# generated using pymatgen
data_Sm6SiGeI6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.68447423
_cell_length_b   10.68447422
_cell_length_c   10.66347973
_cell_angle_alpha   109.47251582
_cell_angle_beta   109.47251349
_cell_angle_gamma   109.54826202
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm6SiGeI6
_chemical_formula_sum   'Sm12 Si2 Ge2 I12'
_cell_volume   936.17199961
_cell_formula_units_Z   2
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  0.46499098  0.48470427  0.23083244  1.0
  Sm  Sm1  1  0.75387283  0.23415855  0.26916756  1.0
  Sm  Sm2  1  0.75368275  0.01941812  0.48504179  1.0
  Sm  Sm3  1  0.23135904  0.46562367  0.48504179  1.0
  Sm  Sm4  1  0.26584145  0.74612717  0.23083244  1.0
  Sm  Sm5  1  0.03437633  0.26864096  0.01495821  1.0
  Sm  Sm6  1  0.01529573  0.03500902  0.26916756  1.0
  Sm  Sm7  1  0.48058188  0.74631725  0.01495821  1.0
  Sm  Sm8  1  0.48350112  0.23350112  0.46700125  1.0
  Sm  Sm9  1  0.01781750  0.48218250  0.75000000  1.0
  Sm  Sm10  1  0.26649888  0.01649888  0.03299875  1.0
  Sm  Sm11  1  0.23218250  0.26781750  0.75000000  1.0
  Si  Si12  1  0.00028785  0.25028785  0.50057569  1.0
  Si  Si13  1  0.24971215  0.49971215  0.99942431  1.0
  Ge  Ge14  1  0.25002817  0.24997183  0.25000000  1.0
  Ge  Ge15  1  0.49997183  0.00002817  0.25000000  1.0
  I  I16  1  0.24999000  0.75734459  0.74270158  1.0
  I  I17  1  0.51464202  0.50728842  0.75729842  1.0
  I  I18  1  0.98622134  0.74314788  0.99327724  1.0
  I  I19  1  0.74265541  0.25001000  0.75729842  1.0
  I  I20  1  0.99271158  0.98535798  0.74270158  1.0
  I  I21  1  0.24987164  0.99294410  0.50672276  1.0
  I  I22  1  0.75685212  0.51377866  0.50672276  1.0
  I  I23  1  0.50705590  0.25012836  0.99327724  1.0
  I  I24  1  0.75707496  0.74292504  0.25000000  1.0
  I  I25  1  0.74295323  0.99295323  0.98590647  1.0
  I  I26  1  0.99292504  0.50707496  0.25000000  1.0
  I  I27  1  0.50704677  0.75704677  0.51409353  1.0