# generated using pymatgen
data_Li5MnO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.80422200
_cell_length_b   12.80422200
_cell_length_c   4.70173700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5MnO4
_chemical_formula_sum   'Li40 Mn8 O32'
_cell_volume   770.84085267
_cell_formula_units_Z   8
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  0.98599500  0.01400500  0.25000000  1
  Li  Li1  1  0.01400500  0.98599500  0.75000000  1
  Li  Li2  1  0.98599500  0.48599500  0.25000000  1
  Li  Li3  1  0.01400500  0.51400500  0.75000000  1
  Li  Li4  1  0.10976000  0.35684900  0.80650200  1
  Li  Li5  1  0.10976000  0.14315100  0.80650200  1
  Li  Li6  1  0.12191800  0.62191800  0.25000000  1
  Li  Li7  1  0.12191800  0.87808200  0.25000000  1
  Li  Li8  1  0.14315100  0.10976000  0.30650200  1
  Li  Li9  1  0.14315100  0.39024000  0.30650200  1
  Li  Li10  1  0.25000000  0.25000000  0.35797800  1
  Li  Li11  1  0.25000000  0.75000000  0.75000000  1
  Li  Li12  1  0.25000000  0.75000000  0.25000000  1
  Li  Li13  1  0.25000000  0.25000000  0.85797800  1
  Li  Li14  1  0.35684900  0.10976000  0.30650200  1
  Li  Li15  1  0.35684900  0.39024000  0.30650200  1
  Li  Li16  1  0.37808200  0.62191800  0.25000000  1
  Li  Li17  1  0.37808200  0.87808200  0.25000000  1
  Li  Li18  1  0.39024000  0.14315100  0.80650200  1
  Li  Li19  1  0.39024000  0.35684900  0.80650200  1
  Li  Li20  1  0.51400500  0.48599500  0.25000000  1
  Li  Li21  1  0.48599500  0.51400500  0.75000000  1
  Li  Li22  1  0.51400500  0.01400500  0.25000000  1
  Li  Li23  1  0.48599500  0.98599500  0.75000000  1
  Li  Li24  1  0.60976000  0.64315100  0.19349800  1
  Li  Li25  1  0.60976000  0.85684900  0.19349800  1
  Li  Li26  1  0.62191800  0.12191800  0.75000000  1
  Li  Li27  1  0.62191800  0.37808200  0.75000000  1
  Li  Li28  1  0.64315100  0.60976000  0.69349800  1
  Li  Li29  1  0.64315100  0.89024000  0.69349800  1
  Li  Li30  1  0.75000000  0.25000000  0.25000000  1
  Li  Li31  1  0.75000000  0.25000000  0.75000000  1
  Li  Li32  1  0.75000000  0.75000000  0.14202200  1
  Li  Li33  1  0.75000000  0.75000000  0.64202200  1
  Li  Li34  1  0.85684900  0.60976000  0.69349800  1
  Li  Li35  1  0.85684900  0.89024000  0.69349800  1
  Li  Li36  1  0.87808200  0.12191800  0.75000000  1
  Li  Li37  1  0.87808200  0.37808200  0.75000000  1
  Li  Li38  1  0.89024000  0.64315100  0.19349800  1
  Li  Li39  1  0.89024000  0.85684900  0.19349800  1
  Mn  Mn40  1  0.02115900  0.75000000  0.71261300  1
  Mn  Mn41  1  0.25000000  0.52115900  0.78738700  1
  Mn  Mn42  1  0.25000000  0.97884100  0.78738700  1
  Mn  Mn43  1  0.47884100  0.75000000  0.71261300  1
  Mn  Mn44  1  0.52115900  0.25000000  0.28738700  1
  Mn  Mn45  1  0.75000000  0.02115900  0.21261300  1
  Mn  Mn46  1  0.75000000  0.47884100  0.21261300  1
  Mn  Mn47  1  0.97884100  0.25000000  0.28738700  1
  O  O48  1  0.00621300  0.12502700  0.51221700  1
  O  O49  1  0.00621300  0.37497300  0.51221700  1
  O  O50  1  0.12502700  0.00621300  0.01221700  1
  O  O51  1  0.12502700  0.49378700  0.01221700  1
  O  O52  1  0.12840500  0.25000000  0.09546400  1
  O  O53  1  0.12623600  0.75000000  0.00169400  1
  O  O54  1  0.25000000  0.12840500  0.59546400  1
  O  O55  1  0.25000000  0.62623600  0.49830600  1
  O  O56  1  0.25000000  0.87376400  0.49830600  1
  O  O57  1  0.25000000  0.37159500  0.59546400  1
  O  O58  1  0.37376400  0.75000000  0.00169400  1
  O  O59  1  0.37159500  0.25000000  0.09546400  1
  O  O60  1  0.37497300  0.49378700  0.01221700  1
  O  O61  1  0.37497300  0.00621300  0.01221700  1
  O  O62  1  0.49378700  0.12502700  0.51221700  1
  O  O63  1  0.49378700  0.37497300  0.51221700  1
  O  O64  1  0.50621300  0.62502700  0.48778300  1
  O  O65  1  0.50621300  0.87497300  0.48778300  1
  O  O66  1  0.62502700  0.99378700  0.98778300  1
  O  O67  1  0.62502700  0.50621300  0.98778300  1
  O  O68  1  0.62840500  0.75000000  0.90453600  1
  O  O69  1  0.62623600  0.25000000  0.99830500  1
  O  O70  1  0.75000000  0.12623600  0.50169500  1
  O  O71  1  0.75000000  0.37376400  0.50169500  1
  O  O72  1  0.75000000  0.62840500  0.40453600  1
  O  O73  1  0.75000000  0.87159500  0.40453600  1
  O  O74  1  0.87376400  0.25000000  0.99830500  1
  O  O75  1  0.87159500  0.75000000  0.90453600  1
  O  O76  1  0.87497300  0.99378700  0.98778300  1
  O  O77  1  0.87497300  0.50621300  0.98778300  1
  O  O78  1  0.99378700  0.62502700  0.48778300  1
  O  O79  1  0.99378700  0.87497300  0.48778300  1
