# generated using pymatgen
data_LiTiSiO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.98098000
_cell_length_b   6.10274900
_cell_length_c   9.36038700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTiSiO4
_chemical_formula_sum   'Li4 Ti4 Si4 O16'
_cell_volume   284.53396178
_cell_formula_units_Z   4
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  0.48025000  0.75000000  0.16962600  1
  Li  Li1  1  0.98025000  0.25000000  0.33037400  1
  Li  Li2  1  0.01975000  0.75000000  0.66962600  1
  Li  Li3  1  0.51975000  0.25000000  0.83037400  1
  Ti  Ti4  1  0.00000000  0.00000000  0.00000000  1
  Ti  Ti5  1  0.00000000  0.50000000  0.00000000  1
  Ti  Ti6  1  0.50000000  0.00000000  0.50000000  1
  Ti  Ti7  1  0.50000000  0.50000000  0.50000000  1
  Si  Si8  1  0.47543100  0.25000000  0.17756200  1
  Si  Si9  1  0.97543100  0.75000000  0.32243800  1
  Si  Si10  1  0.02456900  0.25000000  0.67756200  1
  Si  Si11  1  0.52456900  0.75000000  0.82243800  1
  O  O12  1  0.79842700  0.25000000  0.12907600  1
  O  O13  1  0.32792200  0.03149500  0.11553500  1
  O  O14  1  0.32792200  0.46850500  0.11553500  1
  O  O15  1  0.90132600  0.75000000  0.14717500  1
  O  O16  1  0.40132600  0.25000000  0.35282500  1
  O  O17  1  0.82792200  0.96850500  0.38446500  1
  O  O18  1  0.82792200  0.53149500  0.38446500  1
  O  O19  1  0.29842700  0.75000000  0.37092400  1
  O  O20  1  0.70157300  0.25000000  0.62907600  1
  O  O21  1  0.17207800  0.03149500  0.61553500  1
  O  O22  1  0.17207800  0.46850500  0.61553500  1
  O  O23  1  0.59867400  0.75000000  0.64717500  1
  O  O24  1  0.09867400  0.25000000  0.85282500  1
  O  O25  1  0.67207800  0.53149500  0.88446500  1
  O  O26  1  0.67207800  0.96850500  0.88446500  1
  O  O27  1  0.20157300  0.75000000  0.87092400  1
