# generated using pymatgen
data_LiMn3O6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.11731072
_cell_length_b   7.11731072
_cell_length_c   5.02775096
_cell_angle_alpha   89.52158409
_cell_angle_beta   89.52158409
_cell_angle_gamma   23.66112510
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMn3O6
_chemical_formula_sum   'Li1 Mn3 O6'
_cell_volume   102.20862544
_cell_formula_units_Z   1
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  0.79349300  0.79349300  0.07164900  1
  Mn  Mn1  1  0.00285500  0.00285500  0.00295400  1
  Mn  Mn2  1  0.34264700  0.34264700  0.54516400  1
  Mn  Mn3  1  0.65398100  0.65398100  0.46998800  1
  O  O4  1  0.57407400  0.57407400  0.15949000  1
  O  O5  1  0.42288100  0.42288100  0.86060100  1
  O  O6  1  0.09442200  0.09442200  0.64590800  1
  O  O7  1  0.89958500  0.89958500  0.35422400  1
  O  O8  1  0.23356900  0.23356900  0.29711000  1
  O  O9  1  0.76706900  0.76706900  0.70657400  1
