# generated using pymatgen
data_YTiSi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.01804628
_cell_length_b   4.01804628
_cell_length_c   7.68723114
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YTiSi
_chemical_formula_sum   'Y2 Ti2 Si2'
_cell_volume   124.10800913
_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
  Y  Y0  1  0.75000000  0.75000000  0.34947918  1.0
  Y  Y1  1  0.25000000  0.25000000  0.65052082  1.0
  Ti  Ti2  1  0.75000000  0.25000000  0.00000000  1.0
  Ti  Ti3  1  0.25000000  0.75000000  0.00000000  1.0
  Si  Si4  1  0.75000000  0.75000000  0.76544462  1.0
  Si  Si5  1  0.25000000  0.25000000  0.23455538  1.0