# generated using pymatgen
data_Li6Fe3P8O29
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.98682007
_cell_length_b   9.98682007
_cell_length_c   13.92947433
_cell_angle_alpha   89.74053816
_cell_angle_beta   89.74053816
_cell_angle_gamma   59.94753903
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6Fe3P8O29
_chemical_formula_sum   'Li12 Fe6 P16 O58'
_cell_volume   1202.49713653
_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  0.31143300  0.91025600  0.06225300  1
  Li  Li1  1  0.66380300  0.66473700  0.37945600  1
  Li  Li2  1  0.66473700  0.66380300  0.87945600  1
  Li  Li3  1  0.91025600  0.31143300  0.56225300  1
  Li  Li4  1  0.77734900  0.91390900  0.56349000  1
  Li  Li5  1  0.08912700  0.21964600  0.93659500  1
  Li  Li6  1  0.91390900  0.77734900  0.06349000  1
  Li  Li7  1  0.21964600  0.08912700  0.43659500  1
  Li  Li8  1  0.08929100  0.68820200  0.44037500  1
  Li  Li9  1  0.22110500  0.68894900  0.93750100  1
  Li  Li10  1  0.68820200  0.08929100  0.94037500  1
  Li  Li11  1  0.68894900  0.22110500  0.43750100  1
  Fe  Fe12  1  0.43006100  0.57164100  0.74524500  1
  Fe  Fe13  1  0.57164100  0.43006100  0.24524500  1
  Fe  Fe14  1  0.43288000  0.99785400  0.25086300  1
  Fe  Fe15  1  0.57323200  0.99648300  0.74860100  1
  Fe  Fe16  1  0.99785400  0.43288000  0.75086300  1
  Fe  Fe17  1  0.99648300  0.57323200  0.24860100  1
  P  P18  1  0.32208900  0.76759200  0.34030000  1
  P  P19  1  0.32593500  0.90641200  0.84203200  1
  P  P20  1  0.76759200  0.32208900  0.84030000  1
  P  P21  1  0.66648300  0.67248800  0.12530900  1
  P  P22  1  0.67248800  0.66648300  0.62530900  1
  P  P23  1  0.90641200  0.32593500  0.34203200  1
  P  P24  1  0.08983500  0.23363700  0.16022500  1
  P  P25  1  0.76677800  0.90660300  0.34307200  1
  P  P26  1  0.23363700  0.08983500  0.66022500  1
  P  P27  1  0.90660300  0.76677800  0.84307200  1
  P  P28  1  0.08793000  0.67670000  0.66008100  1
  P  P29  1  0.33226600  0.33181200  0.86976600  1
  P  P30  1  0.33181200  0.33226600  0.36976600  1
  P  P31  1  0.23610200  0.67669300  0.15687400  1
  P  P32  1  0.67670000  0.08793000  0.16008100  1
  P  P33  1  0.67669300  0.23610200  0.65687400  1
  O  O34  1  0.22250400  0.78901700  0.24462100  1
  O  O35  1  0.24697800  0.75391400  0.06552900  1
  O  O36  1  0.33245400  0.74905600  0.84295300  1
  O  O37  1  0.21831400  0.99750100  0.75087300  1
  O  O38  1  0.23499900  0.01163400  0.56700200  1
  O  O39  1  0.33236400  0.91682100  0.34361500  1
  O  O40  1  0.48673700  0.62637900  0.32827300  1
  O  O41  1  0.52515000  0.67265400  0.66673800  1
  O  O42  1  0.62637900  0.48673700  0.82827300  1
  O  O43  1  0.75391400  0.24697800  0.56553000  1
  O  O44  1  0.78901700  0.22250400  0.74462100  1
  O  O45  1  0.74905600  0.33245400  0.34295300  1
  O  O46  1  0.51213800  0.81802200  0.15680300  1
  O  O47  1  0.49025900  0.88099300  0.82605200  1
  O  O48  1  0.67265400  0.52515000  0.16673800  1
  O  O49  1  0.66161900  0.66787000  0.01565300  1
  O  O50  1  0.66787000  0.66161900  0.51565300  1
  O  O51  1  0.81802200  0.51213800  0.65680300  1
  O  O52  1  0.62855600  0.87963400  0.32697400  1
  O  O53  1  0.68190700  0.80999400  0.65806800  1
  O  O54  1  0.91682100  0.33236400  0.84361500  1
  O  O55  1  0.99750100  0.21831400  0.25087300  1
  O  O56  1  0.01163400  0.23499900  0.06700200  1
  O  O57  1  0.00058200  0.24856100  0.43113100  1
  O  O58  1  0.88099300  0.49025900  0.32605200  1
  O  O59  1  0.80999400  0.68190700  0.15806800  1
  O  O60  1  0.08407100  0.24860500  0.66214600  1
  O  O61  1  0.87963400  0.62855600  0.82697400  1
  O  O62  1  0.74863800  0.91731100  0.84534100  1
  O  O63  1  0.24856100  0.00058200  0.93113100  1
  O  O64  1  0.75621200  0.99827000  0.06987100  1
  O  O65  1  0.78507400  0.99427100  0.25096700  1
  O  O66  1  0.24860500  0.08407100  0.16214600  1
  O  O67  1  0.09689600  0.38154800  0.17279800  1
  O  O68  1  0.91731100  0.74863800  0.34534100  1
  O  O69  1  0.18601900  0.32742900  0.83872900  1
  O  O70  1  0.09988200  0.51921800  0.67582800  1
  O  O71  1  0.99827000  0.75621200  0.56987100  1
  O  O72  1  0.00144100  0.74863800  0.93154800  1
  O  O73  1  0.99427100  0.78507400  0.75096700  1
  O  O74  1  0.08490200  0.67063600  0.15943600  1
  O  O75  1  0.32742900  0.18601900  0.33872900  1
  O  O76  1  0.38154800  0.09689600  0.67279800  1
  O  O77  1  0.18548000  0.48283500  0.33820200  1
  O  O78  1  0.33827200  0.33221600  0.48115800  1
  O  O79  1  0.33221600  0.33827200  0.98115800  1
  O  O80  1  0.32818200  0.48463500  0.84211200  1
  O  O81  1  0.51921800  0.09988200  0.17582800  1
  O  O82  1  0.48283500  0.18548000  0.83820200  1
  O  O83  1  0.24684200  0.66293800  0.66247700  1
  O  O84  1  0.23732700  0.75350500  0.42548900  1
  O  O85  1  0.37778500  0.51882200  0.17600700  1
  O  O86  1  0.48463500  0.32818200  0.34211200  1
  O  O87  1  0.51882200  0.37778500  0.67600700  1
  O  O88  1  0.67063600  0.08490200  0.65943600  1
  O  O89  1  0.74863800  0.00144100  0.43154800  1
  O  O90  1  0.66293800  0.24684200  0.16247700  1
  O  O91  1  0.75350500  0.23732700  0.92548900  1
