# generated using pymatgen
data_La12Ru(PtBr4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.61547277
_cell_length_b   10.61547302
_cell_length_c   10.61547324
_cell_angle_alpha   109.19400015
_cell_angle_beta   109.19399953
_cell_angle_gamma   109.19400210
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La12Ru(PtBr4)3
_chemical_formula_sum   'La12 Ru1 Pt3 Br12'
_cell_volume   930.19692668
_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
  La  La0  1  0.26539313  0.75000000  0.23460687  1.0
  La  La1  1  0.48626703  0.75000000  0.01373297  1.0
  La  La2  1  0.23776881  0.47014144  0.47876336  1.0
  La  La3  1  0.02123664  0.02985856  0.26223119  1.0
  La  La4  1  0.23460687  0.26539313  0.75000000  1.0
  La  La5  1  0.01373297  0.48626703  0.75000000  1.0
  La  La6  1  0.47876336  0.23776881  0.47014144  1.0
  La  La7  1  0.26223119  0.02123664  0.02985856  1.0
  La  La8  1  0.75000000  0.23460687  0.26539313  1.0
  La  La9  1  0.75000000  0.01373297  0.48626703  1.0
  La  La10  1  0.47014144  0.47876336  0.23776881  1.0
  La  La11  1  0.02985856  0.26223119  0.02123664  1.0
  Ru  Ru12  1  0.25000000  0.25000000  0.25000000  1.0
  Pt  Pt13  1  0.49950599  0.00049401  0.25000000  1.0
  Pt  Pt14  1  0.25000000  0.49950599  0.00049401  1.0
  Pt  Pt15  1  0.00049401  0.25000000  0.49950599  1.0
  Br  Br16  1  0.25000000  0.99328371  0.50671629  1.0
  Br  Br17  1  0.51009596  0.50684724  0.75597082  1.0
  Br  Br18  1  0.25000000  0.75428483  0.74571517  1.0
  Br  Br19  1  0.98990404  0.74402918  0.99315276  1.0
  Br  Br20  1  0.99328371  0.50671629  0.25000000  1.0
  Br  Br21  1  0.74402918  0.99315276  0.98990404  1.0
  Br  Br22  1  0.75428483  0.74571517  0.25000000  1.0
  Br  Br23  1  0.50684724  0.75597082  0.51009596  1.0
  Br  Br24  1  0.50671629  0.25000000  0.99328371  1.0
  Br  Br25  1  0.75597082  0.51009596  0.50684724  1.0
  Br  Br26  1  0.74571517  0.25000000  0.75428483  1.0
  Br  Br27  1  0.99315276  0.98990404  0.74402918  1.0