# generated using pymatgen
data_SmTh(TcB2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.28119231
_cell_length_b   6.28119150
_cell_length_c   7.60208289
_cell_angle_alpha   89.26592525
_cell_angle_beta   89.26591792
_cell_angle_gamma   114.68162008
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SmTh(TcB2)3
_chemical_formula_sum   'Sm2 Th2 Tc6 B12'
_cell_volume   272.45023648
_cell_formula_units_Z   2
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
  Sm  Sm0  1  0.56143037  0.90371335  0.82087095  1.0
  Sm  Sm1  1  0.09628665  0.43856963  0.67912905  1.0
  Th  Th2  1  0.43818342  0.09221861  0.17180880  1.0
  Th  Th3  1  0.90778139  0.56181658  0.32819120  1.0
  Tc  Tc4  1  0.80305267  0.98884401  0.41159628  1.0
  Tc  Tc5  1  0.01115599  0.19694733  0.08840372  1.0
  Tc  Tc6  1  0.19564199  0.00998172  0.58761758  1.0
  Tc  Tc7  1  0.99001828  0.80435801  0.91238242  1.0
  Tc  Tc8  1  0.41393836  0.58606164  0.25000000  1.0
  Tc  Tc9  1  0.58613578  0.41386422  0.75000000  1.0
  B  B10  1  0.14952467  0.24464943  0.37214016  1.0
  B  B11  1  0.75535057  0.85047533  0.12785984  1.0
  B  B12  1  0.84836528  0.75726402  0.63438948  1.0
  B  B13  1  0.24273598  0.15163472  0.86561052  1.0
  B  B14  1  0.15974570  0.58355850  0.01639453  1.0
  B  B15  1  0.41644150  0.84025430  0.48360547  1.0
  B  B16  1  0.84107903  0.41831613  0.98026516  1.0
  B  B17  1  0.58168387  0.15892097  0.51973484  1.0
  B  B18  1  0.35040384  0.44237732  0.96613161  1.0
  B  B19  1  0.55762268  0.64959616  0.53386839  1.0
  B  B20  1  0.65084696  0.55742600  0.03160323  1.0
  B  B21  1  0.44257400  0.34915304  0.46839677  1.0