# generated using pymatgen
data_Li3Mn2(P2O7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.84090500
_cell_length_b   9.87131930
_cell_length_c   11.37008600
_cell_angle_alpha   89.88473707
_cell_angle_beta   76.49288380
_cell_angle_gamma   89.93528821
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Mn2(P2O7)2
_chemical_formula_sum   'Li12 Mn8 P16 O56'
_cell_volume   1073.96857101
_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  0.17329700  0.57679700  0.45484000  1
  Li  Li1  1  0.08621300  0.89422700  0.97315400  1
  Li  Li2  1  0.15086800  0.59417300  0.95708800  1
  Li  Li3  1  0.41293500  0.39024200  0.02796000  1
  Li  Li4  1  0.32969600  0.07668300  0.54386400  1
  Li  Li5  1  0.61506000  0.22086500  0.54935400  1
  Li  Li6  1  0.66308700  0.92110400  0.45907800  1
  Li  Li7  1  0.58822600  0.60375600  0.97097800  1
  Li  Li8  1  0.64987100  0.90810700  0.96124700  1
  Li  Li9  1  0.91105300  0.10893000  0.02936300  1
  Li  Li10  1  0.84042500  0.42120900  0.53966200  1
  Li  Li11  1  0.88752200  0.72148800  0.44819000  1
  Mn  Mn12  1  0.20324700  0.07627100  0.32664400  1
  Mn  Mn13  1  0.25720700  0.78687600  0.17708100  1
  Mn  Mn14  1  0.23667000  0.28241500  0.82891500  1
  Mn  Mn15  1  0.29967600  0.57458500  0.66804400  1
  Mn  Mn16  1  0.70462100  0.42181300  0.31930800  1
  Mn  Mn17  1  0.75053800  0.71557400  0.17700300  1
  Mn  Mn18  1  0.74475300  0.21811700  0.82834800  1
  Mn  Mn19  1  0.79827700  0.92392600  0.67479400  1
  P  P20  1  0.02382600  0.54860800  0.24278400  1
  P  P21  1  0.11988400  0.28910400  0.11478600  1
  P  P22  1  0.06134600  0.06865700  0.75656600  1
  P  P23  1  0.12339900  0.85098900  0.57178500  1
  P  P24  1  0.37974600  0.35005900  0.42402400  1
  P  P25  1  0.43695500  0.56818600  0.24220300  1
  P  P26  1  0.51934300  0.95418100  0.24797600  1
  P  P27  1  0.38040300  0.79201000  0.88980200  1
  P  P28  1  0.61823400  0.20857100  0.11172300  1
  P  P29  1  0.47389800  0.04984700  0.75791700  1
  P  P30  1  0.56044900  0.43023200  0.75612100  1
  P  P31  1  0.62223500  0.64624300  0.57658700  1
  P  P32  1  0.88058200  0.14694500  0.42000000  1
  P  P33  1  0.93705400  0.93020000  0.24254900  1
  P  P34  1  0.88082800  0.70854000  0.89186000  1
  P  P35  1  0.97834100  0.45444800  0.75249500  1
  O  O36  1  0.02401200  0.58677100  0.37160600  1
  O  O37  1  0.03321000  0.15146900  0.42927500  1
  O  O38  1  0.08310500  0.91408200  0.26872900  1
  O  O39  1  0.10825700  0.64433400  0.14536000  1
  O  O40  1  0.09638300  0.40375400  0.22177300  1
  O  O41  1  0.18691300  0.17407300  0.17191400  1
  O  O42  1  0.22435500  0.35755500  0.00313900  1
  O  O43  1  0.02052500  0.72704700  0.92264200  1
  O  O44  1  0.11746200  0.92226600  0.70133400  1
  O  O45  1  0.05842400  0.06079100  0.88982200  1
  O  O46  1  0.13140800  0.46802200  0.77904000  1
  O  O47  1  0.18315700  0.70986700  0.58437700  1
  O  O48  1  0.17329400  0.17402000  0.69633400  1
  O  O49  1  0.21451400  0.94428700  0.47760900  1
  O  O50  1  0.28857000  0.44103800  0.51919700  1
  O  O51  1  0.32626200  0.67125200  0.30543600  1
  O  O52  1  0.32266800  0.20789800  0.41518000  1
  O  O53  1  0.36456200  0.96598200  0.22924600  1
  O  O54  1  0.38282500  0.42008100  0.29521700  1
  O  O55  1  0.43974400  0.56169700  0.10871600  1
  O  O56  1  0.48313200  0.23418500  0.07745700  1
  O  O57  1  0.27071300  0.84773500  0.99962800  1
  O  O58  1  0.31995800  0.66888300  0.83686300  1
  O  O59  1  0.39843100  0.90509900  0.78256000  1
  O  O60  1  0.41367700  0.41530900  0.72983700  1
  O  O61  1  0.38889900  0.15267100  0.84673200  1
  O  O62  1  0.52440300  0.92071300  0.37474500  1
  O  O63  1  0.47054900  0.65253700  0.56570700  1
  O  O64  1  0.53380100  0.34166600  0.43626000  1
  O  O65  1  0.48220600  0.07957900  0.62559300  1
  O  O66  1  0.59935300  0.85963200  0.14732300  1
  O  O67  1  0.58141100  0.58780400  0.27176700  1
  O  O68  1  0.59111700  0.10000400  0.22231200  1
  O  O69  1  0.68461200  0.32668400  0.16460900  1
  O  O70  1  0.72357400  0.13749500  0.00407400  1
  O  O71  1  0.52113700  0.77279200  0.91839700  1
  O  O72  1  0.56382900  0.43228000  0.88783900  1
  O  O73  1  0.62164300  0.57673800  0.70530000  1
  O  O74  1  0.62263200  0.03667100  0.78577400  1
  O  O75  1  0.68545300  0.78759900  0.58220900  1
  O  O76  1  0.66417700  0.32320000  0.68683900  1
  O  O77  1  0.72237100  0.56160300  0.48005600  1
  O  O78  1  0.78116700  0.06331900  0.51780600  1
  O  O79  1  0.83328500  0.82449300  0.31363300  1
  O  O80  1  0.81782400  0.28911900  0.41644400  1
  O  O81  1  0.87127300  0.53774400  0.22342300  1
  O  O82  1  0.93265900  0.93151900  0.11088200  1
  O  O83  1  0.87765400  0.07751400  0.29268800  1
  O  O84  1  0.98420400  0.26251800  0.08300700  1
  O  O85  1  0.76981200  0.65073300  0.99931800  1
  O  O86  1  0.82064600  0.83369700  0.84118500  1
  O  O87  1  0.90317400  0.59982000  0.78261900  1
  O  O88  1  0.89969800  0.35194000  0.84404200  1
  O  O89  1  0.91734200  0.08967600  0.72687800  1
  O  O90  1  0.97214900  0.83853600  0.55734500  1
  O  O91  1  0.98247200  0.43168600  0.62197300  1
