# generated using pymatgen
data_LiTiSiO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.73159000
_cell_length_b   5.73159000
_cell_length_c   8.16904800
_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   268.36240822
_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  0.00000000  0.22107800  0.00000000  1
  Li  Li1  1  0.00000000  0.77892200  0.50000000  1
  Li  Li2  1  0.22107800  0.00000000  0.25000000  1
  Li  Li3  1  0.77892200  0.00000000  0.75000000  1
  Ti  Ti4  1  0.24386600  0.50000000  0.25000000  1
  Ti  Ti5  1  0.50000000  0.24386600  0.00000000  1
  Ti  Ti6  1  0.50000000  0.75613400  0.50000000  1
  Ti  Ti7  1  0.75613400  0.50000000  0.75000000  1
  Si  Si8  1  0.24830400  0.24830400  0.62500000  1
  Si  Si9  1  0.24830400  0.75169600  0.87500000  1
  Si  Si10  1  0.75169600  0.24830400  0.37500000  1
  Si  Si11  1  0.75169600  0.75169600  0.12500000  1
  O  O12  1  0.98928600  0.25790900  0.26090400  1
  O  O13  1  0.98928600  0.74209100  0.23909600  1
  O  O14  1  0.25790900  0.98928600  0.98909600  1
  O  O15  1  0.25790900  0.01071400  0.51090400  1
  O  O16  1  0.25623800  0.51341300  0.99448900  1
  O  O17  1  0.25623800  0.48658700  0.50551100  1
  O  O18  1  0.51341300  0.25623800  0.25551100  1
  O  O19  1  0.51341300  0.74376200  0.24448900  1
  O  O20  1  0.48658700  0.25623800  0.74448900  1
  O  O21  1  0.48658700  0.74376200  0.75551100  1
  O  O22  1  0.74376200  0.48658700  0.49448900  1
  O  O23  1  0.74376200  0.51341300  0.00551100  1
  O  O24  1  0.74209100  0.01071400  0.48909600  1
  O  O25  1  0.74209100  0.98928600  0.01090400  1
  O  O26  1  0.01071400  0.25790900  0.73909600  1
  O  O27  1  0.01071400  0.74209100  0.76090400  1
