# generated using pymatgen
data_Ti12Tc6SnRu5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.36596558
_cell_length_b   6.24544458
_cell_length_c   13.15093633
_cell_angle_alpha   90.00000000
_cell_angle_beta   89.99939680
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti12Tc6SnRu5
_chemical_formula_sum   'Ti12 Tc6 Sn1 Ru5'
_cell_volume   358.59178961
_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  0.49999407  0.23001091  0.00000201  1.0
  Ti  Ti1  1  0.49999407  0.76998809  0.00000201  1.0
  Ti  Ti2  1  0.00001655  0.24310713  0.17593974  1.0
  Ti  Ti3  1  0.00001655  0.75689187  0.17593974  1.0
  Ti  Ti4  1  0.50000891  0.25058152  0.33602914  1.0
  Ti  Ti5  1  0.50000891  0.74941848  0.33602914  1.0
  Ti  Ti6  1  0.99998890  0.25045231  0.50000259  1.0
  Ti  Ti7  1  0.99998890  0.74954869  0.50000259  1.0
  Ti  Ti8  1  0.49997197  0.25058335  0.66397329  1.0
  Ti  Ti9  1  0.49997197  0.74941665  0.66397329  1.0
  Ti  Ti10  1  0.99996646  0.24310224  0.82405287  1.0
  Ti  Ti11  1  0.99996646  0.75689676  0.82405287  1.0
  Tc  Tc12  1  0.99999663  0.00000000  0.99999896  1.0
  Tc  Tc13  1  0.50001890  0.50000000  0.16467544  1.0
  Tc  Tc14  1  0.00000704  0.00000000  0.33561808  1.0
  Tc  Tc15  1  0.49999177  0.50000000  0.50000441  1.0
  Tc  Tc16  1  0.99997714  0.00000000  0.66438577  1.0
  Tc  Tc17  1  0.49996446  0.50000000  0.83532031  1.0
  Sn  Sn18  1  0.99999570  0.50000000  0.99999056  1.0
  Ru  Ru19  1  0.50001197  0.00000000  0.16875877  1.0
  Ru  Ru20  1  0.00001205  0.50000000  0.33395778  1.0
  Ru  Ru21  1  0.49999046  0.00000000  0.50000575  1.0
  Ru  Ru22  1  0.99996686  0.50000000  0.66604468  1.0
  Ru  Ru23  1  0.49997228  0.00000000  0.83124025  1.0