# generated using pymatgen
data_LiFePCO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.12281000
_cell_length_b   6.31467065
_cell_length_c   8.69266276
_cell_angle_alpha   85.32555338
_cell_angle_beta   88.47374689
_cell_angle_gamma   87.66421277
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFePCO7
_chemical_formula_sum   'Li2 Fe2 P2 C2 O14'
_cell_volume   279.95279265
_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  0.29595900  0.11746700  0.72874600  1
  Li  Li1  1  0.81693600  0.60104000  0.18218100  1
  Fe  Fe2  1  0.89160100  0.84998800  0.61690100  1
  Fe  Fe3  1  0.30545100  0.37097300  0.32386500  1
  P  P4  1  0.79897600  0.36609500  0.54475000  1
  P  P5  1  0.41411800  0.86964700  0.38943800  1
  C  C6  1  0.38034600  0.38221900  0.01684000  1
  C  C7  1  0.79171300  0.87412600  0.90251100  1
  O  O8  1  0.02316300  0.84717300  0.83923100  1
  O  O9  1  0.60281600  0.89763700  0.80574300  1
  O  O10  1  0.37075400  0.32750000  0.88098200  1
  O  O11  1  0.93627000  0.16895200  0.62823900  1
  O  O12  1  0.81540000  0.55137500  0.64709700  1
  O  O13  1  0.50843200  0.31934300  0.51438700  1
  O  O14  1  0.25312200  0.83739700  0.54221400  1
  O  O15  1  0.94028900  0.42245800  0.38463400  1
  O  O16  1  0.70569100  0.89500900  0.42946000  1
  O  O17  1  0.31761800  0.06981500  0.29064100  1
  O  O18  1  0.40531200  0.67279200  0.29433400  1
  O  O19  1  0.76557200  0.87130500  0.04663700  1
  O  O20  1  0.59697500  0.39177100  0.08682500  1
  O  O21  1  0.16944100  0.42444400  0.09618000  1
