  1  0.07705220  0.23282420  0.68914877  1.0
  I  I19  1  0.68727402  0.07678844  0.22833076  1.0