# generated using pymatgen
data_Li3MnFe3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.88183925
_cell_length_b   5.88183925
_cell_length_c   9.57266200
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999161
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3MnFe3O8
_chemical_formula_sum   'Li6 Mn2 Fe6 O16'
_cell_volume   286.80696645
_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  0.17318200  0.82681800  0.05702100  1
  Li  Li1  1  0.65363500  0.82681800  0.05702100  1
  Li  Li2  1  0.17318200  0.34636500  0.05702100  1
  Li  Li3  1  0.82681800  0.65363500  0.55702100  1
  Li  Li4  1  0.34636500  0.17318200  0.55702100  1
  Li  Li5  1  0.82681800  0.17318200  0.55702100  1
  Mn  Mn6  1  0.33333300  0.66666700  0.51391800  1
  Mn  Mn7  1  0.66666700  0.33333300  0.01391800  1
  Fe  Fe8  1  0.16815900  0.83184100  0.78874300  1
  Fe  Fe9  1  0.66368300  0.83184100  0.78874300  1
  Fe  Fe10  1  0.16815900  0.33631700  0.78874300  1
  Fe  Fe11  1  0.83184100  0.66368300  0.28874300  1
  Fe  Fe12  1  0.33631700  0.16815900  0.28874300  1
  Fe  Fe13  1  0.83184100  0.16815900  0.28874300  1
  O  O14  1  0.16866400  0.83133600  0.40685600  1
  O  O15  1  0.47912000  0.95823900  0.64889000  1
  O  O16  1  0.04176100  0.52088000  0.64889000  1
  O  O17  1  0.33333300  0.66666700  0.90447300  1
  O  O18  1  0.66267300  0.83133600  0.40685600  1
  O  O19  1  0.47912000  0.52088000  0.64889000  1
  O  O20  1  0.16866400  0.33732700  0.40685600  1
  O  O21  1  0.83133600  0.66267300  0.90685600  1
  O  O22  1  0.52088000  0.47912000  0.14889000  1
  O  O23  1  0.95823900  0.47912000  0.14889000  1
  O  O24  1  0.66666700  0.33333300  0.40447300  1
  O  O25  1  0.00000000  0.00000000  0.17804700  1
  O  O26  1  0.33732700  0.16866400  0.90685600  1
  O  O27  1  0.00000000  0.00000000  0.67804700  1
  O  O28  1  0.52088000  0.04176100  0.14889000  1
  O  O29  1  0.83133600  0.16866400  0.90685600  1
