# generated using pymatgen
data_Li2Fe2(CO3)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.50129700
_cell_length_b   7.51535163
_cell_length_c   7.56883670
_cell_angle_alpha   107.97858559
_cell_angle_beta   108.18734635
_cell_angle_gamma   107.77792001
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Fe2(CO3)3
_chemical_formula_sum   'Li4 Fe4 C6 O18'
_cell_volume   345.39661846
_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  0.65865500  0.12679300  0.38575000  1
  Li  Li1  1  0.38688300  0.65713700  0.12603200  1
  Li  Li2  1  0.15226200  0.15619800  0.15755300  1
  Li  Li3  1  0.12380900  0.38550800  0.65866400  1
  Fe  Fe4  1  0.96422200  0.85265800  0.46281500  1
  Fe  Fe5  1  0.57716300  0.57324800  0.58282100  1
  Fe  Fe6  1  0.85634200  0.46420500  0.97022100  1
  Fe  Fe7  1  0.46202000  0.96786000  0.85517500  1
  C  C8  1  0.75398100  0.84101400  0.07572700  1
  C  C9  1  0.61320400  0.41235200  0.20191700  1
  C  C10  1  0.83992400  0.07593900  0.75298000  1
  C  C11  1  0.20608100  0.61064300  0.41261000  1
  C  C12  1  0.40603200  0.20148100  0.60699100  1
  C  C13  1  0.07543900  0.75367700  0.84193200  1
  O  O14  1  0.94147400  0.96228000  0.22205400  1
  O  O15  1  0.59966900  0.88782100  0.08677000  1
  O  O16  1  0.62873800  0.30171600  0.04122700  1
  O  O17  1  0.64481700  0.60310700  0.24355600  1
  O  O18  1  0.88793600  0.08989900  0.60125500  1
  O  O19  1  0.56717000  0.33085200  0.31767800  1
  O  O20  1  0.92129700  0.70772000  0.67177100  1
  O  O21  1  0.67103300  0.92252700  0.71019300  1
  O  O22  1  0.31834000  0.55963000  0.32668200  1
  O  O23  1  0.96366500  0.22040600  0.94093800  1
  O  O24  1  0.60097700  0.25805600  0.64419000  1
  O  O25  1  0.31344300  0.30643500  0.54831100  1
  O  O26  1  0.71398200  0.67406100  0.92192000  1
  O  O27  1  0.30351900  0.04111000  0.62769100  1
  O  O28  1  0.04290200  0.62654500  0.30639000  1
  O  O29  1  0.25736800  0.64522300  0.60454200  1
  O  O30  1  0.21788100  0.94319900  0.96343900  1
  O  O31  1  0.09127400  0.60220000  0.89150800  1
