# generated using pymatgen
data_Li3CrFe3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.89277625
_cell_length_b   5.89277625
_cell_length_c   9.58604800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000277
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3CrFe3O8
_chemical_formula_sum   'Li6 Cr2 Fe6 O16'
_cell_volume   288.27708421
_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  0.65743800  0.82871900  0.05593300  1
  Li  Li1  1  0.17128100  0.34256200  0.05593300  1
  Li  Li2  1  0.17128100  0.82871900  0.05593300  1
  Li  Li3  1  0.82871900  0.17128100  0.55593300  1
  Li  Li4  1  0.82871900  0.65743800  0.55593300  1
  Li  Li5  1  0.34256200  0.17128100  0.55593300  1
  Cr  Cr6  1  0.33333300  0.66666700  0.51187000  1
  Cr  Cr7  1  0.66666700  0.33333300  0.01187000  1
  Fe  Fe8  1  0.66198200  0.83099100  0.78709000  1
  Fe  Fe9  1  0.16900900  0.33801800  0.78709000  1
  Fe  Fe10  1  0.16900900  0.83099100  0.78709000  1
  Fe  Fe11  1  0.83099100  0.16900900  0.28709000  1
  Fe  Fe12  1  0.83099100  0.66198200  0.28709000  1
  Fe  Fe13  1  0.33801800  0.16900900  0.28709000  1
  O  O14  1  0.66490700  0.83245300  0.40775800  1
  O  O15  1  0.48012400  0.51987600  0.65107100  1
  O  O16  1  0.33333300  0.66666700  0.90374500  1
  O  O17  1  0.48012400  0.96024700  0.65107100  1
  O  O18  1  0.16754700  0.33509300  0.40775800  1
  O  O19  1  0.03975300  0.51987600  0.65107100  1
  O  O20  1  0.16754700  0.83245300  0.40775800  1
  O  O21  1  0.83245300  0.16754700  0.90775800  1
  O  O22  1  0.96024700  0.48012400  0.15107100  1
  O  O23  1  0.66666700  0.33333300  0.40374500  1
  O  O24  1  0.51987600  0.03975300  0.15107100  1
  O  O25  1  0.83245300  0.66490700  0.90775800  1
  O  O26  1  0.00000000  0.00000000  0.67765500  1
  O  O27  1  0.00000000  0.00000000  0.17765500  1
  O  O28  1  0.51987600  0.48012400  0.15107100  1
  O  O29  1  0.33509300  0.16754700  0.90775800  1
