# generated using pymatgen
data_TmTh8Se17
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.50200451
_cell_length_b   8.50200392
_cell_length_c   11.38232918
_cell_angle_alpha   80.06826612
_cell_angle_beta   80.06826577
_cell_angle_gamma   64.77581098
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TmTh8Se17
_chemical_formula_sum   'Tm1 Th8 Se17'
_cell_volume   728.61806983
_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  0.00000000  0.00000000  0.00000000  1.0
  Th  Th1  1  0.18493896  0.69596766  0.70038405  1.0
  Th  Th2  1  0.69596766  0.18493896  0.70038405  1.0
  Th  Th3  1  0.81506104  0.30403234  0.29961595  1.0
  Th  Th4  1  0.30403234  0.81506104  0.29961595  1.0
  Th  Th5  1  0.79321793  0.79321793  0.45931627  1.0
  Th  Th6  1  0.20678207  0.20678207  0.54068373  1.0
  Th  Th7  1  0.31988688  0.31988688  0.01880548  1.0
  Th  Th8  1  0.68011312  0.68011312  0.98119452  1.0
  Se  Se9  1  0.17702718  0.56957725  0.46750269  1.0
  Se  Se10  1  0.56957725  0.17702718  0.46750269  1.0
  Se  Se11  1  0.82297282  0.43042275  0.53249731  1.0
  Se  Se12  1  0.43042275  0.82297282  0.53249731  1.0
  Se  Se13  1  0.05576461  0.66867685  0.96223497  1.0
  Se  Se14  1  0.66867685  0.05576461  0.96223497  1.0
  Se  Se15  1  0.94423539  0.33132315  0.03776503  1.0
  Se  Se16  1  0.33132315  0.94423539  0.03776503  1.0
  Se  Se17  1  0.78980235  0.78980235  0.72123155  1.0
  Se  Se18  1  0.21019765  0.21019765  0.27876845  1.0
  Se  Se19  1  0.93832905  0.93832905  0.23727506  1.0
  Se  Se20  1  0.06167095  0.06167095  0.76272494  1.0
  Se  Se21  1  0.69579407  0.69579407  0.24697463  1.0
  Se  Se22  1  0.30420593  0.30420593  0.75302537  1.0
  Se  Se23  1  0.48089152  0.48089152  0.16630310  1.0
  Se  Se24  1  0.51910848  0.51910848  0.83369690  1.0
  Se  Se25  1  0.00000000  0.00000000  0.50000000  1.0