# generated using pymatgen
data_Na2LiFePCO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.82365350
_cell_length_b   6.80647520
_cell_length_c   10.22272519
_cell_angle_alpha   90.06068748
_cell_angle_beta   88.13501356
_cell_angle_gamma   89.60749440
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na2LiFePCO7
_chemical_formula_sum   'Na8 Li4 Fe4 P4 C4 O28'
_cell_volume   613.61609040
_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
  Na  Na0  1  0.08447500  0.24499200  0.88023600  1
  Na  Na1  1  0.26261400  0.00140100  0.62643300  1
  Na  Na2  1  0.26253300  0.49713500  0.62465400  1
  Na  Na3  1  0.26176400  0.00271600  0.12686400  1
  Na  Na4  1  0.26149700  0.49964700  0.12686500  1
  Na  Na5  1  0.74283300  0.50065100  0.87094700  1
  Na  Na6  1  0.73803500  0.50247500  0.37798400  1
  Na  Na7  1  0.73759400  0.99858500  0.37494700  1
  Li  Li8  1  0.08918600  0.24891200  0.37638100  1
  Li  Li9  1  0.71868200  0.96939000  0.88395600  1
  Li  Li10  1  0.90139700  0.76251600  0.62325900  1
  Li  Li11  1  0.90013000  0.75508800  0.12479800  1
  Fe  Fe12  1  0.35900000  0.74735900  0.88388700  1
  Fe  Fe13  1  0.35017000  0.75183700  0.39131100  1
  Fe  Fe14  1  0.65071200  0.24671800  0.61521800  1
  Fe  Fe15  1  0.65250600  0.24743700  0.10778600  1
  P  P16  1  0.41625100  0.24184000  0.85287700  1
  P  P17  1  0.40801900  0.25147500  0.35667000  1
  P  P18  1  0.59964700  0.75365400  0.64636100  1
  P  P19  1  0.59062800  0.74925100  0.14148500  1
  C  C20  1  0.04375600  0.75887500  0.86635000  1
  C  C21  1  0.04883600  0.75087100  0.35957200  1
  C  C22  1  0.95181400  0.25002600  0.62952600  1
  C  C23  1  0.94299700  0.25056800  0.14590100  1
  O  O24  1  0.09314700  0.25112800  0.65509700  1
  O  O25  1  0.08611100  0.25246500  0.16871400  1
  O  O26  1  0.07177400  0.75225700  0.99015400  1
  O  O27  1  0.08092100  0.75251600  0.48312100  1
  O  O28  1  0.15725400  0.74583800  0.77996900  1
  O  O29  1  0.16024200  0.75239400  0.27160300  1
  O  O30  1  0.31550100  0.06349200  0.89282400  1
  O  O31  1  0.32756000  0.42953800  0.89848900  1
  O  O32  1  0.30907700  0.06997100  0.39478600  1
  O  O33  1  0.30801400  0.43415300  0.39396700  1
  O  O34  1  0.43674500  0.24683100  0.70031400  1
  O  O35  1  0.44146800  0.74894800  0.58412500  1
  O  O36  1  0.44071800  0.25095300  0.20495900  1
  O  O37  1  0.43577500  0.75140000  0.07473900  1
  O  O38  1  0.57665600  0.22701800  0.91066300  1
  O  O39  1  0.57528000  0.76840800  0.79903800  1
  O  O40  1  0.56131800  0.25233200  0.42607200  1
  O  O41  1  0.56085900  0.75704800  0.29278700  1
  O  O42  1  0.69720800  0.56844500  0.61238400  1
  O  O43  1  0.69764700  0.93010700  0.59896600  1
  O  O44  1  0.68702200  0.56333900  0.10540100  1
  O  O45  1  0.69220000  0.92609400  0.09612600  1
  O  O46  1  0.84980300  0.24839800  0.72583000  1
  O  O47  1  0.84397600  0.24381200  0.24264700  1
  O  O48  1  0.90712400  0.24995500  0.50953000  1
  O  O49  1  0.89265700  0.25450400  0.02756700  1
  O  O50  1  0.90747400  0.77723700  0.82481900  1
  O  O51  1  0.91139200  0.74800400  0.32104000  1
