# generated using pymatgen
data_LiMn3O6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.92704000
_cell_length_b   5.95297649
_cell_length_c   13.13828500
_cell_angle_alpha   102.94548643
_cell_angle_beta   102.14408061
_cell_angle_gamma   91.65173585
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMn3O6
_chemical_formula_sum   'Li4 Mn12 O24'
_cell_volume   440.26718539
_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  0.61466400  0.88426600  0.24555800  1
  Li  Li1  1  0.71486400  0.11338600  0.41959300  1
  Li  Li2  1  0.37490600  0.12902900  0.75101500  1
  Li  Li3  1  0.96909000  0.86894800  0.91899400  1
  Mn  Mn4  1  0.49381900  0.00407900  0.00034200  1
  Mn  Mn5  1  0.49398900  0.50611800  0.99677600  1
  Mn  Mn6  1  0.83803200  0.49683900  0.16351600  1
  Mn  Mn7  1  0.33729100  0.48796600  0.16784700  1
  Mn  Mn8  1  0.16156400  0.00335100  0.33064400  1
  Mn  Mn9  1  0.16188300  0.51081400  0.32860500  1
  Mn  Mn10  1  0.49436200  0.50216300  0.50176600  1
  Mn  Mn11  1  0.99563800  0.51248400  0.49727100  1
  Mn  Mn12  1  0.84377200  0.99767200  0.66807900  1
  Mn  Mn13  1  0.84517800  0.49209600  0.67175500  1
  Mn  Mn14  1  0.16849900  0.50609800  0.83431900  1
  Mn  Mn15  1  0.66641600  0.50082100  0.83412200  1
  O  O16  1  0.74066000  0.71536900  0.01058800  1
  O  O17  1  0.28759500  0.73109900  0.01118500  1
  O  O18  1  0.57581800  0.29220100  0.15450400  1
  O  O19  1  0.58931800  0.71593700  0.16174900  1
  O  O20  1  0.08359900  0.26487600  0.17522400  1
  O  O21  1  0.09712200  0.69395200  0.17139000  1
  O  O22  1  0.39648900  0.24335600  0.32032800  1
  O  O23  1  0.94119600  0.26396700  0.32181300  1
  O  O24  1  0.36808400  0.76839800  0.32670800  1
  O  O25  1  0.92415800  0.76003000  0.34428200  1
  O  O26  1  0.23099600  0.31692400  0.48686800  1
  O  O27  1  0.23639000  0.74848400  0.48496900  1
  O  O28  1  0.75724900  0.26324900  0.51105400  1
  O  O29  1  0.75715300  0.70094900  0.51455600  1
  O  O30  1  0.05679400  0.27255400  0.65519200  1
  O  O31  1  0.63378100  0.23527000  0.67334700  1
  O  O32  1  0.63611300  0.72658100  0.67901000  1
  O  O33  1  0.06085000  0.73928000  0.67640700  1
  O  O34  1  0.93157700  0.28523300  0.82526900  1
  O  O35  1  0.92908100  0.74681600  0.82218400  1
  O  O36  1  0.40875300  0.72378400  0.84316200  1
  O  O37  1  0.40059200  0.27291500  0.84030800  1
  O  O38  1  0.25450100  0.30035200  0.98570700  1
  O  O39  1  0.69764900  0.27580000  0.98812500  1
