# generated using pymatgen
data_Tm16Sc4(IrRh3)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.58308220
_cell_length_b   10.58308220
_cell_length_c   6.17983686
_cell_angle_alpha   90.02270165
_cell_angle_beta   90.02270165
_cell_angle_gamma   89.91714150
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tm16Sc4(IrRh3)3
_chemical_formula_sum   'Tm16 Sc4 Ir3 Rh9'
_cell_volume   692.15096177
_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
  Tm  Tm0  1  0.28815178  0.08725039  0.38059141  1.0
  Tm  Tm1  1  0.28800635  0.91211410  0.88038293  1.0
  Tm  Tm2  1  0.71185829  0.08584660  0.87951532  1.0
  Tm  Tm3  1  0.71176883  0.91224416  0.37959968  1.0
  Tm  Tm4  1  0.58438649  0.78654268  0.88020598  1.0
  Tm  Tm5  1  0.58478300  0.21252005  0.37938151  1.0
  Tm  Tm6  1  0.41529744  0.78698089  0.37912824  1.0
  Tm  Tm7  1  0.41307515  0.21227794  0.87964069  1.0
  Tm  Tm8  1  0.21345732  0.41561351  0.61979402  1.0
  Tm  Tm9  1  0.21301911  0.58470256  0.12087176  1.0
  Tm  Tm10  1  0.78747995  0.41521700  0.12061849  1.0
  Tm  Tm11  1  0.78772206  0.58692485  0.62035931  1.0
  Tm  Tm12  1  0.91274961  0.71184822  0.11940859  1.0
  Tm  Tm13  1  0.91415340  0.28814171  0.62048468  1.0
  Tm  Tm14  1  0.08788590  0.71199365  0.61961707  1.0
  Tm  Tm15  1  0.08775584  0.28823117  0.12040032  1.0
  Sc  Sc16  1  0.99950687  0.00025921  0.49967718  1.0
  Sc  Sc17  1  0.99974079  0.00049313  0.00032282  1.0
  Sc  Sc18  1  0.49949167  0.49970106  0.00017651  1.0
  Sc  Sc19  1  0.50029894  0.50050833  0.49982349  1.0
  Ir  Ir20  1  0.65147644  0.64983668  0.24940717  1.0
  Ir  Ir21  1  0.35016332  0.34852356  0.25059283  1.0
  Ir  Ir22  1  0.34905391  0.65094609  0.75000000  1.0
  Rh  Rh23  1  0.84924200  0.15075800  0.25000000  1.0
  Rh  Rh24  1  0.85032618  0.85095951  0.75005304  1.0
  Rh  Rh25  1  0.14904049  0.14967382  0.74994696  1.0
  Rh  Rh26  1  0.14938661  0.85061339  0.25000000  1.0
  Rh  Rh27  1  0.65166769  0.34833231  0.75000000  1.0
  Rh  Rh28  1  0.50007367  0.00063335  0.12752354  1.0
  Rh  Rh29  1  0.50019325  0.00057999  0.62824453  1.0
  Rh  Rh30  1  0.99942001  0.49980675  0.87175547  1.0
  Rh  Rh31  1  0.99936665  0.49992633  0.37247646  1.0