# generated using pymatgen
data_Ti3BeGe2Ru3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.70623674
_cell_length_b   6.33397508
_cell_length_c   7.41641898
_cell_angle_alpha   115.27830228
_cell_angle_beta   116.88295648
_cell_angle_gamma   89.99953724
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti3BeGe2Ru3
_chemical_formula_sum   'Ti6 Be2 Ge4 Ru6'
_cell_volume   246.69019349
_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
  Ti  Ti0  1  0.24671844  0.44459277  0.38917939  1.0
  Ti  Ti1  1  0.85751503  0.55539273  0.61077349  1.0
  Ti  Ti2  1  0.63532455  0.74981701  0.99962072  1.0
  Ti  Ti3  1  0.63570436  0.25017736  0.00035858  1.0
  Ti  Ti4  1  0.85818744  0.05573418  0.61146630  1.0
  Ti  Ti5  1  0.24670777  0.94426188  0.38850482  1.0
  Be  Be6  1  0.24666457  0.25009002  0.00022086  1.0
  Be  Be7  1  0.24643290  0.74989774  0.99986185  1.0
  Ge  Ge8  1  0.58004146  0.83361085  0.66665554  1.0
  Ge  Ge9  1  0.91339506  0.16638435  0.33333347  1.0
  Ge  Ge10  1  0.91338981  0.66695055  0.33332416  1.0
  Ge  Ge11  1  0.58004768  0.33305047  0.66666489  1.0
  Ru  Ru12  1  0.00032226  0.99998607  0.99998645  1.0
  Ru  Ru13  1  0.00032199  0.49997876  0.99998615  1.0
  Ru  Ru14  1  0.49307754  0.62330124  0.24636556  1.0
  Ru  Ru15  1  0.24673658  0.37674724  0.75366796  1.0
  Ru  Ru16  1  0.24673280  0.87693979  0.75366791  1.0
  Ru  Ru17  1  0.49307676  0.12308699  0.24636188  1.0