# generated using pymatgen
data_Ti11Al(TcIr)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.36304624
_cell_length_b   6.16064939
_cell_length_c   13.08327226
_cell_angle_alpha   90.00001777
_cell_angle_beta   89.99981889
_cell_angle_gamma   90.00002214
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti11Al(TcIr)6
_chemical_formula_sum   'Ti11 Al1 Tc6 Ir6'
_cell_volume   351.66786773
_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  0.50000000  0.74778858  1.00000000  1.0
  Ti  Ti1  1  0.00002088  0.24950210  0.16207281  1.0
  Ti  Ti2  1  0.00001770  0.74980474  0.16566316  1.0
  Ti  Ti3  1  0.50001925  0.25158595  0.33184272  1.0
  Ti  Ti4  1  0.50001727  0.75132966  0.33254715  1.0
  Ti  Ti5  1  0.99999900  0.25007787  0.50000000  1.0
  Ti  Ti6  1  0.99999900  0.75017907  0.50000000  1.0
  Ti  Ti7  1  0.49998075  0.25158595  0.66815728  1.0
  Ti  Ti8  1  0.49998273  0.75132966  0.66745185  1.0
  Ti  Ti9  1  0.99997812  0.24950210  0.83792719  1.0
  Ti  Ti10  1  0.99998330  0.74980574  0.83433684  1.0
  Al  Al11  1  0.50000000  0.24801405  1.00000000  1.0
  Tc  Tc12  1  0.00000000  0.99360082  0.99999900  1.0
  Tc  Tc13  1  0.50001929  0.50107804  0.16829631  1.0
  Tc  Tc14  1  0.00001607  0.00153633  0.33324872  1.0
  Tc  Tc15  1  0.49999900  0.50051902  0.50000100  1.0
  Tc  Tc16  1  0.99998393  0.00153933  0.66675128  1.0
  Tc  Tc17  1  0.49997971  0.50107504  0.83170169  1.0
  Ir  Ir18  1  0.00000100  0.49784072  0.99999900  1.0
  Ir  Ir19  1  0.50001722  0.00015065  0.16685768  1.0
  Ir  Ir20  1  0.00001697  0.50056745  0.33337978  1.0
  Ir  Ir21  1  0.50000000  0.00087302  0.50000100  1.0
  Ir  Ir22  1  0.99998303  0.50056445  0.66662022  1.0
  Ir  Ir23  1  0.49998278  0.00015265  0.83314132  1.0