# generated using pymatgen
data_Li2TiCr3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.39767300
_cell_length_b   8.39767300
_cell_length_c   8.39767300
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TiCr3O8
_chemical_formula_sum   'Li8 Ti4 Cr12 O32'
_cell_volume   592.21155708
_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  0.99603600  0.99603600  0.99603600  1
  Li  Li1  1  0.25396400  0.25396400  0.25396400  1
  Li  Li2  1  0.24603600  0.74603600  0.75396400  1
  Li  Li3  1  0.50396400  0.00396400  0.49603600  1
  Li  Li4  1  0.49603600  0.50396400  0.00396400  1
  Li  Li5  1  0.75396400  0.24603600  0.74603600  1
  Li  Li6  1  0.74603600  0.75396400  0.24603600  1
  Li  Li7  1  0.00396400  0.49603600  0.50396400  1
  Ti  Ti8  1  0.12500000  0.87500000  0.37500000  1
  Ti  Ti9  1  0.37500000  0.12500000  0.87500000  1
  Ti  Ti10  1  0.62500000  0.62500000  0.62500000  1
  Ti  Ti11  1  0.87500000  0.37500000  0.12500000  1
  Cr  Cr12  1  0.12802400  0.12197600  0.62500000  1
  Cr  Cr13  1  0.12500000  0.37197600  0.87802400  1
  Cr  Cr14  1  0.12197600  0.62500000  0.12802400  1
  Cr  Cr15  1  0.37802400  0.37500000  0.62802400  1
  Cr  Cr16  1  0.37500000  0.62802400  0.37802400  1
  Cr  Cr17  1  0.37197600  0.87802400  0.12500000  1
  Cr  Cr18  1  0.62802400  0.37802400  0.37500000  1
  Cr  Cr19  1  0.62500000  0.12802400  0.12197600  1
  Cr  Cr20  1  0.62197600  0.87500000  0.87197600  1
  Cr  Cr21  1  0.87802400  0.12500000  0.37197600  1
  Cr  Cr22  1  0.87500000  0.87197600  0.62197600  1
  Cr  Cr23  1  0.87197600  0.62197600  0.87500000  1
  O  O24  1  0.11785400  0.10802000  0.38691500  1
  O  O25  1  0.11308500  0.88214600  0.60802000  1
  O  O26  1  0.10804600  0.60804600  0.89195400  1
  O  O27  1  0.14198000  0.13214600  0.86308500  1
  O  O28  1  0.10802000  0.38691500  0.11785400  1
  O  O29  1  0.14195400  0.35804600  0.64195400  1
  O  O30  1  0.13691500  0.64198000  0.36785400  1
  O  O31  1  0.13214600  0.86308500  0.14198000  1
  O  O32  1  0.36785400  0.13691500  0.64198000  1
  O  O33  1  0.36308500  0.35802000  0.86785400  1
  O  O34  1  0.35804600  0.64195400  0.14195400  1
  O  O35  1  0.39198000  0.61308500  0.61785400  1
  O  O36  1  0.35802000  0.86785400  0.36308500  1
  O  O37  1  0.39195400  0.39195400  0.39195400  1
  O  O38  1  0.38691500  0.11785400  0.10802000  1
  O  O39  1  0.38214600  0.89198000  0.88691500  1
  O  O40  1  0.61785400  0.39198000  0.61308500  1
  O  O41  1  0.61308500  0.61785400  0.39198000  1
  O  O42  1  0.60804600  0.89195400  0.10804600  1
  O  O43  1  0.64198000  0.36785400  0.13691500  1
  O  O44  1  0.60802000  0.11308500  0.88214600  1
  O  O45  1  0.64195400  0.14195400  0.35804600  1
  O  O46  1  0.63691500  0.85802000  0.63214600  1
  O  O47  1  0.63214600  0.63691500  0.85802000  1
  O  O48  1  0.86785400  0.36308500  0.35802000  1
  O  O49  1  0.86308500  0.14198000  0.13214600  1
  O  O50  1  0.85804600  0.85804600  0.85804600  1
  O  O51  1  0.89198000  0.88691500  0.38214600  1
  O  O52  1  0.85802000  0.63214600  0.63691500  1
  O  O53  1  0.89195400  0.10804600  0.60804600  1
  O  O54  1  0.88691500  0.38214600  0.89198000  1
  O  O55  1  0.88214600  0.60802000  0.11308500  1
