# generated using pymatgen
data_LiMn3O6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.69840430
_cell_length_b   5.69839184
_cell_length_c   12.74734299
_cell_angle_alpha   77.03639305
_cell_angle_beta   77.03599403
_cell_angle_gamma   89.89481680
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMn3O6
_chemical_formula_sum   'Li4 Mn12 O24'
_cell_volume   392.58411345
_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  0.37360117  0.62353329  0.75330989  1
  Li  Li1  1  0.95862241  0.71179377  0.58033451  1
  Li  Li2  1  0.62353151  0.37360068  0.25331603  1
  Li  Li3  1  0.71180178  0.95864047  0.08029145  1
  Mn  Mn4  1  0.00330398  0.49950408  0.99991472  1
  Mn  Mn5  1  0.49691283  0.49954681  0.99987423  1
  Mn  Mn6  1  0.83311278  0.33079751  0.83326963  1
  Mn  Mn7  1  0.83296777  0.83712158  0.83351086  1
  Mn  Mn8  1  0.66591841  0.16727502  0.66671410  1
  Mn  Mn9  1  0.16598060  0.16732179  0.66661138  1
  Mn  Mn10  1  0.49947486  0.00326175  0.49995330  1
  Mn  Mn11  1  0.49952497  0.49690613  0.49990637  1
  Mn  Mn12  1  0.33077654  0.83311082  0.33327170  1
  Mn  Mn13  1  0.83712974  0.83296234  0.33351835  1
  Mn  Mn14  1  0.16728828  0.66593800  0.16669220  1
  Mn  Mn15  1  0.16733302  0.16598982  0.16659174  1
  O  O16  1  0.75495525  0.27993723  0.99108767  1
  O  O17  1  0.75405377  0.72789651  0.99128364  1
  O  O18  1  0.60486982  0.57985252  0.84204495  1
  O  O19  1  0.05282763  0.57913318  0.84201790  1
  O  O20  1  0.61701653  0.08931929  0.82362842  1
  O  O21  1  0.05870049  0.08848956  0.82348134  1
  O  O22  1  0.91219089  0.93780149  0.67493049  1
  O  O23  1  0.91151867  0.38891500  0.67470533  1
  O  O24  1  0.42031543  0.94564183  0.65858519  1
  O  O25  1  0.41964618  0.39678228  0.65848162  1
  O  O26  1  0.27382752  0.24564572  0.50968361  1
  O  O27  1  0.71532747  0.24474926  0.50981274  1
  O  O28  1  0.27988496  0.75491016  0.49118428  1
  O  O29  1  0.72786217  0.75400425  0.49138238  1
  O  O30  1  0.57981823  0.60483355  0.34211529  1
  O  O31  1  0.57909385  0.05279099  0.34209122  1
  O  O32  1  0.08848467  0.05869791  0.32348798  1
  O  O33  1  0.08931669  0.61701174  0.32363549  1
  O  O34  1  0.93780988  0.91218121  0.17494891  1
  O  O35  1  0.38889377  0.91151290  0.17472458  1
  O  O36  1  0.39681799  0.41968696  0.15839378  1
  O  O37  1  0.94569395  0.42036192  0.15849560  1
  O  O38  1  0.24478043  0.71534079  0.00976087  1
  O  O39  1  0.24567313  0.27386390  0.00963223  1
