# generated using pymatgen
data_Ti3(NbSi2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.67977046
_cell_length_b   6.66447855
_cell_length_c   6.48685576
_cell_angle_alpha   90.00000000
_cell_angle_beta   109.14634965
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti3(NbSi2)2
_chemical_formula_sum   'Ti6 Nb4 Si8'
_cell_volume   272.80257690
_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  0.50000000  0.50000000  0.00000000  1.0
  Ti  Ti1  1  0.74998607  0.17778935  0.25541207  1.0
  Ti  Ti2  1  0.25001493  0.67779035  0.24458893  1.0
  Ti  Ti3  1  0.50000000  0.00000000  0.49999900  1.0
  Ti  Ti4  1  0.74998607  0.32221065  0.75541207  1.0
  Ti  Ti5  1  0.25001393  0.82221065  0.74458793  1.0
  Nb  Nb6  1  0.18909683  0.17191201  0.05736490  1.0
  Nb  Nb7  1  0.81090317  0.67191201  0.44263510  1.0
  Nb  Nb8  1  0.18909683  0.32808799  0.55736590  1.0
  Nb  Nb9  1  0.81090317  0.82808699  0.94263510  1.0
  Si  Si10  1  0.92606199  0.46557728  0.14815890  1.0
  Si  Si11  1  0.51164218  0.87352175  0.13134026  1.0
  Si  Si12  1  0.48835782  0.37352175  0.36865974  1.0
  Si  Si13  1  0.07393801  0.96557728  0.35184110  1.0
  Si  Si14  1  0.92606199  0.03442272  0.64815790  1.0
  Si  Si15  1  0.51164318  0.62647925  0.63134026  1.0
  Si  Si16  1  0.48835782  0.12647925  0.86865874  1.0
  Si  Si17  1  0.07393701  0.53442272  0.85184210  1.0