# generated using pymatgen
data_Li2Fe2(CO3)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.06611351
_cell_length_b   7.64060524
_cell_length_c   8.11412514
_cell_angle_alpha   79.48152135
_cell_angle_beta   100.31074940
_cell_angle_gamma   105.65269243
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Fe2(CO3)3
_chemical_formula_sum   'Li4 Fe4 C6 O18'
_cell_volume   352.68881983
_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  0.12744700  0.14030000  0.58648600  1
  Li  Li1  1  0.12756500  0.64661000  0.08161100  1
  Li  Li2  1  0.72683700  0.84137300  0.28196900  1
  Li  Li3  1  0.72649600  0.34496900  0.78454800  1
  Fe  Fe4  1  0.59676900  0.53711100  0.05932200  1
  Fe  Fe5  1  0.92662700  0.49015100  0.43481800  1
  Fe  Fe6  1  0.92175000  0.99326900  0.93139500  1
  Fe  Fe7  1  0.59360000  0.03944800  0.55403200  1
  C  C8  1  0.24768900  0.86269100  0.38202000  1
  C  C9  1  0.24689600  0.36839300  0.88104900  1
  C  C10  1  0.47195400  0.43058000  0.44190200  1
  C  C11  1  0.46852100  0.93329700  0.94177000  1
  C  C12  1  0.87341500  0.22794200  0.24176800  1
  C  C13  1  0.87360100  0.73115300  0.73962700  1
  O  O14  1  0.06675900  0.75943800  0.30343700  1
  O  O15  1  0.06470800  0.26427700  0.80302600  1
  O  O16  1  0.26869800  0.42371200  0.46475000  1
  O  O17  1  0.26527600  0.92519800  0.96687000  1
  O  O18  1  0.89011900  0.10920900  0.15719200  1
  O  O19  1  0.88953800  0.61321800  0.65364800  1
  O  O20  1  0.23121800  0.97169100  0.48182900  1
  O  O21  1  0.23045200  0.47647600  0.98149400  1
  O  O22  1  0.45674600  0.86109400  0.36841300  1
  O  O23  1  0.45491600  0.36782200  0.86448300  1
  O  O24  1  0.59328700  0.32428400  0.54190000  1
  O  O25  1  0.59025400  0.82515400  0.03881000  1
  O  O26  1  0.86913700  0.18817700  0.40614900  1
  O  O27  1  0.86392700  0.68919400  0.90313200  1
  O  O28  1  0.57555900  0.04808100  0.82276800  1
  O  O29  1  0.58069400  0.54324500  0.32201100  1
  O  O30  1  0.86896300  0.90183400  0.67697600  1
  O  O31  1  0.86356500  0.39710100  0.17728400  1
