# generated using pymatgen
data_Li4TiCrO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.04449100
_cell_length_b   5.05581123
_cell_length_c   19.39852374
_cell_angle_alpha   85.05913440
_cell_angle_beta   86.94762815
_cell_angle_gamma   60.55255836
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4TiCrO6
_chemical_formula_sum   'Li16 Ti4 Cr4 O24'
_cell_volume   429.18812965
_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  0.50000000  0.50000000  0.50000000  1
  Li  Li1  1  0.50150800  0.37678300  0.87503200  1
  Li  Li2  1  0.18040200  0.41031400  0.74960400  1
  Li  Li3  1  0.50000000  0.00000000  0.00000000  1
  Li  Li4  1  0.49889500  0.87320700  0.37497400  1
  Li  Li5  1  0.49219200  0.75109000  0.75004500  1
  Li  Li6  1  0.17514200  0.90997000  0.24942600  1
  Li  Li7  1  0.50780800  0.24891000  0.24995500  1
  Li  Li8  1  0.81939800  0.33152400  0.99991300  1
  Li  Li9  1  0.17526000  0.15612600  0.49966500  1
  Li  Li10  1  0.82474000  0.84387400  0.50033500  1
  Li  Li11  1  0.18060200  0.66847600  0.00008700  1
  Li  Li12  1  0.82485800  0.09003000  0.75057400  1
  Li  Li13  1  0.50110500  0.12679300  0.62502600  1
  Li  Li14  1  0.81959800  0.58968600  0.25039600  1
  Li  Li15  1  0.49849200  0.62321700  0.12496800  1
  Ti  Ti16  1  0.83204000  0.45583600  0.62472000  1
  Ti  Ti17  1  0.16772100  0.29554700  0.12521500  1
  Ti  Ti18  1  0.83227900  0.70445300  0.87478500  1
  Ti  Ti19  1  0.16796000  0.54416400  0.37528000  1
  Cr  Cr20  1  0.83249700  0.95554500  0.12487100  1
  Cr  Cr21  1  0.16711600  0.79422100  0.62524600  1
  Cr  Cr22  1  0.83288400  0.20577900  0.37475400  1
  Cr  Cr23  1  0.16750300  0.04445500  0.87512900  1
  O  O24  1  0.50148400  0.45979800  0.68317800  1
  O  O25  1  0.49370900  0.78887000  0.56782100  1
  O  O26  1  0.50692200  0.96091500  0.18223200  1
  O  O27  1  0.14548100  0.34755100  0.93110800  1
  O  O28  1  0.14586800  0.50358700  0.56876200  1
  O  O29  1  0.49788500  0.29031500  0.06675800  1
  O  O30  1  0.85461600  0.39662800  0.81768000  1
  O  O31  1  0.14656500  0.85353800  0.43179000  1
  O  O32  1  0.14074400  0.99855200  0.06907100  1
  O  O33  1  0.14646800  0.75316300  0.81906300  1
  O  O34  1  0.85971600  0.75105000  0.68123400  1
  O  O35  1  0.85347400  0.90212300  0.31911700  1
  O  O36  1  0.14652600  0.09787700  0.68088300  1
  O  O37  1  0.14028400  0.24895000  0.31876600  1
  O  O38  1  0.85353200  0.24683700  0.18093700  1
  O  O39  1  0.85925600  0.00144800  0.93092900  1
  O  O40  1  0.85343500  0.14646200  0.56821000  1
  O  O41  1  0.14538400  0.60337200  0.18232000  1
  O  O42  1  0.50211500  0.70968500  0.93324200  1
  O  O43  1  0.85413200  0.49641300  0.43123800  1
  O  O44  1  0.85451900  0.65244900  0.06889200  1
  O  O45  1  0.49307800  0.03908500  0.81776800  1
  O  O46  1  0.50629100  0.21113000  0.43217900  1
  O  O47  1  0.49851600  0.54020200  0.31682200  1
