# generated using pymatgen
data_LiMn3O6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.95297643
_cell_length_b   5.92704015
_cell_length_c   13.15331885
_cell_angle_alpha   102.89562261
_cell_angle_beta   103.22735835
_cell_angle_gamma   88.34825936
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMn3O6
_chemical_formula_sum   'Li4 Mn12 O24'
_cell_volume   440.26720971
_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  0.87017600  0.61466400  0.24555800  1
  Li  Li1  1  0.46702100  0.71486400  0.41959300  1
  Li  Li2  1  0.11995500  0.37490600  0.75101500  1
  Li  Li3  1  0.21205800  0.96909000  0.91899400  1
  Mn  Mn4  1  0.99557900  0.49381900  0.00034200  1
  Mn  Mn5  1  0.49710500  0.49398900  0.99677600  1
  Mn  Mn6  1  0.33964400  0.83803200  0.16351600  1
  Mn  Mn7  1  0.34418800  0.33729100  0.16784700  1
  Mn  Mn8  1  0.66600500  0.16156400  0.33064400  1
  Mn  Mn9  1  0.16058100  0.16188300  0.32860500  1
  Mn  Mn10  1  0.99607100  0.49436200  0.50176600  1
  Mn  Mn11  1  0.99024500  0.99563800  0.49727100  1
  Mn  Mn12  1  0.33424900  0.84377200  0.66807900  1
  Mn  Mn13  1  0.83614900  0.84517800  0.67175500  1
  Mn  Mn14  1  0.65958200  0.16849900  0.83431900  1
  Mn  Mn15  1  0.66505800  0.66641600  0.83412200  1
  O  O16  1  0.27404300  0.74066000  0.01058800  1
  O  O17  1  0.25771600  0.28759500  0.01118500  1
  O  O18  1  0.55329500  0.57581800  0.15450400  1
  O  O19  1  0.12231400  0.58931800  0.16174900  1
  O  O20  1  0.55990000  0.08359900  0.17522400  1
  O  O21  1  0.13465900  0.09712200  0.17139000  1
  O  O22  1  0.43631600  0.39648900  0.32032800  1
  O  O23  1  0.41421900  0.94119600  0.32181300  1
  O  O24  1  0.90489400  0.36808400  0.32670800  1
  O  O25  1  0.89568800  0.92415800  0.34428200  1
  O  O26  1  0.19620800  0.23099600  0.48686800  1
  O  O27  1  0.76654800  0.23639000  0.48496900  1
  O  O28  1  0.22569700  0.75724900  0.51105400  1
  O  O29  1  0.78449500  0.75715300  0.51455600  1
  O  O30  1  0.07225400  0.05679400  0.65519200  1
  O  O31  1  0.09138300  0.63378100  0.67334700  1
  O  O32  1  0.59440900  0.63611300  0.67901000  1
  O  O33  1  0.58431400  0.06085000  0.67640700  1
  O  O34  1  0.88949800  0.93157700  0.82526900  1
  O  O35  1  0.43100000  0.92908100  0.82218400  1
  O  O36  1  0.43305400  0.40875300  0.84316200  1
  O  O37  1  0.88677800  0.40059200  0.84030800  1
  O  O38  1  0.71394200  0.25450100  0.98570700  1
  O  O39  1  0.73607500  0.69764900  0.98812500  1
