# generated using pymatgen
data_Li3Ti2MnO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.92607998
_cell_length_b   6.92492933
_cell_length_c   6.70715543
_cell_angle_alpha   84.42788902
_cell_angle_beta   116.25979540
_cell_angle_gamma   77.70246437
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Ti2MnO6
_chemical_formula_sum   'Li6 Ti4 Mn2 O12'
_cell_volume   235.35600770
_cell_formula_units_Z   2
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  0.75207000  0.32685600  0.16811200  1
  Li  Li1  1  0.24821500  0.33941600  0.16557900  1
  Li  Li2  1  0.75843100  0.98603600  0.51012700  1
  Li  Li3  1  0.26031600  0.97885600  0.50933100  1
  Li  Li4  1  0.73994300  0.68752900  0.82410400  1
  Li  Li5  1  0.24156000  0.68090500  0.82306000  1
  Ti  Ti6  1  0.00412200  0.00743800  0.00173000  1
  Ti  Ti7  1  0.49050900  0.00865100  0.99906300  1
  Ti  Ti8  1  0.50945200  0.65810800  0.33415900  1
  Ti  Ti9  1  0.99587600  0.65916000  0.33159600  1
  Mn  Mn10  1  0.49999100  0.33324400  0.66669600  1
  Mn  Mn11  1  0.99999000  0.33334400  0.66671900  1
  O  O12  1  0.63659700  0.99624900  0.77214000  1
  O  O13  1  0.13472200  0.99307700  0.76594000  1
  O  O14  1  0.86517500  0.67378500  0.56725200  1
  O  O15  1  0.36329200  0.67036900  0.56097200  1
  O  O16  1  0.62012800  0.69099400  0.08585600  1
  O  O17  1  0.12607800  0.68849500  0.09283200  1
  O  O18  1  0.87385700  0.97830600  0.24035000  1
  O  O19  1  0.37982800  0.97578500  0.24737400  1
  O  O20  1  0.60914000  0.36791100  0.39988800  1
  O  O21  1  0.10463200  0.37074000  0.39802000  1
  O  O22  1  0.89529700  0.29594700  0.93549100  1
  O  O23  1  0.39077700  0.29879800  0.93360800  1
