# generated using pymatgen
data_Li2TiMn3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.24693200
_cell_length_b   8.33361177
_cell_length_c   8.80691400
_cell_angle_alpha   89.93487084
_cell_angle_beta   89.58008766
_cell_angle_gamma   89.83931112
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TiMn3O8
_chemical_formula_sum   'Li8 Ti4 Mn12 O32'
_cell_volume   605.25138504
_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  0.00423700  0.99759000  0.00008600  1
  Li  Li1  1  0.74605300  0.25356900  0.74944600  1
  Li  Li2  1  0.25480700  0.75008700  0.74581700  1
  Li  Li3  1  0.99641200  0.49573800  0.50861600  1
  Li  Li4  1  0.49534900  0.00739600  0.49594200  1
  Li  Li5  1  0.75582600  0.74511300  0.24848800  1
  Li  Li6  1  0.24195200  0.24447500  0.24391300  1
  Li  Li7  1  0.50355400  0.50722400  0.00626000  1
  Ti  Ti8  1  0.13127600  0.37676200  0.87287300  1
  Ti  Ti9  1  0.86542700  0.88446600  0.62691400  1
  Ti  Ti10  1  0.37284300  0.61407200  0.37245000  1
  Ti  Ti11  1  0.62957400  0.11843100  0.12674700  1
  Mn  Mn12  1  0.87583500  0.62439300  0.86909800  1
  Mn  Mn13  1  0.62398100  0.87190800  0.88105100  1
  Mn  Mn14  1  0.37313500  0.12664900  0.88315700  1
  Mn  Mn15  1  0.62696700  0.62237200  0.62164900  1
  Mn  Mn16  1  0.37663100  0.37121000  0.62284700  1
  Mn  Mn17  1  0.12929200  0.12418800  0.62572500  1
  Mn  Mn18  1  0.62741600  0.37512900  0.36914800  1
  Mn  Mn19  1  0.87521500  0.12439300  0.37347700  1
  Mn  Mn20  1  0.12496200  0.87549300  0.37841100  1
  Mn  Mn21  1  0.87376700  0.37681900  0.12014200  1
  Mn  Mn22  1  0.12253500  0.62825100  0.12135100  1
  Mn  Mn23  1  0.37458200  0.87738500  0.13494700  1
  O  O24  1  0.88539900  0.39565200  0.87491500  1
  O  O25  1  0.10910100  0.61269900  0.86946700  1
  O  O26  1  0.38596100  0.88046800  0.91114000  1
  O  O27  1  0.86586400  0.86059300  0.85533600  1
  O  O28  1  0.60977700  0.11137400  0.89774100  1
  O  O29  1  0.64096100  0.64117100  0.87013800  1
  O  O30  1  0.36071500  0.37002500  0.87628200  1
  O  O31  1  0.14082200  0.14251300  0.87852200  1
  O  O32  1  0.86160400  0.63505000  0.64644000  1
  O  O33  1  0.64021300  0.86299300  0.62177500  1
  O  O34  1  0.36458100  0.13966300  0.63615700  1
  O  O35  1  0.39137700  0.61188600  0.60170900  1
  O  O36  1  0.13859400  0.36059600  0.64306400  1
  O  O37  1  0.61365400  0.38208500  0.59257500  1
  O  O38  1  0.88942400  0.10666500  0.63082700  1
  O  O39  1  0.11972200  0.88834200  0.59967400  1
  O  O40  1  0.61329300  0.60546400  0.37140200  1
  O  O41  1  0.38855400  0.38964700  0.36555400  1
  O  O42  1  0.10796500  0.10594500  0.37622800  1
  O  O43  1  0.63715100  0.14119900  0.35859200  1
  O  O44  1  0.88984100  0.88302500  0.39483800  1
  O  O45  1  0.85968100  0.36044200  0.36735000  1
  O  O46  1  0.13983400  0.64227900  0.37932200  1
  O  O47  1  0.36099800  0.86547200  0.35713600  1
  O  O48  1  0.63820900  0.36405500  0.14558300  1
  O  O49  1  0.85657100  0.13424700  0.12220100  1
  O  O50  1  0.13622600  0.86321000  0.15155100  1
  O  O51  1  0.10838500  0.39179200  0.10570600  1
  O  O52  1  0.36084400  0.64241000  0.14362900  1
  O  O53  1  0.88742600  0.62078900  0.09363900  1
  O  O54  1  0.60836000  0.88956800  0.13520500  1
  O  O55  1  0.38712500  0.10570800  0.12775200  1
