# generated using pymatgen
data_LiMnO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   23.79558338
_cell_length_b   23.79558338
_cell_length_c   5.76152791
_cell_angle_alpha   83.05584367
_cell_angle_beta   83.05584367
_cell_angle_gamma   13.90681980
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMnO2
_chemical_formula_sum   'Li20 Mn20 O40'
_cell_volume   778.24702812
_cell_formula_units_Z   20
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  0.20009500  0.20009500  0.79395000  1
  Li  Li1  1  0.40263000  0.89858400  0.59719200  1
  Li  Li2  1  0.89858400  0.40263000  0.59719200  1
  Li  Li3  1  0.60102900  0.60102900  0.39275600  1
  Li  Li4  1  0.20023800  0.20023800  0.30174100  1
  Li  Li5  1  0.80088700  0.30258300  0.19206800  1
  Li  Li6  1  0.30258300  0.80088700  0.19206800  1
  Li  Li7  1  0.00566600  0.49413500  0.99631600  1
  Li  Li8  1  0.60123900  0.60123900  0.89766700  1
  Li  Li9  1  0.20332200  0.69810100  0.78953600  1
  Li  Li10  1  0.69810100  0.20332200  0.78953600  1
  Li  Li11  1  0.00032800  0.00032800  0.98511100  1
  Li  Li12  1  0.00316400  0.00316400  0.48721100  1
  Li  Li13  1  0.60582900  0.09505600  0.39072400  1
  Li  Li14  1  0.09505600  0.60582900  0.39072400  1
  Li  Li15  1  0.39987700  0.39987700  0.58528000  1
  Li  Li16  1  0.40078300  0.40078300  0.09240600  1
  Li  Li17  1  0.79935000  0.79935000  0.18756900  1
  Li  Li18  1  0.80188400  0.80188400  0.69199400  1
  Li  Li19  1  0.49413500  0.00566600  0.99631600  1
  Mn  Mn20  1  0.70204600  0.70204600  0.79524500  1
  Mn  Mn21  1  0.10249000  0.10249000  0.39379200  1
  Mn  Mn22  1  0.70196000  0.70196000  0.29604200  1
  Mn  Mn23  1  0.40106500  0.90332500  0.09547400  1
  Mn  Mn24  1  0.90332500  0.40106500  0.09547400  1
  Mn  Mn25  1  0.50272100  0.50272100  0.98964100  1
  Mn  Mn26  1  0.10241400  0.10241400  0.89400000  1
  Mn  Mn27  1  0.30036400  0.80491000  0.69210000  1
  Mn  Mn28  1  0.80491000  0.30036400  0.69210000  1
  Mn  Mn29  1  0.90237600  0.90237600  0.58792400  1
  Mn  Mn30  1  0.50257300  0.50257300  0.48991200  1
  Mn  Mn31  1  0.70164100  0.20337800  0.28889100  1
  Mn  Mn32  1  0.20337800  0.70164100  0.28889100  1
  Mn  Mn33  1  0.30201900  0.30201900  0.19171900  1
  Mn  Mn34  1  0.90222900  0.90222900  0.08866800  1
  Mn  Mn35  1  0.10367000  0.60057000  0.89010000  1
  Mn  Mn36  1  0.60057000  0.10367000  0.89010000  1
  Mn  Mn37  1  0.30191400  0.30191400  0.69239400  1
  Mn  Mn38  1  0.50305800  0.00084100  0.49478800  1
  Mn  Mn39  1  0.00084100  0.50305800  0.49478800  1
  O  O40  1  0.75204400  0.75204400  0.72561100  1
  O  O41  1  0.47103500  0.93375200  0.54520200  1
  O  O42  1  0.93375200  0.47103500  0.54520200  1
  O  O43  1  0.15269200  0.15269200  0.32619800  1
  O  O44  1  0.65258000  0.65258000  0.32635200  1
  O  O45  1  0.75235100  0.75235100  0.26279300  1
  O  O46  1  0.86945500  0.33619600  0.14371400  1
  O  O47  1  0.33619600  0.86945500  0.14371400  1
  O  O48  1  0.47111900  0.93373800  0.04533100  1
  O  O49  1  0.93373800  0.47111900  0.04533100  1
  O  O50  1  0.55325300  0.55325300  0.92271000  1
  O  O51  1  0.05343500  0.05343500  0.92225900  1
  O  O52  1  0.15274600  0.15274600  0.86373900  1
  O  O53  1  0.65251300  0.65251300  0.86400300  1
  O  O54  1  0.27037000  0.73648100  0.73890800  1
  O  O55  1  0.73648100  0.27037000  0.73890800  1
  O  O56  1  0.86971600  0.33637700  0.64317800  1
  O  O57  1  0.33637700  0.86971600  0.64317800  1
  O  O58  1  0.95240000  0.95240000  0.51986200  1
  O  O59  1  0.45331900  0.45331900  0.51930400  1
  O  O60  1  0.55328400  0.55328400  0.46005000  1
  O  O61  1  0.05287900  0.05287900  0.46025300  1
  O  O62  1  0.67195900  0.13363700  0.33774500  1
  O  O63  1  0.13363700  0.67195900  0.33774500  1
  O  O64  1  0.26994900  0.73620000  0.23915300  1
  O  O65  1  0.73620000  0.26994900  0.23915300  1
  O  O66  1  0.35254100  0.35254100  0.12097000  1
  O  O67  1  0.85294000  0.85294000  0.12027900  1
  O  O68  1  0.95295100  0.95295100  0.05673200  1
  O  O69  1  0.45316200  0.45316200  0.05679900  1
  O  O70  1  0.07348900  0.53181200  0.94134800  1
  O  O71  1  0.53181200  0.07348900  0.94134800  1
  O  O72  1  0.67190100  0.13325200  0.83787900  1
  O  O73  1  0.13325200  0.67190100  0.83787900  1
  O  O74  1  0.25249500  0.25249500  0.72542800  1
  O  O75  1  0.35252700  0.35252700  0.65820400  1
  O  O76  1  0.85223900  0.85223900  0.65837700  1
  O  O77  1  0.07308200  0.53167700  0.44153800  1
  O  O78  1  0.53167700  0.07308200  0.44153800  1
  O  O79  1  0.25245200  0.25245200  0.26291800  1
