# generated using pymatgen
data_Li2FeP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.87767100
_cell_length_b   9.94424100
_cell_length_c   11.23003050
_cell_angle_alpha   77.92847203
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2FeP2O7
_chemical_formula_sum   'Li16 Fe8 P16 O56'
_cell_volume   1078.68820855
_cell_formula_units_Z   8
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  0.72070400  0.11106100  0.55353400  1
  Li  Li1  1  0.42389400  0.16802800  0.45612500  1
  Li  Li2  1  0.10693000  0.08598100  0.97195700  1
  Li  Li3  1  0.90977800  0.34419700  0.04267200  1
  Li  Li4  1  0.40977800  0.15580300  0.95732800  1
  Li  Li5  1  0.60693000  0.41401900  0.02804300  1
  Li  Li6  1  0.92389400  0.33197200  0.54387500  1
  Li  Li7  1  0.22070400  0.38893900  0.44646600  1
  Li  Li8  1  0.77929600  0.61106100  0.55353400  1
  Li  Li9  1  0.07610600  0.66802800  0.45612500  1
  Li  Li10  1  0.39307000  0.58598100  0.97195700  1
  Li  Li11  1  0.59022200  0.84419700  0.04267200  1
  Li  Li12  1  0.09022200  0.65580300  0.95732800  1
  Li  Li13  1  0.89307000  0.91401900  0.02804300  1
  Li  Li14  1  0.57610600  0.83197200  0.54387500  1
  Li  Li15  1  0.27929600  0.88893900  0.44646600  1
  Fe  Fe16  1  0.92434000  0.20088200  0.32406100  1
  Fe  Fe17  1  0.21191000  0.25374600  0.17856000  1
  Fe  Fe18  1  0.71191000  0.24625400  0.82144000  1
  Fe  Fe19  1  0.42434000  0.29911800  0.67593900  1
  Fe  Fe20  1  0.57566000  0.70088200  0.32406100  1
  Fe  Fe21  1  0.28809000  0.75374600  0.17856000  1
  Fe  Fe22  1  0.78809000  0.74625400  0.82144000  1
  Fe  Fe23  1  0.07566000  0.79911800  0.67593900  1
  P  P24  1  0.45330100  0.02608700  0.23864900  1
  P  P25  1  0.70426900  0.11926200  0.10804100  1
  P  P26  1  0.93151000  0.05901000  0.75675400  1
  P  P27  1  0.15015800  0.12277200  0.57271800  1
  P  P28  1  0.65015800  0.37722800  0.42728200  1
  P  P29  1  0.43151000  0.44099000  0.24324600  1
  P  P30  1  0.04669900  0.52608700  0.23864900  1
  P  P31  1  0.20426900  0.38073800  0.89195900  1
  P  P32  1  0.79573100  0.61926200  0.10804100  1
  P  P33  1  0.95330100  0.47391300  0.76135100  1
  P  P34  1  0.56849000  0.55901000  0.75675400  1
  P  P35  1  0.34984200  0.62277200  0.57271800  1
  P  P36  1  0.84984200  0.87722800  0.42728200  1
  P  P37  1  0.06849000  0.94099000  0.24324600  1
  P  P38  1  0.29573100  0.88073800  0.89195900  1
  P  P39  1  0.54669900  0.97391300  0.76135100  1
  O  O40  1  0.41496600  0.02301200  0.37027100  1
  O  O41  1  0.83962400  0.02404200  0.44769100  1
  O  O42  1  0.08724900  0.08620800  0.26983800  1
  O  O43  1  0.36347400  0.11874700  0.14395900  1
  O  O44  1  0.60187200  0.09602100  0.22409200  1
  O  O45  1  0.82900800  0.18360400  0.15417000  1
  O  O46  1  0.63429800  0.22275700  0.00146300  1
  O  O47  1  0.27591000  0.01891300  0.92526000  1
  O  O48  1  0.07887000  0.11306000  0.70450900  1
  O  O49  1  0.93505000  0.06328700  0.88988200  1
  O  O50  1  0.53363900  0.12049000  0.78956400  1
  O  O51  1  0.28909300  0.18867800  0.58270500  1
  O  O52  1  0.82584900  0.16384400  0.68870100  1
  O  O53  1  0.06295900  0.22324100  0.48084200  1
  O  O54  1  0.56295900  0.27675900  0.51915800  1
  O  O55  1  0.32584900  0.33615600  0.31129900  1
  O  O56  1  0.78909300  0.31132200  0.41729500  1
  O  O57  1  0.03363900  0.37951000  0.21043600  1
  O  O58  1  0.57887000  0.38694000  0.29549100  1
  O  O59  1  0.43505000  0.43671300  0.11011800  1
  O  O60  1  0.77591000  0.48108700  0.07474000  1
  O  O61  1  0.13429800  0.27724300  0.99853700  1
  O  O62  1  0.32900800  0.31639600  0.84583000  1
  O  O63  1  0.10187200  0.40397900  0.77590800  1
  O  O64  1  0.58724900  0.41379200  0.73016200  1
  O  O65  1  0.86347400  0.38125300  0.85604100  1
  O  O66  1  0.08503400  0.52301200  0.37027100  1
  O  O67  1  0.33962400  0.47595800  0.55230900  1
  O  O68  1  0.66037600  0.52404200  0.44769100  1
  O  O69  1  0.91496600  0.47698800  0.62972900  1
  O  O70  1  0.13652600  0.61874700  0.14395900  1
  O  O71  1  0.41275100  0.58620800  0.26983800  1
  O  O72  1  0.89812800  0.59602100  0.22409200  1
  O  O73  1  0.67099200  0.68360400  0.15417000  1
  O  O74  1  0.86570200  0.72275700  0.00146300  1
  O  O75  1  0.22409000  0.51891300  0.92526000  1
  O  O76  1  0.56495000  0.56328700  0.88988200  1
  O  O77  1  0.42113000  0.61306000  0.70450900  1
  O  O78  1  0.96636100  0.62049000  0.78956400  1
  O  O79  1  0.21090700  0.68867800  0.58270500  1
  O  O80  1  0.67415100  0.66384400  0.68870100  1
  O  O81  1  0.43704100  0.72324100  0.48084200  1
  O  O82  1  0.93704100  0.77675900  0.51915800  1
  O  O83  1  0.17415100  0.83615600  0.31129900  1
  O  O84  1  0.71090700  0.81132200  0.41729500  1
  O  O85  1  0.46636100  0.87951000  0.21043600  1
  O  O86  1  0.06495000  0.93671300  0.11011800  1
  O  O87  1  0.92113000  0.88694000  0.29549100  1
  O  O88  1  0.72409000  0.98108700  0.07474000  1
  O  O89  1  0.36570200  0.77724300  0.99853700  1
  O  O90  1  0.17099200  0.81639600  0.84583000  1
  O  O91  1  0.39812800  0.90397900  0.77590800  1
  O  O92  1  0.63652600  0.88125300  0.85604100  1
  O  O93  1  0.91275100  0.91379200  0.73016200  1
  O  O94  1  0.16037600  0.97595800  0.55230900  1
  O  O95  1  0.58503400  0.97698800  0.62972900  1
