# generated using pymatgen
data_Li3Fe2P2(CO7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.14189600
_cell_length_b   8.38482180
_cell_length_c   12.96955038
_cell_angle_alpha   90.90135425
_cell_angle_beta   89.93650858
_cell_angle_gamma   95.09067785
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Fe2P2(CO7)2
_chemical_formula_sum   'Li6 Fe4 P4 C4 O28'
_cell_volume   556.89309111
_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  0.22428600  0.10869700  0.37645700  1
  Li  Li1  1  0.24241900  0.10089800  0.88179000  1
  Li  Li2  1  0.75281000  0.28581500  0.77069800  1
  Li  Li3  1  0.24719000  0.71418500  0.22930200  1
  Li  Li4  1  0.77571400  0.89130300  0.62354300  1
  Li  Li5  1  0.75758100  0.89910200  0.11821000  1
  Fe  Fe6  1  0.19738900  0.33444300  0.62069000  1
  Fe  Fe7  1  0.19999100  0.32798300  0.12418100  1
  Fe  Fe8  1  0.80261100  0.66555700  0.37931000  1
  Fe  Fe9  1  0.80000900  0.67201700  0.87581900  1
  P  P10  1  0.27570700  0.42134600  0.37118700  1
  P  P11  1  0.27049100  0.42263800  0.87395200  1
  P  P12  1  0.72429300  0.57865400  0.62881300  1
  P  P13  1  0.72950900  0.57736200  0.12604800  1
  C  C14  1  0.29216900  0.03645300  0.13007300  1
  C  C15  1  0.30025500  0.04552100  0.62774100  1
  C  C16  1  0.69974500  0.95447900  0.37225900  1
  C  C17  1  0.70783100  0.96354700  0.86992700  1
  O  O18  1  0.05471600  0.07494300  0.62264000  1
  O  O19  1  0.04967300  0.06958700  0.12501000  1
  O  O20  1  0.61510900  0.08968300  0.37439600  1
  O  O21  1  0.63308900  0.10267400  0.85621700  1
  O  O22  1  0.46462500  0.15835300  0.12058100  1
  O  O23  1  0.46567600  0.17476800  0.63375100  1
  O  O24  1  0.16641200  0.30603200  0.78422600  1
  O  O25  1  0.20794900  0.30380400  0.27993800  1
  O  O26  1  0.19697200  0.31920700  0.46685700  1
  O  O27  1  0.22587700  0.31440200  0.96967800  1
  O  O28  1  0.86479500  0.42316600  0.63758400  1
  O  O29  1  0.87265900  0.42528300  0.12055800  1
  O  O30  1  0.57131400  0.47558100  0.37253800  1
  O  O31  1  0.56923000  0.46690300  0.85792600  1
  O  O32  1  0.42868600  0.52441900  0.62746200  1
  O  O33  1  0.43077000  0.53309700  0.14207400  1
  O  O34  1  0.13520500  0.57683400  0.36241600  1
  O  O35  1  0.12734100  0.57471700  0.87944200  1
  O  O36  1  0.80302800  0.68079300  0.53314300  1
  O  O37  1  0.79205100  0.69619600  0.72006200  1
  O  O38  1  0.77412300  0.68559800  0.03032200  1
  O  O39  1  0.83358800  0.69396800  0.21577400  1
  O  O40  1  0.53432400  0.82523200  0.36624900  1
  O  O41  1  0.53537500  0.84164700  0.87941900  1
  O  O42  1  0.38489100  0.91031700  0.62560400  1
  O  O43  1  0.36691100  0.89732600  0.14378300  1
  O  O44  1  0.94528400  0.92505700  0.37736000  1
  O  O45  1  0.95032700  0.93041300  0.87499000  1
