# generated using pymatgen
data_Th3Sc2OsRu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.13940538
_cell_length_b   8.16484371
_cell_length_c   8.16484353
_cell_angle_alpha   119.45515927
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th3Sc2OsRu2
_chemical_formula_sum   'Th6 Sc4 Os2 Ru4'
_cell_volume   356.37805346
_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
  Th  Th0  1  0.75000000  0.74931602  0.74931602  1.0
  Th  Th1  1  0.25000000  0.25068398  0.25068398  1.0
  Th  Th2  1  0.75000000  0.99815530  0.25991856  1.0
  Th  Th3  1  0.25000000  0.00184470  0.74008144  1.0
  Th  Th4  1  0.75000000  0.25991856  0.99815530  1.0
  Th  Th5  1  0.25000000  0.74008144  0.00184470  1.0
  Sc  Sc6  1  0.00000000  0.66190990  0.33809010  1.0
  Sc  Sc7  1  0.00000000  0.33809010  0.66190990  1.0
  Sc  Sc8  1  0.50000000  0.33809010  0.66190990  1.0
  Sc  Sc9  1  0.50000000  0.66190990  0.33809010  1.0
  Os  Os10  1  0.75000000  0.39240507  0.39240507  1.0
  Os  Os11  1  0.25000000  0.60759493  0.60759493  1.0
  Ru  Ru12  1  0.75000000  0.00223080  0.61703202  1.0
  Ru  Ru13  1  0.25000000  0.99776920  0.38296798  1.0
  Ru  Ru14  1  0.75000000  0.61703202  0.00223080  1.0
  Ru  Ru15  1  0.25000000  0.38296798  0.99776920  1.0