# generated using pymatgen
data_Li2TiCrO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.88850930
_cell_length_b   9.56547113
_cell_length_c   5.88867317
_cell_angle_alpha   72.03240371
_cell_angle_beta   90.11885403
_cell_angle_gamma   107.96633906
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TiCrO4
_chemical_formula_sum   'Li8 Ti4 Cr4 O16'
_cell_volume   298.53440340
_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  0.37594300  0.25019600  0.62412300  1
  Li  Li1  1  0.87429100  0.25025600  0.12564200  1
  Li  Li2  1  0.12506600  0.74961400  0.37509500  1
  Li  Li3  1  0.62455400  0.74963600  0.87527600  1
  Li  Li4  1  0.49935000  0.99866200  0.00067900  1
  Li  Li5  1  0.00035600  0.00077500  0.49959200  1
  Li  Li6  1  0.24985700  0.49970300  0.75012200  1
  Li  Li7  1  0.75030100  0.50061300  0.24971900  1
  Ti  Ti8  1  0.87687900  0.24979300  0.62628200  1
  Ti  Ti9  1  0.37294500  0.24979700  0.12390200  1
  Ti  Ti10  1  0.62518900  0.75001000  0.37448400  1
  Ti  Ti11  1  0.12483000  0.75001600  0.87549700  1
  Cr  Cr12  1  0.75008700  0.50008900  0.74998100  1
  Cr  Cr13  1  0.49982200  0.99963500  0.50016700  1
  Cr  Cr14  1  0.24998300  0.49985700  0.25007100  1
  Cr  Cr15  1  0.00028000  0.00056400  0.99973600  1
  O  O16  1  0.97868100  0.47944100  0.51944400  1
  O  O17  1  0.50075500  0.47943100  0.00109900  1
  O  O18  1  0.73007500  0.97786200  0.27185000  1
  O  O19  1  0.24779100  0.97788100  0.75026900  1
  O  O20  1  0.74958500  0.02089100  0.73054500  1
  O  O21  1  0.27129100  0.02090900  0.24854100  1
  O  O22  1  0.51979800  0.52191300  0.49968500  1
  O  O23  1  0.00210100  0.52189400  0.97841300  1
  O  O24  1  0.88012800  0.76016900  0.11988200  1
  O  O25  1  0.38047600  0.76102000  0.61951400  1
  O  O26  1  0.63070500  0.26145500  0.86928500  1
  O  O27  1  0.12977900  0.25950500  0.37021700  1
  O  O28  1  0.37002900  0.74013800  0.12992200  1
  O  O29  1  0.86944100  0.73886600  0.63062800  1
  O  O30  1  0.12061000  0.24125600  0.87940400  1
  O  O31  1  0.61902300  0.23815300  0.38093100  1
