# generated using pymatgen
data_Li2TiFe3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.99434812
_cell_length_b   5.96335182
_cell_length_c   10.40021729
_cell_angle_alpha   107.10715195
_cell_angle_beta   90.44831277
_cell_angle_gamma   60.23706391
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TiFe3O8
_chemical_formula_sum   'Li4 Ti2 Fe6 O16'
_cell_volume   304.14105083
_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  0.31821000  0.37400800  0.56637100  1
  Li  Li1  1  0.80588300  0.37929400  0.06606500  1
  Li  Li2  1  0.17967200  0.62794900  0.93433700  1
  Li  Li3  1  0.69509300  0.62037600  0.43388800  1
  Ti  Ti4  1  0.75293400  0.49995900  0.74834700  1
  Ti  Ti5  1  0.25245200  0.49853600  0.24961600  1
  Fe  Fe6  1  0.24879400  0.00026800  0.75112700  1
  Fe  Fe7  1  0.75089200  0.99866800  0.24966800  1
  Fe  Fe8  1  0.00618100  0.99167800  0.49842000  1
  Fe  Fe9  1  0.74847700  0.00270300  0.75009200  1
  Fe  Fe10  1  0.25037600  0.99972000  0.25026500  1
  Fe  Fe11  1  0.49314300  0.00597100  0.00088700  1
  O  O12  1  0.11663900  0.79116200  0.63753600  1
  O  O13  1  0.58951700  0.79363500  0.13380900  1
  O  O14  1  0.38022400  0.21043300  0.86325400  1
  O  O15  1  0.91191500  0.20564000  0.36629700  1
  O  O16  1  0.86229500  0.25754900  0.85946600  1
  O  O17  1  0.37584600  0.23806000  0.35681600  1
  O  O18  1  0.65990100  0.24041000  0.63031500  1
  O  O19  1  0.14817400  0.25333600  0.13252000  1
  O  O20  1  0.11307400  0.23735100  0.63952200  1
  O  O21  1  0.59953500  0.24653700  0.13461900  1
  O  O22  1  0.38536100  0.76308200  0.86010600  1
  O  O23  1  0.90257600  0.75121300  0.36588800  1
  O  O24  1  0.83878700  0.76079600  0.86984200  1
  O  O25  1  0.35271100  0.74621900  0.36709100  1
  O  O26  1  0.63536700  0.74488600  0.64079300  1
  O  O27  1  0.12597000  0.76056000  0.14304400  1
