# generated using pymatgen
data_Li3Mn4(P2O7)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.70901700
_cell_length_b   9.76053904
_cell_length_c   11.28210370
_cell_angle_alpha   91.30762926
_cell_angle_beta   100.74232635
_cell_angle_gamma   90.60494729
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Mn4(P2O7)4
_chemical_formula_sum   'Li6 Mn8 P16 O56'
_cell_volume   1050.02182128
_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  0.91240200  0.10421900  0.98185100  1
  Li  Li1  1  0.58330000  0.58926100  0.02411500  1
  Li  Li2  1  0.40818900  0.03358300  0.50409300  1
  Li  Li3  1  0.09229900  0.89421400  0.01771100  1
  Li  Li4  1  0.15544900  0.57952600  0.53117000  1
  Li  Li5  1  0.10090900  0.28802100  0.45019400  1
  Mn  Mn6  1  0.80039300  0.92701900  0.33992200  1
  Mn  Mn7  1  0.72588200  0.22386300  0.16963600  1
  Mn  Mn8  1  0.77109000  0.71096100  0.82857500  1
  Mn  Mn9  1  0.69460800  0.42587500  0.65741200  1
  Mn  Mn10  1  0.30254700  0.58248900  0.32427200  1
  Mn  Mn11  1  0.24171800  0.29319800  0.17212900  1
  Mn  Mn12  1  0.28157400  0.77130900  0.83250300  1
  Mn  Mn13  1  0.19147300  0.07206800  0.66625600  1
  P  P14  1  0.97829800  0.44602500  0.24681100  1
  P  P15  1  0.87763800  0.71199500  0.11981700  1
  P  P16  1  0.93499900  0.93137700  0.75330300  1
  P  P17  1  0.86332400  0.15001000  0.56885100  1
  P  P18  1  0.62533600  0.65627300  0.42238000  1
  P  P19  1  0.57160900  0.42726500  0.24415300  1
  P  P20  1  0.46611300  0.06652700  0.23726000  1
  P  P21  1  0.61950300  0.20697500  0.88725800  1
  P  P22  1  0.38543500  0.79067700  0.11295300  1
  P  P23  1  0.52909800  0.93554300  0.75186400  1
  P  P24  1  0.43499400  0.56586900  0.75618300  1
  P  P25  1  0.37114600  0.34458200  0.58021800  1
  P  P26  1  0.12650800  0.85714300  0.43000500  1
  P  P27  1  0.06190200  0.06804300  0.24431300  1
  P  P28  1  0.11740200  0.28769400  0.88066400  1
  P  P29  1  0.02808300  0.55717300  0.75812500  1
  O  O30  1  0.98457900  0.43003000  0.37887800  1
  O  O31  1  0.97511600  0.84930400  0.44516700  1
  O  O32  1  0.91227200  0.07490900  0.27529600  1
  O  O33  1  0.89804500  0.33469900  0.16126000  1
  O  O34  1  0.90195800  0.58671300  0.21125000  1
  O  O35  1  0.80839000  0.82029700  0.19051900  1
  O  O36  1  0.77389000  0.66058900  0.00428900  1
  O  O37  1  0.97342400  0.24861200  0.89968100  1
  O  O38  1  0.86259900  0.06394100  0.69039900  1
  O  O39  1  0.93750800  0.94354500  0.88757200  1
  O  O40  1  0.87567300  0.54627500  0.78915700  1
  O  O41  1  0.80888800  0.29156300  0.59802900  1
  O  O42  1  0.84320800  0.80520100  0.70259900  1
  O  O43  1  0.77347700  0.07016700  0.46389700  1
  O  O44  1  0.70715500  0.58486900  0.52969200  1
  O  O45  1  0.66499700  0.31113600  0.30652000  1
  O  O46  1  0.67031600  0.80124500  0.39680100  1
  O  O47  1  0.61540000  0.06027700  0.20340800  1
  O  O48  1  0.63650200  0.56973500  0.30039400  1
  O  O49  1  0.58775100  0.42078400  0.11339900  1
  O  O50  1  0.52787900  0.75563300  0.08988200  1
  O  O51  1  0.72115500  0.15653500  0.00077400  1
  O  O52  1  0.68003100  0.32539500  0.82562400  1
  O  O53  1  0.60204500  0.08305400  0.79187900  1
  O  O54  1  0.58702600  0.56926100  0.72818900  1
  O  O55  1  0.61910200  0.83239100  0.83383900  1
  O  O56  1  0.46001900  0.09800000  0.36552300  1
  O  O57  1  0.52215200  0.34060000  0.56156800  1
  O  O58  1  0.46546400  0.65346800  0.42788100  1
  O  O59  1  0.52130900  0.92435200  0.61934600  1
  O  O60  1  0.37756200  0.16280100  0.14503700  1
  O  O61  1  0.41781900  0.42071800  0.26687900  1
  O  O62  1  0.39697800  0.91748300  0.20738000  1
  O  O63  1  0.31039200  0.68051500  0.17266900  1
  O  O64  1  0.28356500  0.84045900  0.99752000  1
  O  O65  1  0.47842700  0.24973400  0.91361700  1
  O  O66  1  0.43126200  0.58882100  0.88805200  1
  O  O67  1  0.37138200  0.41832500  0.71061200  1
  O  O68  1  0.38251900  0.93697300  0.79232500  1
  O  O69  1  0.31353500  0.19858200  0.59228400  1
  O  O70  1  0.33287000  0.67322900  0.68875900  1
  O  O71  1  0.27220300  0.42572300  0.48652500  1
  O  O72  1  0.22060900  0.94567300  0.52957000  1
  O  O73  1  0.15414100  0.19301200  0.30028300  1
  O  O74  1  0.18608800  0.71433400  0.41302600  1
  O  O75  1  0.13458200  0.45913300  0.21790600  1
  O  O76  1  0.06394500  0.05839600  0.11119700  1
  O  O77  1  0.13446700  0.93339800  0.30508800  1
  O  O78  1  0.01645900  0.75341000  0.09178600  1
  O  O79  1  0.21106300  0.33756000  0.99958000  1
  O  O80  1  0.19010700  0.17728000  0.81451700  1
  O  O81  1  0.10281400  0.41335700  0.79067500  1
  O  O82  1  0.11273800  0.66484400  0.84592800  1
  O  O83  1  0.08455100  0.92313300  0.72218400  1
  O  O84  1  0.01777700  0.16634300  0.55759500  1
  O  O85  1  0.02649800  0.57491100  0.62769200  1
