# generated using pymatgen
data_Li2TiMn2O6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.33416100
_cell_length_b   8.87085200
_cell_length_c   9.08017136
_cell_angle_alpha   61.34589805
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TiMn2O6
_chemical_formula_sum   'Li12 Ti6 Mn12 O36'
_cell_volume   730.46070631
_cell_formula_units_Z   6
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  0.27802200  0.61875400  0.44568500  1
  Li  Li1  1  0.23272500  0.10486600  0.13190600  1
  Li  Li2  1  0.22954100  0.41938600  0.80310600  1
  Li  Li3  1  0.72954100  0.08061400  0.19689400  1
  Li  Li4  1  0.73272500  0.39513400  0.86809400  1
  Li  Li5  1  0.77802200  0.88124600  0.55431500  1
  Li  Li6  1  0.22197800  0.11875400  0.44568500  1
  Li  Li7  1  0.26727500  0.60486600  0.13190600  1
  Li  Li8  1  0.27045900  0.91938600  0.80310600  1
  Li  Li9  1  0.77045900  0.58061400  0.19689400  1
  Li  Li10  1  0.76727500  0.89513400  0.86809400  1
  Li  Li11  1  0.72197800  0.38124600  0.55431500  1
  Ti  Ti12  1  0.51344100  0.82443400  0.33848500  1
  Ti  Ti13  1  0.01344100  0.67556600  0.66151500  1
  Ti  Ti14  1  0.50000000  0.50000000  0.00000000  1
  Ti  Ti15  1  0.98655900  0.32443400  0.33848500  1
  Ti  Ti16  1  0.48655900  0.17556600  0.66151500  1
  Ti  Ti17  1  0.00000000  0.00000000  0.00000000  1
  Mn  Mn18  1  0.00206800  0.66995500  0.33609300  1
  Mn  Mn19  1  0.49495500  0.16187800  0.00664800  1
  Mn  Mn20  1  0.50273200  0.49377700  0.67258000  1
  Mn  Mn21  1  0.99495500  0.33812200  0.99335200  1
  Mn  Mn22  1  0.00273200  0.00622300  0.32742000  1
  Mn  Mn23  1  0.49793200  0.16995500  0.33609300  1
  Mn  Mn24  1  0.50206800  0.83004500  0.66390700  1
  Mn  Mn25  1  0.99726800  0.99377700  0.67258000  1
  Mn  Mn26  1  0.00504500  0.66187800  0.00664800  1
  Mn  Mn27  1  0.49726800  0.50622300  0.32742000  1
  Mn  Mn28  1  0.50504500  0.83812200  0.99335200  1
  Mn  Mn29  1  0.99793200  0.33004500  0.66390700  1
  O  O30  1  0.60988000  0.61442100  0.42048200  1
  O  O31  1  0.59892900  0.95383300  0.11533500  1
  O  O32  1  0.60553400  0.28440900  0.76028800  1
  O  O33  1  0.10951100  0.57249800  0.55109200  1
  O  O34  1  0.10177600  0.22141000  0.88565600  1
  O  O35  1  0.10288700  0.91864900  0.20501800  1
  O  O36  1  0.90170500  0.45506800  0.75351500  1
  O  O37  1  0.90993800  0.78604700  0.44365300  1
  O  O38  1  0.89328900  0.13204200  0.08113400  1
  O  O39  1  0.39328900  0.36795800  0.91886600  1
  O  O40  1  0.40170500  0.04493200  0.24648500  1
  O  O41  1  0.40993800  0.71395300  0.55634700  1
  O  O42  1  0.60177600  0.27859000  0.11434400  1
  O  O43  1  0.60288700  0.58135100  0.79498200  1
  O  O44  1  0.60951100  0.92750200  0.44890800  1
  O  O45  1  0.10553400  0.21559100  0.23971200  1
  O  O46  1  0.09892900  0.54616700  0.88466500  1
  O  O47  1  0.10988000  0.88557900  0.57951800  1
  O  O48  1  0.89012000  0.11442100  0.42048200  1
  O  O49  1  0.90107100  0.45383300  0.11533500  1
  O  O50  1  0.89446600  0.78440900  0.76028800  1
  O  O51  1  0.39048900  0.07249800  0.55109200  1
  O  O52  1  0.39711300  0.41864900  0.20501800  1
  O  O53  1  0.39822400  0.72141000  0.88565600  1
  O  O54  1  0.59006200  0.28604700  0.44365300  1
  O  O55  1  0.59829500  0.95506800  0.75351500  1
  O  O56  1  0.60671100  0.63204200  0.08113400  1
  O  O57  1  0.10671100  0.86795800  0.91886600  1
  O  O58  1  0.09006200  0.21395300  0.55634700  1
  O  O59  1  0.09829500  0.54493200  0.24648500  1
  O  O60  1  0.89711300  0.08135100  0.79498200  1
  O  O61  1  0.89822400  0.77859000  0.11434400  1
  O  O62  1  0.89048900  0.42750200  0.44890800  1
  O  O63  1  0.39446600  0.71559100  0.23971200  1
  O  O64  1  0.40107100  0.04616700  0.88466500  1
  O  O65  1  0.39012000  0.38557900  0.57951800  1
