# generated using pymatgen
data_Sc2SnMoRu4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.48420682
_cell_length_b   6.32744359
_cell_length_c   13.41732305
_cell_angle_alpha   90.00000000
_cell_angle_beta   89.99953941
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc2SnMoRu4
_chemical_formula_sum   'Sc6 Sn3 Mo3 Ru12'
_cell_volume   380.69729740
_cell_formula_units_Z   3
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
  Sc  Sc0  1  0.99999047  0.00000000  0.99984873  1.0
  Sc  Sc1  1  0.49994940  0.50000100  0.16663912  1.0
  Sc  Sc2  1  0.99994401  0.00000000  0.33346033  1.0
  Sc  Sc3  1  0.49999992  0.50000100  0.50228881  1.0
  Sc  Sc4  1  0.00006193  0.00000000  0.66669427  1.0
  Sc  Sc5  1  0.50004865  0.50000100  0.83108552  1.0
  Sn  Sn6  1  0.49999985  0.00000000  0.50088679  1.0
  Sn  Sn7  1  0.00006219  0.50000100  0.66668340  1.0
  Sn  Sn8  1  0.50004837  0.00000000  0.83246741  1.0
  Mo  Mo9  1  0.99999484  0.50000100  0.99978459  1.0
  Mo  Mo10  1  0.49995256  0.00000000  0.16664022  1.0
  Mo  Mo11  1  0.99995583  0.50000100  0.33353539  1.0
  Ru  Ru12  1  0.49999061  0.25384278  0.00720780  1.0
  Ru  Ru13  1  0.49999061  0.74615722  0.00720780  1.0
  Ru  Ru14  1  0.99994569  0.25017414  0.16663530  1.0
  Ru  Ru15  1  0.99994569  0.74982586  0.16663530  1.0
  Ru  Ru16  1  0.49994220  0.25384987  0.32609321  1.0
  Ru  Ru17  1  0.49994220  0.74614913  0.32609321  1.0
  Ru  Ru18  1  0.99999624  0.25884251  0.48861199  1.0
  Ru  Ru19  1  0.99999624  0.74116049  0.48861199  1.0
  Ru  Ru20  1  0.50007237  0.24973938  0.66669610  1.0
  Ru  Ru21  1  0.50007237  0.75025962  0.66669610  1.0
  Ru  Ru22  1  0.00004688  0.25885186  0.84474631  1.0
  Ru  Ru23  1  0.00004688  0.74114814  0.84474631  1.0