# generated using pymatgen
data_LiFeCO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.34128789
_cell_length_b   8.34128789
_cell_length_c   6.08252700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   121.25304726
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFeCO4
_chemical_formula_sum   'Li4 Fe4 C4 O16'
_cell_volume   361.79086478
_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  0.20716000  0.02969600  0.50167100  1
  Li  Li1  1  0.02969600  0.20716000  0.00167100  1
  Li  Li2  1  0.97030400  0.79284000  0.00167100  1
  Li  Li3  1  0.79284000  0.97030400  0.50167100  1
  Fe  Fe4  1  0.70218500  0.27818700  0.76208700  1
  Fe  Fe5  1  0.72181300  0.29781500  0.26208700  1
  Fe  Fe6  1  0.27818700  0.70218500  0.26208700  1
  Fe  Fe7  1  0.29781500  0.72181300  0.76208700  1
  C  C8  1  0.35541900  0.15360200  0.02301900  1
  C  C9  1  0.84639800  0.64458100  0.52301900  1
  C  C10  1  0.15360200  0.35541900  0.52301900  1
  C  C11  1  0.64458100  0.84639800  0.02301900  1
  O  O12  1  0.18252000  0.08831400  0.03563300  1
  O  O13  1  0.43652900  0.17401100  0.83081300  1
  O  O14  1  0.45580900  0.19933400  0.20458300  1
  O  O15  1  0.73102900  0.17155500  0.50868600  1
  O  O16  1  0.82844500  0.26897100  0.00868600  1
  O  O17  1  0.08831400  0.18252000  0.53563300  1
  O  O18  1  0.80066600  0.54419100  0.70458300  1
  O  O19  1  0.82598900  0.56347100  0.33081300  1
  O  O20  1  0.17401100  0.43652900  0.33081300  1
  O  O21  1  0.19933400  0.45580900  0.70458300  1
  O  O22  1  0.91168600  0.81748000  0.53563300  1
  O  O23  1  0.17155500  0.73102900  0.00868600  1
  O  O24  1  0.26897100  0.82844500  0.50868600  1
  O  O25  1  0.54419100  0.80066600  0.20458300  1
  O  O26  1  0.56347100  0.82598900  0.83081300  1
  O  O27  1  0.81748000  0.91168600  0.03563300  1
