# generated using pymatgen
data_Tb16TmSc3Sn16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.94502588
_cell_length_b   8.07823024
_cell_length_c   15.44155646
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.02338170
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tb16TmSc3Sn16
_chemical_formula_sum   'Tb16 Tm1 Sc3 Sn16'
_cell_volume   991.06600809
_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
  Tb  Tb0  1  0.36876292  0.84022943  0.87735043  1.0
  Tb  Tb1  1  0.86928988  0.65957184  0.62218657  1.0
  Tb  Tb2  1  0.63134264  0.16061219  0.37860039  1.0
  Tb  Tb3  1  0.13073540  0.34074401  0.12143990  1.0
  Tb  Tb4  1  0.63134264  0.16061219  0.12139961  1.0
  Tb  Tb5  1  0.13073540  0.34074401  0.37856010  1.0
  Tb  Tb6  1  0.36876292  0.84022943  0.62264957  1.0
  Tb  Tb7  1  0.86928988  0.65957184  0.87781343  1.0
  Tb  Tb8  1  0.52590193  0.31995195  0.90145157  1.0
  Tb  Tb9  1  0.02531285  0.17914502  0.59862799  1.0
  Tb  Tb10  1  0.47539399  0.67883794  0.40227731  1.0
  Tb  Tb11  1  0.97418858  0.81997773  0.09813386  1.0
  Tb  Tb12  1  0.47539399  0.67883794  0.09772269  1.0
  Tb  Tb13  1  0.97418858  0.81997773  0.40186614  1.0
  Tb  Tb14  1  0.52590193  0.31995195  0.59854843  1.0
  Tb  Tb15  1  0.02531285  0.17914502  0.90137201  1.0
  Tm  Tm16  1  0.30105446  0.00425159  0.25000000  1.0
  Sc  Sc17  1  0.19899196  0.50431766  0.75000000  1.0
  Sc  Sc18  1  0.69878400  0.99603309  0.75000000  1.0
  Sc  Sc19  1  0.80114347  0.49597739  0.25000000  1.0
  Sn  Sn20  1  0.28943819  0.03474160  0.04295486  1.0
  Sn  Sn21  1  0.78968767  0.46635891  0.45524632  1.0
  Sn  Sn22  1  0.71040594  0.96566435  0.54533214  1.0
  Sn  Sn23  1  0.21093658  0.53365248  0.95460088  1.0
  Sn  Sn24  1  0.71040594  0.96566435  0.95466786  1.0
  Sn  Sn25  1  0.21093658  0.53365248  0.54539912  1.0
  Sn  Sn26  1  0.28943819  0.03474160  0.45704514  1.0
  Sn  Sn27  1  0.78968767  0.46635891  0.04475368  1.0
  Sn  Sn28  1  0.56223431  0.62026601  0.75000000  1.0
  Sn  Sn29  1  0.06129255  0.87978736  0.75000000  1.0
  Sn  Sn30  1  0.43961160  0.38192316  0.25000000  1.0
  Sn  Sn31  1  0.93373059  0.12400925  0.25000000  1.0
  Sn  Sn32  1  0.33441395  0.15422088  0.75000000  1.0
  Sn  Sn33  1  0.83330390  0.34595440  0.75000000  1.0
  Sn  Sn34  1  0.66953821  0.84487950  0.25000000  1.0
  Sn  Sn35  1  0.16310683  0.64940883  0.25000000  1.0