# generated using pymatgen
data_Li3TiCr3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.88909407
_cell_length_b   10.26592124
_cell_length_c   5.99931033
_cell_angle_alpha   106.68330503
_cell_angle_beta   60.60772170
_cell_angle_gamma   106.66658618
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3TiCr3O8
_chemical_formula_sum   'Li6 Ti2 Cr6 O16'
_cell_volume   298.04949980
_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  0.75010600  0.24999000  0.74999100  1
  Li  Li1  1  0.25010800  0.74998200  0.24998600  1
  Li  Li2  1  0.49996600  0.00011600  0.49993900  1
  Li  Li3  1  0.99997100  0.50011500  0.99992700  1
  Li  Li4  1  0.49977800  0.49985200  0.00001500  1
  Li  Li5  1  0.99978100  0.99984800  0.50000200  1
  Ti  Ti6  1  0.99945500  0.00002100  0.99998900  1
  Ti  Ti7  1  0.49941900  0.50002300  0.49998700  1
  Cr  Cr8  1  0.99885800  0.50000400  0.50000700  1
  Cr  Cr9  1  0.25037000  0.75053000  0.75099800  1
  Cr  Cr10  1  0.25082700  0.24949000  0.24907900  1
  Cr  Cr11  1  0.49889500  0.00000400  0.00000500  1
  Cr  Cr12  1  0.75043300  0.25053600  0.25101200  1
  Cr  Cr13  1  0.75086800  0.74947900  0.74905300  1
  O  O14  1  0.10917200  0.37346500  0.15756000  1
  O  O15  1  0.60918300  0.87346500  0.65757000  1
  O  O16  1  0.39328500  0.12653900  0.34243600  1
  O  O17  1  0.89327500  0.62653400  0.84244100  1
  O  O18  1  0.88746200  0.12505000  0.35064600  1
  O  O19  1  0.38746500  0.62505100  0.85064600  1
  O  O20  1  0.61303800  0.37495100  0.14936000  1
  O  O21  1  0.11303100  0.87495200  0.64936000  1
  O  O22  1  0.63780600  0.38231400  0.59968800  1
  O  O23  1  0.13782100  0.88232200  0.09969500  1
  O  O24  1  0.14446000  0.38201700  0.59774100  1
  O  O25  1  0.64447500  0.88201400  0.09773900  1
  O  O26  1  0.35517900  0.11768500  0.90030200  1
  O  O27  1  0.85518000  0.61768600  0.40028800  1
  O  O28  1  0.86017700  0.11798500  0.90226200  1
  O  O29  1  0.36015600  0.61798300  0.40227300  1
