# generated using pymatgen
data_ScBe4MoRu5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.13257873
_cell_length_b   8.56081960
_cell_length_c   10.01487568
_cell_angle_alpha   90.00401049
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScBe4MoRu5
_chemical_formula_sum   'Sc2 Be8 Mo2 Ru10'
_cell_volume   268.57334095
_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
  Sc  Sc0  1  0.50000000  0.65600379  0.68110723  1.0
  Sc  Sc1  1  0.50000000  0.34399621  0.31889277  1.0
  Be  Be2  1  0.50000000  0.96047621  0.59407625  1.0
  Be  Be3  1  0.50000000  0.03952379  0.40592375  1.0
  Be  Be4  1  0.50000000  0.84207383  0.90549554  1.0
  Be  Be5  1  0.50000000  0.15792617  0.09450446  1.0
  Be  Be6  1  0.50000000  0.65931315  0.40470881  1.0
  Be  Be7  1  0.50000000  0.34068685  0.59529119  1.0
  Be  Be8  1  0.50000000  0.46011492  0.90587232  1.0
  Be  Be9  1  0.50000000  0.53988508  0.09412768  1.0
  Mo  Mo10  1  0.50000000  0.84654547  0.18630494  1.0
  Mo  Mo11  1  0.50000000  0.15345453  0.81369506  1.0
  Ru  Ru12  1  0.00000000  0.65943602  0.95210149  1.0
  Ru  Ru13  1  0.00000000  0.34056398  0.04789851  1.0
  Ru  Ru14  1  0.00000000  0.84335151  0.44857890  1.0
  Ru  Ru15  1  0.00000000  0.15664849  0.55142110  1.0
  Ru  Ru16  1  0.00000000  0.00000000  0.00000000  1.0
  Ru  Ru17  1  0.00000000  0.38298507  0.76156324  1.0
  Ru  Ru18  1  0.00000000  0.61701493  0.23843676  1.0
  Ru  Ru19  1  0.00000000  0.50000000  0.50000000  1.0
  Ru  Ru20  1  0.00000000  0.91331659  0.74516408  1.0
  Ru  Ru21  1  0.00000000  0.08668341  0.25483592  1.0