# generated using pymatgen
data_Sm12Ru(PtBr4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.27359632
_cell_length_b   10.27359693
_cell_length_c   10.27359714
_cell_angle_alpha   109.28481359
_cell_angle_beta   109.28481547
_cell_angle_gamma   109.28481344
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm12Ru(PtBr4)3
_chemical_formula_sum   'Sm12 Ru1 Pt3 Br12'
_cell_volume   840.44083792
_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  0.26383555  0.75000000  0.23616445  1.0
  Sm  Sm1  1  0.48542151  0.75000000  0.01457849  1.0
  Sm  Sm2  1  0.23877120  0.46982047  0.48027233  1.0
  Sm  Sm3  1  0.01972767  0.03017953  0.26122880  1.0
  Sm  Sm4  1  0.23616445  0.26383555  0.75000000  1.0
  Sm  Sm5  1  0.01457849  0.48542151  0.75000000  1.0
  Sm  Sm6  1  0.48027233  0.23877120  0.46982047  1.0
  Sm  Sm7  1  0.26122880  0.01972767  0.03017953  1.0
  Sm  Sm8  1  0.75000000  0.23616445  0.26383555  1.0
  Sm  Sm9  1  0.75000000  0.01457849  0.48542151  1.0
  Sm  Sm10  1  0.46982047  0.48027233  0.23877120  1.0
  Sm  Sm11  1  0.03017953  0.26122880  0.01972767  1.0
  Ru  Ru12  1  0.25000000  0.25000000  0.25000000  1.0
  Pt  Pt13  1  0.49914785  0.00085215  0.25000000  1.0
  Pt  Pt14  1  0.25000000  0.49914785  0.00085215  1.0
  Pt  Pt15  1  0.00085215  0.25000000  0.49914785  1.0
  Br  Br16  1  0.25000000  0.99258212  0.50741788  1.0
  Br  Br17  1  0.51277936  0.50738150  0.75795307  1.0
  Br  Br18  1  0.25000000  0.75496250  0.74503750  1.0
  Br  Br19  1  0.98722064  0.74204693  0.99261850  1.0
  Br  Br20  1  0.99258212  0.50741788  0.25000000  1.0
  Br  Br21  1  0.74204693  0.99261850  0.98722064  1.0
  Br  Br22  1  0.75496250  0.74503750  0.25000000  1.0
  Br  Br23  1  0.50738150  0.75795307  0.51277936  1.0
  Br  Br24  1  0.50741788  0.25000000  0.99258212  1.0
  Br  Br25  1  0.75795307  0.51277936  0.50738150  1.0
  Br  Br26  1  0.74503750  0.25000000  0.75496250  1.0
  Br  Br27  1  0.99261850  0.98722064  0.74204693  1.0