# generated using pymatgen
data_LiMn3O6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.92540697
_cell_length_b   5.92540697
_cell_length_c   13.27193085
_cell_angle_alpha   76.79696176
_cell_angle_beta   76.79696176
_cell_angle_gamma   87.63746459
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMn3O6
_chemical_formula_sum   'Li4 Mn12 O24'
_cell_volume   441.64470075
_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  0.36760000  0.61565100  0.75309600  1
  Li  Li1  1  0.95977400  0.71769900  0.58175500  1
  Li  Li2  1  0.61565100  0.36760000  0.25309600  1
  Li  Li3  1  0.71769900  0.95977400  0.08175500  1
  Mn  Mn4  1  0.99457700  0.48815200  0.00347900  1
  Mn  Mn5  1  0.49483900  0.49248200  0.99943100  1
  Mn  Mn6  1  0.84196000  0.33600000  0.83104800  1
  Mn  Mn7  1  0.83811100  0.83897000  0.83513700  1
  Mn  Mn8  1  0.66963300  0.16845400  0.66531100  1
  Mn  Mn9  1  0.16552400  0.17145000  0.66608600  1
  Mn  Mn10  1  0.48815200  0.99457700  0.50347900  1
  Mn  Mn11  1  0.49248200  0.49483900  0.49943100  1
  Mn  Mn12  1  0.33600000  0.84196000  0.33104800  1
  Mn  Mn13  1  0.83897000  0.83811100  0.33513700  1
  Mn  Mn14  1  0.16845400  0.66963300  0.16531100  1
  Mn  Mn15  1  0.17145000  0.16552400  0.16608600  1
  O  O16  1  0.75962700  0.27756200  0.98795200  1
  O  O17  1  0.73806000  0.70522600  0.00170000  1
  O  O18  1  0.59928700  0.56895600  0.84514600  1
  O  O19  1  0.04711100  0.57582200  0.84735700  1
  O  O20  1  0.63681900  0.10054300  0.82206200  1
  O  O21  1  0.07496900  0.10347100  0.81810900  1
  O  O22  1  0.92761800  0.95881400  0.66663300  1
  O  O23  1  0.93003500  0.40680800  0.67868500  1
  O  O24  1  0.39886400  0.93499900  0.65541800  1
  O  O25  1  0.41464300  0.39147800  0.65606900  1
  O  O26  1  0.27278600  0.25101600  0.50988700  1
  O  O27  1  0.69903400  0.23223700  0.50897700  1
  O  O28  1  0.27756200  0.75962700  0.48795200  1
  O  O29  1  0.70522600  0.73806000  0.50170000  1
  O  O30  1  0.56895600  0.59928700  0.34514600  1
  O  O31  1  0.57582200  0.04711100  0.34735700  1
  O  O32  1  0.10347100  0.07496900  0.31810900  1
  O  O33  1  0.10054300  0.63681900  0.32206200  1
  O  O34  1  0.95881400  0.92761800  0.16663300  1
  O  O35  1  0.40680800  0.93003500  0.17868500  1
  O  O36  1  0.39147800  0.41464300  0.15606900  1
  O  O37  1  0.93499900  0.39886400  0.15541800  1
  O  O38  1  0.23223700  0.69903400  0.00897700  1
  O  O39  1  0.25101600  0.27278600  0.00988700  1
