# generated using pymatgen
data_Li2MnP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.32651360
_cell_length_b   10.32651360
_cell_length_c   13.64726400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999747
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2MnP2O7
_chemical_formula_sum   'Li16 Mn8 P16 O56'
_cell_volume   1260.32827240
_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  0.16411700  0.83178300  0.17131200  1
  Li  Li1  1  0.16742600  0.83427500  0.67395900  1
  Li  Li2  1  0.00133600  0.49909200  0.37837900  1
  Li  Li3  1  0.66666700  0.33333300  0.67806000  1
  Li  Li4  1  0.66666700  0.33333300  0.25543300  1
  Li  Li5  1  0.83205700  0.16784400  0.88049400  1
  Li  Li6  1  0.49775600  0.99866400  0.37837900  1
  Li  Li7  1  0.16821700  0.33233400  0.17131200  1
  Li  Li8  1  0.16572500  0.33315000  0.67395900  1
  Li  Li9  1  0.33333300  0.66666700  0.87876300  1
  Li  Li10  1  0.66766600  0.83588300  0.17131200  1
  Li  Li11  1  0.00000000  0.00000000  0.37943900  1
  Li  Li12  1  0.66685000  0.83257400  0.67395900  1
  Li  Li13  1  0.83215600  0.66421300  0.88049400  1
  Li  Li14  1  0.50090800  0.50224400  0.37837900  1
  Li  Li15  1  0.33578700  0.16794300  0.88049400  1
  Mn  Mn16  1  0.16607300  0.83333700  0.98140500  1
  Mn  Mn17  1  0.16618700  0.83211200  0.48285300  1
  Mn  Mn18  1  0.66666700  0.33333300  0.99548900  1
  Mn  Mn19  1  0.66666700  0.33333300  0.48726500  1
  Mn  Mn20  1  0.16666300  0.33273600  0.98140500  1
  Mn  Mn21  1  0.16788800  0.33407500  0.48285300  1
  Mn  Mn22  1  0.66726400  0.83392700  0.98140500  1
  Mn  Mn23  1  0.66592500  0.83381300  0.48285300  1
  P  P24  1  0.99954700  0.49941200  0.85782000  1
  P  P25  1  0.00026800  0.50024200  0.62258400  1
  P  P26  1  0.83546200  0.16660400  0.11883800  1
  P  P27  1  0.49986400  0.00045300  0.85782000  1
  P  P28  1  0.49997400  0.99973200  0.62258400  1
  P  P29  1  0.83093100  0.16636600  0.35404000  1
  P  P30  1  0.33333300  0.66666700  0.12177900  1
  P  P31  1  0.33333300  0.66666700  0.35713100  1
  P  P32  1  0.00000000  0.00000000  0.85692500  1
  P  P33  1  0.00000000  0.00000000  0.62183600  1
  P  P34  1  0.83339600  0.66885800  0.11883800  1
  P  P35  1  0.50058800  0.50013600  0.85782000  1
  P  P36  1  0.49975800  0.50002600  0.62258400  1
  P  P37  1  0.83363400  0.66456600  0.35404000  1
  P  P38  1  0.33114200  0.16453800  0.11883800  1
  P  P39  1  0.33543400  0.16906900  0.35404000  1
  O  O40  1  0.11907200  0.65867000  0.59390500  1
  O  O41  1  0.13976400  0.64637800  0.88753200  1
  O  O42  1  0.85272700  0.49122400  0.88755000  1
  O  O43  1  0.84112400  0.46087300  0.59461500  1
  O  O44  1  0.00117500  0.49979700  0.74078300  1
  O  O45  1  0.81864000  0.30729900  0.37754800  1
  O  O46  1  0.80311900  0.28981400  0.09244000  1
  O  O47  1  0.03844000  0.38075100  0.59280900  1
  O  O48  1  0.00818700  0.36007500  0.88698600  1
  O  O49  1  0.61974900  0.15887600  0.59461500  1
  O  O50  1  0.63849700  0.14727300  0.88755000  1
  O  O51  1  0.35188900  0.99181300  0.88698600  1
  O  O52  1  0.34231100  0.96156000  0.59280900  1
  O  O53  1  0.83059100  0.15997300  0.23890500  1
  O  O54  1  0.49862200  0.99882500  0.74078300  1
  O  O55  1  0.99387000  0.20085800  0.09411800  1
  O  O56  1  0.97770900  0.17703000  0.38798400  1
  O  O57  1  0.69225300  0.02155900  0.38791600  1
  O  O58  1  0.71382100  0.00912600  0.09043100  1
  O  O59  1  0.32549900  0.80580500  0.38797400  1
  O  O60  1  0.29402400  0.78593800  0.09408600  1
  O  O61  1  0.53959700  0.88092800  0.59390500  1
  O  O62  1  0.50661500  0.86023600  0.88753200  1
  O  O63  1  0.11884600  0.15859500  0.59322900  1
  O  O64  1  0.14057900  0.14601700  0.88682700  1
  O  O65  1  0.85398300  0.99456200  0.88682700  1
  O  O66  1  0.84140500  0.96025200  0.59322900  1
  O  O67  1  0.33333300  0.66666700  0.24127600  1
  O  O68  1  0.00000000  0.00000000  0.74024200  1
  O  O69  1  0.49191400  0.70597600  0.09408600  1
  O  O70  1  0.48030500  0.67450100  0.38797400  1
  O  O71  1  0.19419500  0.51969500  0.38797400  1
  O  O72  1  0.21406200  0.50808600  0.09408600  1
  O  O73  1  0.82297000  0.80067900  0.38798400  1
  O  O74  1  0.79914200  0.79301300  0.09411800  1
  O  O75  1  0.03974800  0.88115400  0.59322900  1
  O  O76  1  0.00543800  0.85942100  0.88682700  1
  O  O77  1  0.61924900  0.65768900  0.59280900  1
  O  O78  1  0.63992500  0.64811100  0.88698600  1
  O  O79  1  0.35362200  0.49338500  0.88753200  1
  O  O80  1  0.34133000  0.46040300  0.59390500  1
  O  O81  1  0.84002700  0.67061900  0.23890500  1
  O  O82  1  0.50020300  0.50137800  0.74078300  1
  O  O83  1  0.99087400  0.70469500  0.09043100  1
  O  O84  1  0.97844100  0.67069400  0.38791600  1
  O  O85  1  0.69270100  0.51134100  0.37754800  1
  O  O86  1  0.71018600  0.51330500  0.09244000  1
  O  O87  1  0.32930600  0.30774700  0.38791600  1
  O  O88  1  0.29530500  0.28617900  0.09043100  1
  O  O89  1  0.53912700  0.38025100  0.59461500  1
  O  O90  1  0.50877600  0.36150300  0.88755000  1
  O  O91  1  0.32938100  0.16940900  0.23890500  1
  O  O92  1  0.48669500  0.19688100  0.09244000  1
  O  O93  1  0.48865900  0.18136000  0.37754800  1
  O  O94  1  0.19932100  0.02229100  0.38798400  1
  O  O95  1  0.20698700  0.00613000  0.09411800  1
