# generated using pymatgen
data_TiGeRu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.27514131
_cell_length_b   4.27594961
_cell_length_c   4.27454267
_cell_angle_alpha   59.99190532
_cell_angle_beta   59.98962574
_cell_angle_gamma   59.99106318
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiGeRu2
_chemical_formula_sum   'Ti1 Ge1 Ru2'
_cell_volume   55.24179051
_cell_formula_units_Z   1
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  0.75001862  0.74999995  0.74999955  1.0
  Ge  Ge1  1  0.25001503  0.25000971  0.24997420  1.0
  Ru  Ru2  1  0.00000472  -0.00000392  -0.00003071  1.0
  Ru  Ru3  1  0.49996063  0.49999825  0.50005896  1.0