# generated using pymatgen
data_Ti6AlTc3Ru2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.36023717
_cell_length_b   6.22089028
_cell_length_c   13.15606995
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti6AlTc3Ru2
_chemical_formula_sum   'Ti12 Al2 Tc6 Ru4'
_cell_volume   356.85256981
_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  0.49998617  0.24594704  0.00607150  1.0
  Ti  Ti1  1  0.49998617  0.75405296  0.00607150  1.0
  Ti  Ti2  1  0.99988468  0.25001877  0.16805397  1.0
  Ti  Ti3  1  0.99988468  0.74998123  0.16805397  1.0
  Ti  Ti4  1  0.49988668  0.24998123  0.33194603  1.0
  Ti  Ti5  1  0.49988668  0.75001877  0.33194603  1.0
  Ti  Ti6  1  0.99998517  0.25405196  0.49392850  1.0
  Ti  Ti7  1  0.99998517  0.74594804  0.49392850  1.0
  Ti  Ti8  1  0.50015986  0.25851222  0.66052623  1.0
  Ti  Ti9  1  0.50015986  0.74148778  0.66052623  1.0
  Ti  Ti10  1  0.00016086  0.24148778  0.83947477  1.0
  Ti  Ti11  1  0.00016086  0.75851222  0.83947477  1.0
  Al  Al12  1  0.00021392  0.00000000  0.66529476  1.0
  Al  Al13  1  0.50021192  0.49999900  0.83470424  1.0
  Tc  Tc14  1  0.99995118  0.49999900  0.99636922  1.0
  Tc  Tc15  1  0.49985197  0.00000000  0.16806444  1.0
  Tc  Tc16  1  0.99985297  0.49999900  0.33193456  1.0
  Tc  Tc17  1  0.49995218  0.00000000  0.50363078  1.0
  Tc  Tc18  1  0.00010406  0.49999900  0.67037581  1.0
  Tc  Tc19  1  0.50010306  0.00000000  0.82962319  1.0
  Ru  Ru20  1  0.99995474  0.00000000  0.00105366  1.0
  Ru  Ru21  1  0.49985771  0.49999900  0.16616069  1.0
  Ru  Ru22  1  0.99985871  0.00000000  0.33383931  1.0
  Ru  Ru23  1  0.49995574  0.49999900  0.49894634  1.0