# generated using pymatgen
data_LiTiVO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.92316602
_cell_length_b   6.00438888
_cell_length_c   8.45471631
_cell_angle_alpha   90.00001939
_cell_angle_beta   89.99999425
_cell_angle_gamma   90.05721047
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTiVO4
_chemical_formula_sum   'Li4 Ti4 V4 O16'
_cell_volume   300.69176991
_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  0.49999700  0.00000000  1
  Li  Li1  1  0.50000000  0.00000400  0.50000000  1
  Li  Li2  1  0.50000000  0.49999700  0.00000000  1
  Li  Li3  1  0.00000000  0.00000400  0.50000000  1
  Ti  Ti4  1  0.50000000  0.00005200  0.00000000  1
  Ti  Ti5  1  0.00000000  0.49994900  0.50000000  1
  Ti  Ti6  1  0.00000000  0.00005100  0.99999900  1
  Ti  Ti7  1  0.50000000  0.49995100  0.50000100  1
  V  V8  1  0.25000100  0.74999600  0.75000400  1
  V  V9  1  0.75000100  0.74999200  0.24999800  1
  V  V10  1  0.75000300  0.24999900  0.24999300  1
  V  V11  1  0.24999500  0.24999500  0.74999900  1
  O  O12  1  0.97378300  0.50016100  0.26560700  1
  O  O13  1  0.47378300  0.00021200  0.76560600  1
  O  O14  1  0.52621900  0.49978900  0.26560500  1
  O  O15  1  0.02621800  0.99983900  0.76560500  1
  O  O16  1  0.47378200  0.50016200  0.73439500  1
  O  O17  1  0.97378000  0.00021200  0.23439500  1
  O  O18  1  0.02621800  0.49978900  0.73439500  1
  O  O19  1  0.52621700  0.99984100  0.23439500  1
  O  O20  1  0.74976400  0.77481300  0.00506800  1
  O  O21  1  0.24976400  0.27486300  0.50499700  1
  O  O22  1  0.75023700  0.22513900  0.00499700  1
  O  O23  1  0.25023500  0.72518900  0.50506800  1
  O  O24  1  0.24976600  0.77481300  0.99493300  1
  O  O25  1  0.74976400  0.27486400  0.49500300  1
  O  O26  1  0.25023500  0.22513800  0.99500300  1
  O  O27  1  0.75023500  0.72518900  0.49493300  1
