# generated using pymatgen
data_Li2FePCO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.07340200
_cell_length_b   8.45584845
_cell_length_c   12.83393620
_cell_angle_alpha   94.48551779
_cell_angle_beta   93.64363948
_cell_angle_gamma   95.52513850
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2FePCO7
_chemical_formula_sum   'Li8 Fe4 P4 C4 O28'
_cell_volume   544.93490550
_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  0.24448400  0.25797000  0.28210800  1
  Li  Li1  1  0.28336400  0.91853900  0.09781700  1
  Li  Li2  1  0.20770700  0.24875400  0.77577400  1
  Li  Li3  1  0.12681200  0.21926200  0.50835600  1
  Li  Li4  1  0.71663600  0.08146100  0.90218300  1
  Li  Li5  1  0.87318800  0.78073800  0.49164400  1
  Li  Li6  1  0.79229300  0.75124600  0.22422600  1
  Li  Li7  1  0.75551600  0.74203000  0.71789200  1
  Fe  Fe8  1  0.30145500  0.65588100  0.87733700  1
  Fe  Fe9  1  0.32326800  0.66074700  0.37696500  1
  Fe  Fe10  1  0.69854500  0.34411900  0.12266300  1
  Fe  Fe11  1  0.67673200  0.33925300  0.62303500  1
  P  P12  1  0.23883000  0.58356800  0.12190700  1
  P  P13  1  0.21571000  0.57488800  0.62164300  1
  P  P14  1  0.76117000  0.41643200  0.87809300  1
  P  P15  1  0.78429000  0.42511200  0.37835700  1
  C  C16  1  0.17018100  0.93615800  0.85820700  1
  C  C17  1  0.24902300  0.94952400  0.37797000  1
  C  C18  1  0.82981900  0.06384200  0.14179300  1
  C  C19  1  0.75097700  0.05047600  0.62203000  1
  O  O20  1  0.41833500  0.91462000  0.88281100  1
  O  O21  1  0.36007200  0.42786600  0.09384300  1
  O  O22  1  0.39269200  0.67722100  0.22097000  1
  O  O23  1  0.48078800  0.89884900  0.39187400  1
  O  O24  1  0.32439600  0.41243900  0.58900800  1
  O  O25  1  0.38326600  0.65434300  0.71999300  1
  O  O26  1  0.25926600  0.69772600  0.03274800  1
  O  O27  1  0.08512800  0.07311500  0.85692100  1
  O  O28  1  0.22602800  0.68242000  0.52992200  1
  O  O29  1  0.20487500  0.09483000  0.38186800  1
  O  O30  1  0.05898000  0.45160900  0.85549700  1
  O  O31  1  0.98950400  0.19511000  0.16009000  1
  O  O32  1  0.08228800  0.45649500  0.35176500  1
  O  O33  1  0.95094900  0.16867500  0.64041300  1
  O  O34  1  0.01049600  0.80489000  0.83991000  1
  O  O35  1  0.94102000  0.54839100  0.14450300  1
  O  O36  1  0.04905100  0.83132500  0.35958700  1
  O  O37  1  0.91771200  0.54350500  0.64823500  1
  O  O38  1  0.91487200  0.92688500  0.14307900  1
  O  O39  1  0.74073400  0.30227400  0.96725200  1
  O  O40  1  0.79512500  0.90517000  0.61813200  1
  O  O41  1  0.77397200  0.31758000  0.47007800  1
  O  O42  1  0.63992800  0.57213400  0.90615700  1
  O  O43  1  0.58166500  0.08538000  0.11718900  1
  O  O44  1  0.61673400  0.34565700  0.28000700  1
  O  O45  1  0.67560400  0.58756100  0.41099200  1
  O  O46  1  0.51921200  0.10115100  0.60812600  1
  O  O47  1  0.60730800  0.32277900  0.77903000  1
