# generated using pymatgen
data_LiTiCrO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.05654800
_cell_length_b   9.64785700
_cell_length_c   5.96997400
_cell_angle_alpha   90.00007402
_cell_angle_beta   89.99999040
_cell_angle_gamma   90.00031898
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTiCrO4
_chemical_formula_sum   'Li4 Ti4 Cr4 O16'
_cell_volume   291.24429814
_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  0.55991100  0.96424000  0.12500000  1
  Li  Li1  1  0.55991300  0.96423900  0.62501100  1
  Li  Li2  1  0.94008500  0.46424100  0.12500900  1
  Li  Li3  1  0.94009000  0.46424200  0.62499500  1
  Ti  Ti4  1  0.51316900  0.64298800  0.12503000  1
  Ti  Ti5  1  0.51318300  0.64299500  0.62498400  1
  Ti  Ti6  1  0.98681500  0.14299700  0.12497900  1
  Ti  Ti7  1  0.98682800  0.14299000  0.62502200  1
  Cr  Cr8  1  0.48452500  0.36192800  0.87497200  1
  Cr  Cr9  1  0.01547700  0.86190600  0.37499800  1
  Cr  Cr10  1  0.48454200  0.36183600  0.37499700  1
  Cr  Cr11  1  0.01545300  0.86186800  0.87501300  1
  O  O12  1  0.30819900  0.46409200  0.12501300  1
  O  O13  1  0.30818700  0.46409800  0.62496900  1
  O  O14  1  0.19180700  0.96410100  0.12499200  1
  O  O15  1  0.19180500  0.96409600  0.62502000  1
  O  O16  1  0.71086500  0.53543400  0.37500000  1
  O  O17  1  0.71088000  0.53545000  0.87499200  1
  O  O18  1  0.78911600  0.03545300  0.37500400  1
  O  O19  1  0.78913200  0.03543800  0.87500400  1
  O  O20  1  0.78892800  0.78062700  0.12502000  1
  O  O21  1  0.78893800  0.78062300  0.62499400  1
  O  O22  1  0.71106000  0.28062100  0.12497000  1
  O  O23  1  0.71107200  0.28062400  0.62500900  1
  O  O24  1  0.18481300  0.21770600  0.37500600  1
  O  O25  1  0.18481800  0.21772700  0.87499800  1
  O  O26  1  0.31519300  0.71773100  0.37500100  1
  O  O27  1  0.31519500  0.71771000  0.87500100  1
