# generated using pymatgen
data_Li2Mn3O6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.18898966
_cell_length_b   5.18898966
_cell_length_c   10.25069000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.09167228
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Mn3O6
_chemical_formula_sum   'Li4 Mn6 O12'
_cell_volume   238.80720212
_cell_formula_units_Z   2
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  0.65329700  0.15329700  0.25000000  1
  Li  Li1  1  0.84670300  0.34670300  0.75000000  1
  Li  Li2  1  0.15329700  0.65329700  0.25000000  1
  Li  Li3  1  0.34670300  0.84670300  0.75000000  1
  Mn  Mn4  1  0.50000000  0.50000000  0.50000000  1
  Mn  Mn5  1  0.00000000  0.00000000  0.00000000  1
  Mn  Mn6  1  0.83642500  0.16357500  0.50000000  1
  Mn  Mn7  1  0.33642500  0.66357500  0.00000000  1
  Mn  Mn8  1  0.66357500  0.33642500  0.00000000  1
  Mn  Mn9  1  0.16357500  0.83642500  0.50000000  1
  O  O10  1  0.67342200  0.67342200  0.09203900  1
  O  O11  1  0.82657800  0.82657800  0.59203900  1
  O  O12  1  0.17342200  0.17342200  0.40796100  1
  O  O13  1  0.47794400  0.84190900  0.39266000  1
  O  O14  1  0.32657800  0.32657800  0.90796100  1
  O  O15  1  0.65809100  0.02205600  0.89266000  1
  O  O16  1  0.97794400  0.34190900  0.10734000  1
  O  O17  1  0.15809100  0.52205600  0.60734000  1
  O  O18  1  0.52205600  0.15809100  0.60734000  1
  O  O19  1  0.84190900  0.47794400  0.39266000  1
  O  O20  1  0.02205600  0.65809100  0.89266000  1
  O  O21  1  0.34190900  0.97794400  0.10734000  1
