# generated using pymatgen
data_Li3MnO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.62571413
_cell_length_b   9.62571413
_cell_length_c   9.79392400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000087
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3MnO3
_chemical_formula_sum   'Li36 Mn12 O36'
_cell_volume   785.87464362
_cell_formula_units_Z   12
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  0.41725700  0.19506100  0.17314400  1
  Li  Li1  1  0.47981300  0.24985000  0.67302700  1
  Li  Li2  1  0.42663300  0.85532900  0.67300300  1
  Li  Li3  1  0.51891600  0.08530000  0.83021200  1
  Li  Li4  1  0.43361700  0.91470000  0.16978800  1
  Li  Li5  1  0.57130400  0.14467100  0.32699700  1
  Li  Li6  1  0.52018700  0.77003600  0.32697300  1
  Li  Li7  1  0.80493900  0.22219700  0.17314400  1
  Li  Li8  1  0.42869600  0.57336700  0.67300300  1
  Li  Li9  1  0.48108400  0.56638300  0.16978800  1
  Li  Li10  1  0.58274300  0.77780300  0.82685600  1
  Li  Li11  1  0.75015000  0.22996400  0.67302700  1
  Li  Li12  1  0.89728400  0.14617200  0.82961400  1
  Li  Li13  1  0.56638300  0.48108400  0.83021200  1
  Li  Li14  1  0.81482100  0.91681600  0.67293100  1
  Li  Li15  1  0.89800500  0.08318400  0.32706900  1
  Li  Li16  1  0.57336700  0.42869600  0.32699700  1
  Li  Li17  1  0.75111200  0.85382800  0.17038600  1
  Li  Li18  1  0.91681600  0.81482100  0.32706900  1
  Li  Li19  1  0.10271600  0.24888800  0.17038600  1
  Li  Li20  1  0.77780300  0.58274300  0.17314400  1
  Li  Li21  1  0.85382800  0.75111200  0.82961400  1
  Li  Li22  1  0.10199500  0.18517900  0.67293100  1
  Li  Li23  1  0.77003600  0.52018700  0.67302700  1
  Li  Li24  1  0.91470000  0.43361700  0.83021200  1
  Li  Li25  1  0.08318400  0.89800500  0.67293100  1
  Li  Li26  1  0.18517900  0.10199500  0.32706900  1
  Li  Li27  1  0.24888800  0.10271600  0.82961400  1
  Li  Li28  1  0.85532900  0.42663300  0.32699700  1
  Li  Li29  1  0.14617200  0.89728400  0.17038600  1
  Li  Li30  1  0.08530000  0.51891600  0.16978800  1
  Li  Li31  1  0.22996400  0.75015000  0.32697300  1
  Li  Li32  1  0.14467100  0.57130400  0.67300300  1
  Li  Li33  1  0.22219700  0.80493900  0.82685600  1
  Li  Li34  1  0.19506100  0.41725700  0.82685600  1
  Li  Li35  1  0.24985000  0.47981300  0.32697300  1
  Mn  Mn36  1  0.33400400  0.00000000  0.50000000  1
  Mn  Mn37  1  0.33333300  0.66666700  0.99991500  1
  Mn  Mn38  1  0.66551800  0.00000000  0.00000000  1
  Mn  Mn39  1  0.33448200  0.33448200  0.00000000  1
  Mn  Mn40  1  0.33063000  0.33063000  0.50000000  1
  Mn  Mn41  1  0.66937000  0.00000000  0.50000000  1
  Mn  Mn42  1  0.66599600  0.66599600  0.50000000  1
  Mn  Mn43  1  0.66666700  0.33333300  0.00008500  1
  Mn  Mn44  1  0.00000000  0.00000000  0.00000000  1
  Mn  Mn45  1  0.00000000  0.66551800  0.00000000  1
  Mn  Mn46  1  0.00000000  0.66937000  0.50000000  1
  Mn  Mn47  1  0.00000000  0.33400400  0.50000000  1
  O  O48  1  0.41154600  0.22180400  0.37915700  1
  O  O49  1  0.47365600  0.25378600  0.88019900  1
  O  O50  1  0.52844700  0.08124400  0.62038000  1
  O  O51  1  0.57940100  0.14075900  0.12014500  1
  O  O52  1  0.44720300  0.91875600  0.37962000  1
  O  O53  1  0.43864100  0.85924100  0.87985500  1
  O  O54  1  0.42059900  0.56135900  0.87985500  1
  O  O55  1  0.52634400  0.78013100  0.11980100  1
  O  O56  1  0.74621400  0.21986900  0.88019900  1
  O  O57  1  0.77819600  0.18974200  0.37915700  1
  O  O58  1  0.58845400  0.81025800  0.62084300  1
  O  O59  1  0.47155300  0.55279700  0.37962000  1
  O  O60  1  0.55279700  0.47155300  0.62038000  1
  O  O61  1  0.74782500  0.86551500  0.37980400  1
  O  O62  1  0.80707200  0.91827200  0.88018200  1
  O  O63  1  0.88231000  0.13448500  0.62019600  1
  O  O64  1  0.56135900  0.42059900  0.12014500  1
  O  O65  1  0.88880000  0.08172800  0.11981800  1
  O  O66  1  0.81025800  0.58845400  0.37915700  1
  O  O67  1  0.11769000  0.25217500  0.37980400  1
  O  O68  1  0.78013100  0.52634400  0.88019900  1
  O  O69  1  0.86551500  0.74782500  0.62019600  1
  O  O70  1  0.91827200  0.80707200  0.11981800  1
  O  O71  1  0.11120000  0.19292800  0.88018200  1
  O  O72  1  0.19292800  0.11120000  0.11981800  1
  O  O73  1  0.08172800  0.88880000  0.88018200  1
  O  O74  1  0.85924100  0.43864100  0.12014500  1
  O  O75  1  0.91875600  0.44720300  0.62038000  1
  O  O76  1  0.13448500  0.88231000  0.37980400  1
  O  O77  1  0.25217500  0.11769000  0.62019600  1
  O  O78  1  0.18974200  0.77819600  0.62084300  1
  O  O79  1  0.21986900  0.74621400  0.11980100  1
  O  O80  1  0.08124400  0.52844700  0.37962000  1
  O  O81  1  0.14075900  0.57940100  0.87985500  1
  O  O82  1  0.22180400  0.41154600  0.62084300  1
  O  O83  1  0.25378600  0.47365600  0.11980100  1
