# generated using pymatgen
data_Li2TiMnO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.79622703
_cell_length_b   10.27877096
_cell_length_c   5.79620911
_cell_angle_alpha   73.62343102
_cell_angle_beta   90.01152335
_cell_angle_gamma   73.62393592
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TiMnO4
_chemical_formula_sum   'Li8 Ti4 Mn4 O16'
_cell_volume   316.68245814
_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  0.62504100  0.24997800  0.62501400  1
  Li  Li1  1  0.12504500  0.24999100  0.12501000  1
  Li  Li2  1  0.37504100  0.74996500  0.87501000  1
  Li  Li3  1  0.87501600  0.75000000  0.37501300  1
  Li  Li4  1  0.00000000  0.99997600  0.50000600  1
  Li  Li5  1  0.50005400  0.99997400  0.00004300  1
  Li  Li6  1  0.75000100  0.49997200  0.75003400  1
  Li  Li7  1  0.25004000  0.49996000  0.24993800  1
  Ti  Ti8  1  0.62504400  0.25000500  0.12497800  1
  Ti  Ti9  1  0.12505600  0.24999200  0.62502900  1
  Ti  Ti10  1  0.37507300  0.75001500  0.37501800  1
  Ti  Ti11  1  0.87504500  0.74998100  0.87504900  1
  Mn  Mn12  1  0.74993400  0.50005200  0.24997500  1
  Mn  Mn13  1  0.49985900  0.00001300  0.50018500  1
  Mn  Mn14  1  0.24959600  0.50028300  0.74969100  1
  Mn  Mn15  1  0.99990600  0.00022900  0.00000500  1
  O  O16  1  0.52202800  0.45578600  0.02199200  1
  O  O17  1  0.02203300  0.45579700  0.52202000  1
  O  O18  1  0.27215200  0.95577300  0.27213500  1
  O  O19  1  0.77215800  0.95577100  0.77214100  1
  O  O20  1  0.72787600  0.04416300  0.22796200  1
  O  O21  1  0.22788800  0.04415500  0.72794700  1
  O  O22  1  0.47795500  0.54418600  0.47785100  1
  O  O23  1  0.97790800  0.54418700  0.97788000  1
  O  O24  1  0.87436000  0.25133400  0.37433300  1
  O  O25  1  0.37432700  0.25133800  0.87429000  1
  O  O26  1  0.62434500  0.75132800  0.62432500  1
  O  O27  1  0.12434900  0.75133900  0.12433500  1
  O  O28  1  0.12571600  0.74862200  0.62567300  1
  O  O29  1  0.62571500  0.74861700  0.12569900  1
  O  O30  1  0.87573200  0.24861700  0.87568600  1
  O  O31  1  0.37570700  0.24860100  0.37573200  1
