# generated using pymatgen
data_Ti6NbRe12Mo5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.41404932
_cell_length_b   6.25300343
_cell_length_c   13.23876098
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00031149
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti6NbRe12Mo5
_chemical_formula_sum   'Ti6 Nb1 Re12 Mo5'
_cell_volume   365.40390919
_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  0.00000000  0.50000000  0.00000000  1.0
  Ti  Ti1  1  0.49995917  0.00000000  0.16742536  1.0
  Ti  Ti2  1  0.99995605  0.50000000  0.33347629  1.0
  Ti  Ti3  1  0.50000000  0.00000000  0.50000000  1.0
  Ti  Ti4  1  0.00004295  0.50000000  0.66652371  1.0
  Ti  Ti5  1  0.50004083  0.00000000  0.83257564  1.0
  Nb  Nb6  1  0.00000000  0.00000000  0.00000000  1.0
  Re  Re7  1  0.50000000  0.25431589  0.00000000  1.0
  Re  Re8  1  0.50000000  0.74568411  0.00000000  1.0
  Re  Re9  1  0.99995784  0.25188311  0.16928908  1.0
  Re  Re10  1  0.99995784  0.74811589  0.16928908  1.0
  Re  Re11  1  0.49996576  0.24995047  0.33420287  1.0
  Re  Re12  1  0.49996576  0.75004953  0.33420287  1.0
  Re  Re13  1  0.00000000  0.25040327  0.50000000  1.0
  Re  Re14  1  0.00000000  0.74959673  0.50000000  1.0
  Re  Re15  1  0.50003424  0.24995047  0.66579713  1.0
  Re  Re16  1  0.50003424  0.75004953  0.66579713  1.0
  Re  Re17  1  0.00004216  0.25188311  0.83071092  1.0
  Re  Re18  1  0.00004216  0.74811589  0.83071092  1.0
  Mo  Mo19  1  0.49995956  0.50000000  0.16713834  1.0
  Mo  Mo20  1  0.99996129  0.00000000  0.33381734  1.0
  Mo  Mo21  1  0.50000000  0.50000000  0.50000000  1.0
  Mo  Mo22  1  0.00003871  0.00000000  0.66618266  1.0
  Mo  Mo23  1  0.50004044  0.50000000  0.83286166  1.0