# generated using pymatgen
data_Li5Fe2P2(CO7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.46824400
_cell_length_b   9.38372100
_cell_length_c   10.16137940
_cell_angle_alpha   63.43990387
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Fe2P2(CO7)2
_chemical_formula_sum   'Li10 Fe4 P4 C4 O28'
_cell_volume   551.66815991
_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  0.49429200  0.10379900  0.55639000  1
  Li  Li1  1  0.50570800  0.10379900  0.05639000  1
  Li  Li2  1  0.31729700  0.28995500  0.73880100  1
  Li  Li3  1  0.68270300  0.28995500  0.23880100  1
  Li  Li4  1  0.74308700  0.73927800  0.76221400  1
  Li  Li5  1  0.25788800  0.73936700  0.76008100  1
  Li  Li6  1  0.74211200  0.73936700  0.26008100  1
  Li  Li7  1  0.25691300  0.73927800  0.26221400  1
  Li  Li8  1  0.99104300  0.89994500  0.93190800  1
  Li  Li9  1  0.00895700  0.89994500  0.43190800  1
  Fe  Fe10  1  0.00031100  0.32643600  0.93855500  1
  Fe  Fe11  1  0.99968900  0.32643600  0.43855500  1
  Fe  Fe12  1  0.49861600  0.66752400  0.56015000  1
  Fe  Fe13  1  0.50138400  0.66752400  0.06015000  1
  P  P14  1  0.50603100  0.41315600  0.93436900  1
  P  P15  1  0.49396900  0.41315600  0.43436900  1
  P  P16  1  0.00514800  0.58047000  0.57957100  1
  P  P17  1  0.99485200  0.58047000  0.07957100  1
  C  C18  1  0.00141300  0.03690200  0.63007800  1
  C  C19  1  0.99858700  0.03690200  0.13007800  1
  C  C20  1  0.48349900  0.96325100  0.85814100  1
  C  C21  1  0.51650100  0.96325100  0.35814100  1
  O  O22  1  0.00699700  0.06916400  0.99123900  1
  O  O23  1  0.99300300  0.06916400  0.49123900  1
  O  O24  1  0.45551500  0.10078200  0.75304200  1
  O  O25  1  0.00611300  0.15928100  0.65760400  1
  O  O26  1  0.54448500  0.10078200  0.25304200  1
  O  O27  1  0.99388700  0.15928100  0.15760400  1
  O  O28  1  0.31871100  0.30388400  0.93991300  1
  O  O29  1  0.69449200  0.31067100  0.93213800  1
  O  O30  1  0.30550800  0.31067100  0.43213800  1
  O  O31  1  0.68128900  0.30388400  0.43991300  1
  O  O32  1  0.03587500  0.42343000  0.72060700  1
  O  O33  1  0.48268800  0.44019800  0.57298700  1
  O  O34  1  0.96412500  0.42343000  0.22060700  1
  O  O35  1  0.51731200  0.44019800  0.07298700  1
  O  O36  1  0.00097700  0.54063600  0.94498300  1
  O  O37  1  0.49320600  0.57569100  0.79655700  1
  O  O38  1  0.99902300  0.54063600  0.44498300  1
  O  O39  1  0.50679400  0.57569100  0.29655700  1
  O  O40  1  0.81248800  0.67874200  0.57891200  1
  O  O41  1  0.18314700  0.70066700  0.55912800  1
  O  O42  1  0.18751200  0.67874200  0.07891200  1
  O  O43  1  0.81685300  0.70066700  0.05912800  1
  O  O44  1  0.50155000  0.83894700  0.82955100  1
  O  O45  1  0.00394600  0.89262100  0.73496300  1
  O  O46  1  0.49845000  0.83894700  0.32955100  1
  O  O47  1  0.99605400  0.89262100  0.23496300  1
  O  O48  1  0.50695300  0.93409200  0.49628600  1
  O  O49  1  0.49304700  0.93409200  0.99628600  1
