# generated using pymatgen
data_Li3Mn4(P2O7)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.68885611
_cell_length_b   9.67176831
_cell_length_c   11.05202789
_cell_angle_alpha   90.07886935
_cell_angle_beta   100.25943736
_cell_angle_gamma   89.31616960
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Mn4(P2O7)4
_chemical_formula_sum   'Li6 Mn8 P16 O56'
_cell_volume   1019.03575599
_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  0.09129300  0.10314900  0.02204400  1
  Li  Li1  1  0.41712700  0.59593700  0.97673200  1
  Li  Li2  1  0.39122100  0.20654600  0.54533000  1
  Li  Li3  1  0.90654400  0.89475400  0.97868000  1
  Li  Li4  1  0.83582600  0.58119200  0.46132400  1
  Li  Li5  1  0.88998200  0.28345100  0.55125000  1
  Mn  Mn6  1  0.19506400  0.92094100  0.66297200  1
  Mn  Mn7  1  0.27468800  0.22013100  0.83638500  1
  Mn  Mn8  1  0.22750400  0.71426200  0.16746600  1
  Mn  Mn9  1  0.30417500  0.42960900  0.33303400  1
  Mn  Mn10  1  0.69567800  0.58039400  0.67365700  1
  Mn  Mn11  1  0.75636600  0.29343100  0.83086900  1
  Mn  Mn12  1  0.71958000  0.77429300  0.16741600  1
  Mn  Mn13  1  0.80687000  0.07277700  0.33327800  1
  P  P14  1  0.02351800  0.44116700  0.75276100  1
  P  P15  1  0.11843800  0.70926000  0.88322600  1
  P  P16  1  0.06198500  0.93038000  0.24278100  1
  P  P17  1  0.13151000  0.15298500  0.42760400  1
  P  P18  1  0.37363700  0.64896300  0.57468200  1
  P  P19  1  0.43046000  0.42487800  0.75833700  1
  P  P20  1  0.53240700  0.06250400  0.75718700  1
  P  P21  1  0.38670300  0.21373900  0.11693900  1
  P  P22  1  0.61264200  0.79102300  0.88519400  1
  P  P23  1  0.46571500  0.93724100  0.24769000  1
  P  P24  1  0.56415600  0.56941100  0.24262800  1
  P  P25  1  0.62905900  0.34654500  0.42344800  1
  P  P26  1  0.87298200  0.85739900  0.56752600  1
  P  P27  1  0.93848700  0.06786800  0.75773800  1
  P  P28  1  0.88093000  0.28830200  0.11692600  1
  P  P29  1  0.97003900  0.56144100  0.24202900  1
  O  O30  1  0.01900400  0.41798900  0.61917800  1
  O  O31  1  0.03173000  0.85282000  0.55866800  1
  O  O32  1  0.08894400  0.07153300  0.72298500  1
  O  O33  1  0.10833200  0.33488000  0.84146300  1
  O  O34  1  0.09861600  0.58606600  0.78436600  1
  O  O35  1  0.18623100  0.82415700  0.81297000  1
  O  O36  1  0.22754800  0.65659300  0.99613800  1
  O  O37  1  0.02219900  0.25345600  0.09103900  1
  O  O38  1  0.12997400  0.06959500  0.30231300  1
  O  O39  1  0.06115500  0.93827900  0.10725200  1
  O  O40  1  0.12075000  0.55344800  0.20529500  1
  O  O41  1  0.19953100  0.29132200  0.40764800  1
  O  O42  1  0.15753200  0.80908100  0.29791100  1
  O  O43  1  0.22382800  0.07317700  0.53323100  1
  O  O44  1  0.29114400  0.57012400  0.46660400  1
  O  O45  1  0.33734300  0.30596600  0.69417900  1
  O  O46  1  0.31904200  0.79420000  0.59932600  1
  O  O47  1  0.38062700  0.05580000  0.79321000  1
  O  O48  1  0.36406000  0.56612700  0.69920600  1
  O  O49  1  0.41506600  0.42378800  0.89058000  1
  O  O50  1  0.47336300  0.75986800  0.91389400  1
  O  O51  1  0.27439400  0.16357500  0.00302700  1
  O  O52  1  0.31820600  0.33045800  0.18675800  1
  O  O53  1  0.39863900  0.08854100  0.21465000  1
  O  O54  1  0.41308400  0.57891500  0.27290300  1
  O  O55  1  0.37285500  0.83867500  0.15564600  1
  O  O56  1  0.53394200  0.09281900  0.62648600  1
  O  O57  1  0.47846200  0.33720000  0.44420100  1
  O  O58  1  0.53365300  0.65056300  0.57100600  1
  O  O59  1  0.46907100  0.91294000  0.37971100  1
  O  O60  1  0.62365000  0.15952600  0.85135800  1
  O  O61  1  0.58268600  0.41551100  0.73016800  1
  O  O62  1  0.60148400  0.91231800  0.78569500  1
  O  O63  1  0.68516400  0.67343700  0.81982300  1
  O  O64  1  0.72025100  0.83991600  0.99974300  1
  O  O65  1  0.52332400  0.24310100  0.08267900  1
  O  O66  1  0.57050400  0.58489300  0.10887800  1
  O  O67  1  0.62453500  0.42197700  0.29327800  1
  O  O68  1  0.61641900  0.93745700  0.20786100  1
  O  O69  1  0.69806500  0.20622600  0.40863900  1
  O  O70  1  0.66973500  0.67728400  0.31022400  1
  O  O71  1  0.72454800  0.43429700  0.52171600  1
  O  O72  1  0.78522400  0.94055400  0.46375300  1
  O  O73  1  0.84771000  0.19277000  0.70190700  1
  O  O74  1  0.81805900  0.71212700  0.58590100  1
  O  O75  1  0.86717100  0.45498100  0.78408700  1
  O  O76  1  0.93888300  0.05831800  0.89226600  1
  O  O77  1  0.86476300  0.93218000  0.69564300  1
  O  O78  1  0.98101900  0.74256200  0.91681100  1
  O  O79  1  0.77922900  0.34001200  0.00074900  1
  O  O80  1  0.81294200  0.17425400  0.18697300  1
  O  O81  1  0.89751000  0.41380100  0.21436500  1
  O  O82  1  0.88006900  0.66428600  0.15190400  1
  O  O83  1  0.91158600  0.92293000  0.27522900  1
  O  O84  1  0.97649900  0.16705300  0.44065000  1
  O  O85  1  0.97477600  0.58713600  0.37458100  1
