# generated using pymatgen
data_Li2FePCO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.48879700
_cell_length_b   8.32042100
_cell_length_c   10.16795008
_cell_angle_alpha   85.26873105
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2FePCO7
_chemical_formula_sum   'Li8 Fe4 P4 C4 O28'
_cell_volume   547.09219360
_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  0.75375300  0.90346600  0.61849500  1
  Li  Li1  1  0.74624700  0.90346600  0.11849500  1
  Li  Li2  1  0.96567500  0.72531700  0.87439000  1
  Li  Li3  1  0.53432500  0.72531700  0.37439000  1
  Li  Li4  1  0.46567500  0.27468300  0.62561000  1
  Li  Li5  1  0.03432500  0.27468300  0.12561000  1
  Li  Li6  1  0.25375300  0.09653400  0.88150500  1
  Li  Li7  1  0.24624700  0.09653400  0.38150500  1
  Fe  Fe8  1  0.24218200  0.67013500  0.60012700  1
  Fe  Fe9  1  0.25781800  0.67013500  0.10012700  1
  Fe  Fe10  1  0.74218200  0.32986500  0.89987300  1
  Fe  Fe11  1  0.75781800  0.32986500  0.39987300  1
  P  P12  1  0.74511800  0.57964400  0.63927500  1
  P  P13  1  0.75488200  0.57964400  0.13927500  1
  P  P14  1  0.24511800  0.42035600  0.86072500  1
  P  P15  1  0.25488200  0.42035600  0.36072500  1
  C  C16  1  0.25544700  0.96009200  0.64899300  1
  C  C17  1  0.24455300  0.96009200  0.14899300  1
  C  C18  1  0.75544700  0.03990800  0.85100700  1
  C  C19  1  0.74455300  0.03990800  0.35100700  1
  O  O20  1  0.25978800  0.92308700  0.52584800  1
  O  O21  1  0.78000300  0.89781300  0.81624100  1
  O  O22  1  0.24021200  0.92308700  0.02584800  1
  O  O23  1  0.22624800  0.83770000  0.73673800  1
  O  O24  1  0.71999700  0.89781300  0.31624100  1
  O  O25  1  0.27375200  0.83770000  0.23673800  1
  O  O26  1  0.93650900  0.68188400  0.59643900  1
  O  O27  1  0.56295900  0.69562900  0.59823000  1
  O  O28  1  0.93704100  0.69562900  0.09823000  1
  O  O29  1  0.56349100  0.68188400  0.09643900  1
  O  O30  1  0.22250700  0.57991800  0.92708300  1
  O  O31  1  0.75763200  0.53883300  0.79146100  1
  O  O32  1  0.27749300  0.57991800  0.42708300  1
  O  O33  1  0.74236800  0.53883300  0.29146100  1
  O  O34  1  0.25763200  0.46116700  0.70853900  1
  O  O35  1  0.72250700  0.42008200  0.57291700  1
  O  O36  1  0.24236800  0.46116700  0.20853900  1
  O  O37  1  0.77749300  0.42008200  0.07291700  1
  O  O38  1  0.43650900  0.31811600  0.90356100  1
  O  O39  1  0.06295900  0.30437100  0.90177000  1
  O  O40  1  0.43704100  0.30437100  0.40177000  1
  O  O41  1  0.06349100  0.31811600  0.40356100  1
  O  O42  1  0.72624800  0.16230000  0.76326200  1
  O  O43  1  0.28000300  0.10218700  0.68375900  1
  O  O44  1  0.77375200  0.16230000  0.26326200  1
  O  O45  1  0.75978800  0.07691300  0.97415200  1
  O  O46  1  0.21999700  0.10218700  0.18375900  1
  O  O47  1  0.74021200  0.07691300  0.47415200  1
