# generated using pymatgen
data_Li2Mn3O6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.21465691
_cell_length_b   5.21465691
_cell_length_c   10.83270831
_cell_angle_alpha   71.15836626
_cell_angle_beta   71.15836626
_cell_angle_gamma   57.57434498
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Mn3O6
_chemical_formula_sum   'Li4 Mn6 O12'
_cell_volume   231.14601019
_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  0.23383000  0.40697300  0.24166200  1
  Li  Li1  1  0.58009700  0.72235500  0.24004200  1
  Li  Li2  1  0.40697300  0.23383000  0.74166200  1
  Li  Li3  1  0.72235500  0.58009700  0.74004200  1
  Mn  Mn4  1  0.33108800  0.17822700  0.00295600  1
  Mn  Mn5  1  0.17822700  0.33108800  0.50295600  1
  Mn  Mn6  1  0.00258800  0.84877400  0.98921300  1
  Mn  Mn7  1  0.51421600  0.66633800  0.50581800  1
  Mn  Mn8  1  0.84877400  0.00258800  0.48921300  1
  Mn  Mn9  1  0.66633800  0.51421600  0.00581800  1
  O  O10  1  0.98284300  0.48122000  0.10756000  1
  O  O11  1  0.79590700  0.32178300  0.61227400  1
  O  O12  1  0.23097600  0.04226900  0.40250100  1
  O  O13  1  0.04226900  0.23097600  0.90250100  1
  O  O14  1  0.61452400  0.12665900  0.09930500  1
  O  O15  1  0.36479800  0.54140100  0.89148300  1
  O  O16  1  0.48122000  0.98284300  0.60756000  1
  O  O17  1  0.54140100  0.36479800  0.39148300  1
  O  O18  1  0.90221100  0.66440500  0.39025400  1
  O  O19  1  0.66440500  0.90221100  0.89025400  1
  O  O20  1  0.32178300  0.79590700  0.11227400  1
  O  O21  1  0.12665900  0.61452400  0.59930500  1
