# generated using pymatgen
data_Ti3Si
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.63132404
_cell_length_b   5.63133894
_cell_length_c   4.50545247
_cell_angle_alpha   89.99999941
_cell_angle_beta   90.00000036
_cell_angle_gamma   120.00033305
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti3Si
_chemical_formula_sum   'Ti6 Si2'
_cell_volume   123.73420503
_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  0.17179925  0.34359775  0.24999998  1.0
  Ti  Ti1  1  0.65640251  0.82820185  0.25000000  1.0
  Ti  Ti2  1  0.17179937  0.82820215  0.25000002  1.0
  Ti  Ti3  1  0.82820138  0.65640412  0.75000004  1.0
  Ti  Ti4  1  0.34359570  0.17179755  0.74999999  1.0
  Ti  Ti5  1  0.82820127  0.17179700  0.74999997  1.0
  Si  Si6  1  0.66666979  0.33333486  0.25000000  1.0
  Si  Si7  1  0.33333272  0.66666672  0.75000000  1.0