# generated using pymatgen
data_Pr6RuPtBr6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.45171266
_cell_length_b   10.45170297
_cell_length_c   10.54795209
_cell_angle_alpha   109.39710004
_cell_angle_beta   109.39724030
_cell_angle_gamma   109.24401600
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pr6RuPtBr6
_chemical_formula_sum   'Pr12 Ru2 Pt2 Br12'
_cell_volume   891.07728059
_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
  Pr  Pr0  1  0.47068165  0.48023696  0.23994631  1.0
  Pr  Pr1  1  0.74030057  0.23074210  0.26008023  1.0
  Pr  Pr2  1  0.74178701  0.00966476  0.47939630  1.0
  Pr  Pr3  1  0.23762908  0.46979039  0.47941326  1.0
  Pr  Pr4  1  0.26925890  0.75969943  0.23992077  1.0
  Pr  Pr5  1  0.03020961  0.26236992  0.02058674  1.0
  Pr  Pr6  1  0.01976304  0.02931835  0.26005369  1.0
  Pr  Pr7  1  0.49033424  0.75821199  0.02060370  1.0
  Pr  Pr8  1  0.48534128  0.23535551  0.47069208  1.0
  Pr  Pr9  1  0.01385918  0.48614182  0.75000100  1.0
  Pr  Pr10  1  0.26464449  0.01465972  0.02930892  1.0
  Pr  Pr11  1  0.23616718  0.26383082  0.74999900  1.0
  Ru  Ru12  1  0.25048475  0.24951525  0.25000000  1.0
  Ru  Ru13  1  0.49950811  0.00049289  0.25000000  1.0
  Pt  Pt14  1  0.99944929  0.24942998  0.49883320  1.0
  Pt  Pt15  1  0.25057002  0.50055071  0.00116780  1.0
  Br  Br16  1  0.25082804  0.75454922  0.74495861  1.0
  Br  Br17  1  0.50960365  0.50585958  0.75506528  1.0
  Br  Br18  1  0.98595716  0.74139106  0.99162174  1.0
  Br  Br19  1  0.74544978  0.24917296  0.75504039  1.0
  Br  Br20  1  0.99414042  0.99039435  0.74493372  1.0
  Br  Br21  1  0.24975670  0.99433652  0.50834520  1.0
  Br  Br22  1  0.75860894  0.51404284  0.50837826  1.0
  Br  Br23  1  0.50566348  0.25024330  0.99165480  1.0
  Br  Br24  1  0.75602667  0.74397233  0.25000000  1.0
  Br  Br25  1  0.74359383  0.99357117  0.98714650  1.0
  Br  Br26  1  0.99395208  0.50604892  0.25000000  1.0
  Br  Br27  1  0.50642883  0.75640617  0.51285350  1.0