# generated using pymatgen
data_Sm12Ru3PtBr12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.26880197
_cell_length_b   10.26880156
_cell_length_c   10.22132568
_cell_angle_alpha   109.37759266
_cell_angle_beta   109.37759185
_cell_angle_gamma   109.56468229
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm12Ru3PtBr12
_chemical_formula_sum   'Sm12 Ru3 Pt1 Br12'
_cell_volume   830.66406150
_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  0.26196030  0.74009115  0.23004428  1.0
  Sm  Sm1  1  0.47812984  0.74009115  0.01004687  1.0
  Sm  Sm2  1  0.23427879  0.46855759  0.48427879  1.0
  Sm  Sm3  1  0.01476797  0.02953793  0.26476797  1.0
  Sm  Sm4  1  0.23427879  0.26572121  0.75000000  1.0
  Sm  Sm5  1  0.01476797  0.48523203  0.75000000  1.0
  Sm  Sm6  1  0.47812984  0.23803970  0.46808197  1.0
  Sm  Sm7  1  0.26196030  0.02187016  0.03191803  1.0
  Sm  Sm8  1  0.75990885  0.23803970  0.26995572  1.0
  Sm  Sm9  1  0.75990885  0.02187016  0.48995313  1.0
  Sm  Sm10  1  0.47046207  0.48523203  0.23523203  1.0
  Sm  Sm11  1  0.03144241  0.26572121  0.01572121  1.0
  Ru  Ru12  1  0.25005202  0.50010303  0.00005202  1.0
  Ru  Ru13  1  0.99989697  0.24994798  0.49994798  1.0
  Ru  Ru14  1  0.25005202  0.24994798  0.25000000  1.0
  Pt  Pt15  1  0.50000000  0.00000000  0.25000000  1.0
  Br  Br16  1  0.24939721  0.99300253  0.50599904  1.0
  Br  Br17  1  0.51611798  0.50805949  0.75805949  1.0
  Br  Br18  1  0.24939721  0.75639467  0.74339817  1.0
  Br  Br19  1  0.98698346  0.74349223  0.99349223  1.0
  Br  Br20  1  0.99194051  0.50805949  0.25000000  1.0
  Br  Br21  1  0.74360533  0.99300253  0.98700149  1.0
  Br  Br22  1  0.75650777  0.74349223  0.25000000  1.0
  Br  Br23  1  0.50699747  0.75639467  0.51299851  1.0
  Br  Br24  1  0.50699747  0.25060279  0.99400096  1.0
  Br  Br25  1  0.75650777  0.51301654  0.50650777  1.0
  Br  Br26  1  0.74360533  0.25060279  0.75660183  1.0
  Br  Br27  1  0.99194051  0.98388202  0.74194051  1.0