# generated using pymatgen
data_Li3Ti2(FeO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.05315167
_cell_length_b   5.99365211
_cell_length_c   5.93920637
_cell_angle_alpha   60.24484833
_cell_angle_beta   61.03383712
_cell_angle_gamma   91.05279900
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Ti2(FeO4)2
_chemical_formula_sum   'Li3 Ti2 Fe2 O8'
_cell_volume   153.87885442
_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  0.00000000  0.50000000  0.00000000  1
  Li  Li1  1  0.50000000  0.00000000  0.50000000  1
  Li  Li2  1  0.50000000  0.50000000  0.00000000  1
  Ti  Ti3  1  0.00000000  0.00000000  0.50000000  1
  Ti  Ti4  1  0.00000000  0.00000000  0.00000000  1
  Fe  Fe5  1  0.00000000  0.50000000  0.50000000  1
  Fe  Fe6  1  0.50000000  0.00000000  0.00000000  1
  O  O7  1  0.22200267  0.76667683  0.49236024  1
  O  O8  1  0.78577877  0.77988038  0.96303772  1
  O  O9  1  0.21945636  0.75423377  0.02048150  1
  O  O10  1  0.22096180  0.22988639  0.52344794  1
  O  O11  1  0.77903820  0.77011361  0.47655206  1
  O  O12  1  0.78054364  0.24576623  0.97951850  1
  O  O13  1  0.21422123  0.22011962  0.03696228  1
  O  O14  1  0.77799733  0.23332317  0.50763976  1
