# generated using pymatgen
data_Li3MnAl2O6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.91000813
_cell_length_b   7.99276990
_cell_length_c   8.62159946
_cell_angle_alpha   107.62819117
_cell_angle_beta   107.28525161
_cell_angle_gamma   96.36680957
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3MnAl2O6
_chemical_formula_sum   'Li12 Mn4 Al8 O24'
_cell_volume   483.78895610
_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  0.45588700  0.62186800  0.91705400  1
  Li  Li1  1  0.95589800  0.12187600  0.91706000  1
  Li  Li2  1  0.04410400  0.87812500  0.08294200  1
  Li  Li3  1  0.54411400  0.37813000  0.08294700  1
  Li  Li4  1  0.94992000  0.29015900  0.24333200  1
  Li  Li5  1  0.44991000  0.79016300  0.24333200  1
  Li  Li6  1  0.55009100  0.20984000  0.75667000  1
  Li  Li7  1  0.05007900  0.70983800  0.75667000  1
  Li  Li8  1  0.28920200  0.63514700  0.59747800  1
  Li  Li9  1  0.78921100  0.13514700  0.59747500  1
  Li  Li10  1  0.21078800  0.86485300  0.40252200  1
  Li  Li11  1  0.71079900  0.36485000  0.40252500  1
  Mn  Mn12  1  0.29485400  0.46553500  0.25789900  1
  Mn  Mn13  1  0.70515300  0.53447600  0.74211600  1
  Mn  Mn14  1  0.79481900  0.96553600  0.25787200  1
  Mn  Mn15  1  0.20516600  0.03445700  0.74210500  1
  Al  Al16  1  0.62160100  0.79706500  0.58145400  1
  Al  Al17  1  0.12159700  0.29705800  0.58146000  1
  Al  Al18  1  0.87840300  0.70294000  0.41853700  1
  Al  Al19  1  0.37840600  0.20293800  0.41854500  1
  Al  Al20  1  0.62453900  0.95763300  0.91294000  1
  Al  Al21  1  0.12454000  0.45763100  0.91294900  1
  Al  Al22  1  0.87546300  0.54236900  0.08705200  1
  Al  Al23  1  0.37545700  0.04237100  0.08705700  1
  O  O24  1  0.22765200  0.36427700  0.42146100  1
  O  O25  1  0.72763900  0.86427000  0.42145100  1
  O  O26  1  0.27235500  0.13572600  0.57854500  1
  O  O27  1  0.77235000  0.63572600  0.57854200  1
  O  O28  1  0.55424200  0.72585000  0.75792000  1
  O  O29  1  0.05425000  0.22584900  0.75792400  1
  O  O30  1  0.94575000  0.77415100  0.24207800  1
  O  O31  1  0.44575600  0.27415000  0.24208000  1
  O  O32  1  0.34953700  0.53038200  0.08044400  1
  O  O33  1  0.84952300  0.03037200  0.08043100  1
  O  O34  1  0.15047100  0.96962400  0.91956500  1
  O  O35  1  0.65046600  0.46962200  0.91956100  1
  O  O36  1  0.39554500  0.71189900  0.42678400  1
  O  O37  1  0.89554900  0.21188300  0.42677400  1
  O  O38  1  0.10445200  0.78811000  0.57322300  1
  O  O39  1  0.60445900  0.28810800  0.57322500  1
  O  O40  1  0.69684900  0.01899400  0.74548000  1
  O  O41  1  0.19684400  0.51899800  0.74548000  1
  O  O42  1  0.80315600  0.48100100  0.25452000  1
  O  O43  1  0.30315100  0.98100500  0.25451900  1
  O  O44  1  0.03542400  0.39095500  0.07973400  1
  O  O45  1  0.53540700  0.89094500  0.07972000  1
  O  O46  1  0.46458800  0.10905100  0.92027600  1
  O  O47  1  0.96457900  0.60904600  0.92027000  1
