# generated using pymatgen
data_LiTiV3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.83686002
_cell_length_b   5.82498090
_cell_length_c   6.08351665
_cell_angle_alpha   61.39674219
_cell_angle_beta   90.48614181
_cell_angle_gamma   119.94626645
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTiV3O8
_chemical_formula_sum   'Li1 Ti1 V3 O8'
_cell_volume   149.95355067
_cell_formula_units_Z   1
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  0.49998900  0.49999400  0.50000200  1
  Ti  Ti1  1  0.00000700  0.99999200  0.00001600  1
  V  V2  1  0.99999500  0.50000200  0.99999900  1
  V  V3  1  0.50002400  0.50002300  0.99999200  1
  V  V4  1  0.50001300  0.00001000  0.99999500  1
  O  O5  1  0.76386900  0.53323100  0.20458000  1
  O  O6  1  0.27292200  0.53433500  0.20520400  1
  O  O7  1  0.76404100  0.02679900  0.20409000  1
  O  O8  1  0.27395500  0.03937200  0.19651000  1
  O  O9  1  0.72604200  0.96062300  0.80349000  1
  O  O10  1  0.23594700  0.97319100  0.79591600  1
  O  O11  1  0.72707700  0.46566300  0.79478700  1
  O  O12  1  0.23612000  0.46676400  0.79541900  1
