# generated using pymatgen
data_Na2LiFePCO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.80647500
_cell_length_b   8.82365304
_cell_length_c   10.22272546
_cell_angle_alpha   91.86498358
_cell_angle_beta   90.06068260
_cell_angle_gamma   90.39250498
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na2LiFePCO7
_chemical_formula_sum   'Na8 Li4 Fe4 P4 C4 O28'
_cell_volume   613.61605773
_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  0.24499200  0.91552500  0.88023600  1
  Na  Na1  1  0.00140100  0.73738600  0.62643300  1
  Na  Na2  1  0.49713500  0.73746700  0.62465400  1
  Na  Na3  1  0.00271600  0.73823600  0.12686400  1
  Na  Na4  1  0.49964700  0.73850300  0.12686500  1
  Na  Na5  1  0.50065100  0.25716700  0.87094700  1
  Na  Na6  1  0.50247500  0.26196500  0.37798400  1
  Na  Na7  1  0.99858500  0.26240600  0.37494700  1
  Li  Li8  1  0.24891200  0.91081400  0.37638100  1
  Li  Li9  1  0.96939000  0.28131800  0.88395600  1
  Li  Li10  1  0.76251600  0.09860300  0.62325900  1
  Li  Li11  1  0.75508800  0.09987000  0.12479800  1
  Fe  Fe12  1  0.74735900  0.64100000  0.88388700  1
  Fe  Fe13  1  0.75183700  0.64983000  0.39131100  1
  Fe  Fe14  1  0.24671800  0.34928800  0.61521800  1
  Fe  Fe15  1  0.24743700  0.34749400  0.10778600  1
  P  P16  1  0.24184000  0.58374900  0.85287700  1
  P  P17  1  0.25147500  0.59198100  0.35667000  1
  P  P18  1  0.75365400  0.40035300  0.64636100  1
  P  P19  1  0.74925100  0.40937200  0.14148500  1
  C  C20  1  0.75887500  0.95624400  0.86635000  1
  C  C21  1  0.75087100  0.95116400  0.35957200  1
  C  C22  1  0.25002600  0.04818600  0.62952600  1
  C  C23  1  0.25056800  0.05700300  0.14590100  1
  O  O24  1  0.25112800  0.90685300  0.65509700  1
  O  O25  1  0.25246500  0.91388900  0.16871400  1
  O  O26  1  0.75225700  0.92822600  0.99015400  1
  O  O27  1  0.75251600  0.91907900  0.48312100  1
  O  O28  1  0.74583800  0.84274600  0.77996900  1
  O  O29  1  0.75239400  0.83975800  0.27160300  1
  O  O30  1  0.06349200  0.68449900  0.89282400  1
  O  O31  1  0.42953800  0.67244100  0.89848900  1
  O  O32  1  0.06997100  0.69092300  0.39478600  1
  O  O33  1  0.43415300  0.69198600  0.39396700  1
  O  O34  1  0.24683100  0.56325500  0.70031400  1
  O  O35  1  0.74894800  0.55853200  0.58412500  1
  O  O36  1  0.25095300  0.55928200  0.20495900  1
  O  O37  1  0.75140000  0.56422500  0.07473900  1
  O  O38  1  0.22701800  0.42334400  0.91066300  1
  O  O39  1  0.76840800  0.42472000  0.79903800  1
  O  O40  1  0.25233200  0.43868200  0.42607200  1
  O  O41  1  0.75704800  0.43914100  0.29278700  1
  O  O42  1  0.56844500  0.30279200  0.61238400  1
  O  O43  1  0.93010700  0.30235300  0.59896600  1
  O  O44  1  0.56333900  0.31297800  0.10540100  1
  O  O45  1  0.92609400  0.30780000  0.09612500  1
  O  O46  1  0.24839800  0.15019700  0.72583000  1
  O  O47  1  0.24381200  0.15602400  0.24264700  1
  O  O48  1  0.24995500  0.09287600  0.50953000  1
  O  O49  1  0.25450400  0.10734300  0.02756700  1
  O  O50  1  0.77723700  0.09252600  0.82481900  1
  O  O51  1  0.74800400  0.08860800  0.32104000  1
