# generated using pymatgen
data_LiMn3O6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.85129000
_cell_length_b   6.59871226
_cell_length_c   13.17683381
_cell_angle_alpha   99.82550615
_cell_angle_beta   90.84178056
_cell_angle_gamma   115.26516554
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMn3O6
_chemical_formula_sum   'Li4 Mn12 O24'
_cell_volume   451.16154688
_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  0.58662900  0.67716700  0.82184900  1
  Li  Li1  1  0.57978500  0.17895100  0.32112700  1
  Li  Li2  1  0.24072100  0.48842800  0.00812700  1
  Li  Li3  1  0.74974700  0.99185700  0.51250300  1
  Mn  Mn4  1  0.00875700  0.51864500  0.50780900  1
  Mn  Mn5  1  0.16793400  0.33712400  0.67025800  1
  Mn  Mn6  1  0.99357100  0.99526100  0.99888400  1
  Mn  Mn7  1  0.16973900  0.83388800  0.16620600  1
  Mn  Mn8  1  0.66806800  0.33705200  0.66952500  1
  Mn  Mn9  1  0.82978200  0.16564800  0.83091500  1
  Mn  Mn10  1  0.66959200  0.83466400  0.16660300  1
  Mn  Mn11  1  0.83654800  0.66741900  0.33283500  1
  Mn  Mn12  1  0.32044100  0.14048200  0.82503600  1
  Mn  Mn13  1  0.32242200  0.63738100  0.32497500  1
  Mn  Mn14  1  0.49558500  0.49678700  0.50315300  1
  Mn  Mn15  1  0.50875100  0.02655600  0.00609600  1
  O  O16  1  0.51734200  0.54386400  0.66874500  1
  O  O17  1  0.65543600  0.29425700  0.51574900  1
  O  O18  1  0.52295200  0.04689400  0.17109400  1
  O  O19  1  0.02009700  0.54925200  0.65766100  1
  O  O20  1  0.63974100  0.79875900  0.01548500  1
  O  O21  1  0.12298700  0.28713700  0.52197600  1
  O  O22  1  0.19062200  0.36883500  0.82168300  1
  O  O23  1  0.01948900  0.04178200  0.15197300  1
  O  O24  1  0.31724200  0.12681500  0.67391400  1
  O  O25  1  0.15363800  0.79562200  0.01652500  1
  O  O26  1  0.19477300  0.86475900  0.31610200  1
  O  O27  1  0.71236100  0.39168700  0.81540300  1
  O  O28  1  0.31787100  0.62180800  0.16123100  1
  O  O29  1  0.81541800  0.12354700  0.67654300  1
  O  O30  1  0.87091400  0.22340500  0.98245300  1
  O  O31  1  0.68749000  0.87480000  0.31648900  1
  O  O32  1  0.93400000  0.93159700  0.85056900  1
  O  O33  1  0.81916000  0.62618700  0.17975000  1
  O  O34  1  0.85900600  0.72582100  0.48334400  1
  O  O35  1  0.33476800  0.20827800  0.98235700  1
  O  O36  1  0.96116900  0.44807200  0.35504800  1
  O  O37  1  0.49146900  0.95407500  0.83572400  1
  O  O38  1  0.36118800  0.70830900  0.49436300  1
  O  O39  1  0.49273600  0.44850600  0.33867500  1
