# generated using pymatgen
data_TbScB6Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.56785445
_cell_length_b   8.96942615
_cell_length_c   11.34839335
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TbScB6Ru
_chemical_formula_sum   'Tb4 Sc4 B24 Ru4'
_cell_volume   363.16682414
_cell_formula_units_Z   4
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  0.00000000  0.82064320  0.08553098  1.0
  Tb  Tb1  1  0.00000000  0.17935680  0.91446902  1.0
  Tb  Tb2  1  0.00000000  0.32064320  0.41446902  1.0
  Tb  Tb3  1  0.00000000  0.67935680  0.58553098  1.0
  Sc  Sc4  1  0.00000000  0.44519113  0.12647160  1.0
  Sc  Sc5  1  0.00000000  0.55480887  0.87352840  1.0
  Sc  Sc6  1  0.00000000  0.94519113  0.37352840  1.0
  Sc  Sc7  1  0.00000000  0.05480887  0.62647160  1.0
  B  B8  1  0.50000000  0.05569080  0.06801640  1.0
  B  B9  1  0.50000000  0.94430920  0.93198360  1.0
  B  B10  1  0.50000000  0.55569080  0.43198360  1.0
  B  B11  1  0.50000000  0.44430920  0.56801640  1.0
  B  B12  1  0.50000000  0.25297239  0.08194972  1.0
  B  B13  1  0.50000000  0.74702761  0.91805028  1.0
  B  B14  1  0.50000000  0.75297239  0.41805028  1.0
  B  B15  1  0.50000000  0.24702761  0.58194972  1.0
  B  B16  1  0.50000000  0.29350064  0.23495903  1.0
  B  B17  1  0.50000000  0.70649936  0.76504097  1.0
  B  B18  1  0.50000000  0.79350064  0.26504097  1.0
  B  B19  1  0.50000000  0.20649936  0.73495903  1.0
  B  B20  1  0.50000000  0.12929400  0.31724281  1.0
  B  B21  1  0.50000000  0.87070600  0.68275719  1.0
  B  B22  1  0.50000000  0.62929400  0.18275719  1.0
  B  B23  1  0.50000000  0.37070600  0.81724281  1.0
  B  B24  1  0.50000000  0.48289415  0.28532742  1.0
  B  B25  1  0.50000000  0.51710585  0.71467258  1.0
  B  B26  1  0.50000000  0.98289415  0.21467258  1.0
  B  B27  1  0.50000000  0.01710585  0.78532742  1.0
  B  B28  1  0.50000000  0.09991863  0.47316857  1.0
  B  B29  1  0.50000000  0.90008137  0.52683143  1.0
  B  B30  1  0.50000000  0.59991863  0.02683143  1.0
  B  B31  1  0.50000000  0.40008137  0.97316857  1.0
  Ru  Ru32  1  0.00000000  0.14043570  0.18162531  1.0
  Ru  Ru33  1  0.00000000  0.85956430  0.81837469  1.0
  Ru  Ru34  1  0.00000000  0.64043570  0.31837469  1.0
  Ru  Ru35  1  0.00000000  0.35956430  0.68162531  1.0