# generated using pymatgen
data_LiTiSiO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.06650852
_cell_length_b   5.06650852
_cell_length_c   5.97964700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   112.00465447
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTiSiO4
_chemical_formula_sum   'Li2 Ti2 Si2 O8'
_cell_volume   142.31304345
_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
  Li  Li0  1  0.66292500  0.33707500  0.25000000  1
  Li  Li1  1  0.33707500  0.66292500  0.75000000  1
  Ti  Ti2  1  0.00000000  0.00000000  0.00000000  1
  Ti  Ti3  1  0.00000000  0.00000000  0.50000000  1
  Si  Si4  1  0.65150100  0.34849900  0.75000000  1
  Si  Si5  1  0.34849900  0.65150100  0.25000000  1
  O  O6  1  0.24085100  0.29593600  0.25000000  1
  O  O7  1  0.29593600  0.24085100  0.75000000  1
  O  O8  1  0.76567600  0.23432400  0.53040300  1
  O  O9  1  0.23432400  0.76567600  0.03040300  1
  O  O10  1  0.76567600  0.23432400  0.96959700  1
  O  O11  1  0.23432400  0.76567600  0.46959700  1
  O  O12  1  0.75914900  0.70406400  0.75000000  1
  O  O13  1  0.70406400  0.75914900  0.25000000  1
