# generated using pymatgen
data_Li3Mn2(P2O7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.82939200
_cell_length_b   9.84099508
_cell_length_c   11.38173070
_cell_angle_alpha   89.72236781
_cell_angle_beta   76.78919888
_cell_angle_gamma   89.56618723
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Mn2(P2O7)2
_chemical_formula_sum   'Li12 Mn8 P16 O56'
_cell_volume   1071.79381541
_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  0.88463800  0.28118400  0.44772500  1
  Li  Li1  1  0.81909400  0.58577700  0.54976300  1
  Li  Li2  1  0.91230100  0.89125300  0.02672400  1
  Li  Li3  1  0.65670400  0.09690200  0.95811700  1
  Li  Li4  1  0.58752000  0.39412900  0.97033700  1
  Li  Li5  1  0.65118200  0.06734300  0.46773400  1
  Li  Li6  1  0.34881800  0.93265700  0.53226600  1
  Li  Li7  1  0.41248000  0.60587100  0.02966300  1
  Li  Li8  1  0.34329600  0.90309800  0.04188300  1
  Li  Li9  1  0.08769900  0.10874700  0.97327600  1
  Li  Li10  1  0.18090600  0.41422300  0.45023700  1
  Li  Li11  1  0.11536200  0.71881600  0.55227500  1
  Mn  Mn12  1  0.79773700  0.07479100  0.67166500  1
  Mn  Mn13  1  0.74301100  0.78267700  0.82525100  1
  Mn  Mn14  1  0.75832100  0.28930900  0.17388600  1
  Mn  Mn15  1  0.70466600  0.57955800  0.32283100  1
  Mn  Mn16  1  0.29533400  0.42044200  0.67716900  1
  Mn  Mn17  1  0.24167900  0.71069100  0.82611400  1
  Mn  Mn18  1  0.25698900  0.21732300  0.17474900  1
  Mn  Mn19  1  0.20226300  0.92520900  0.32833500  1
  P  P20  1  0.97586800  0.54791400  0.75367700  1
  P  P21  1  0.88194900  0.29015700  0.88823900  1
  P  P22  1  0.93871700  0.06904600  0.24244400  1
  P  P23  1  0.87803700  0.85033400  0.42435600  1
  P  P24  1  0.61956500  0.35317100  0.57801100  1
  P  P25  1  0.56159600  0.56958400  0.75838100  1
  P  P26  1  0.47668900  0.94982600  0.75613000  1
  P  P27  1  0.61804700  0.79246300  0.10986300  1
  P  P28  1  0.38195300  0.20753700  0.89013700  1
  P  P29  1  0.52331100  0.05017400  0.24387000  1
  P  P30  1  0.43840400  0.43041600  0.24161900  1
  P  P31  1  0.38043500  0.64682900  0.42198900  1
  P  P32  1  0.12196300  0.14966600  0.57564400  1
  P  P33  1  0.06128300  0.93095400  0.75755600  1
  P  P34  1  0.11805100  0.70984300  0.11176100  1
  P  P35  1  0.02413200  0.45208600  0.24632300  1
  O  O36  1  0.97707300  0.58014100  0.62302200  1
  O  O37  1  0.96934500  0.16210000  0.56145100  1
  O  O38  1  0.91473900  0.91285700  0.73138500  1
  O  O39  1  0.89427000  0.65035600  0.84471000  1
  O  O40  1  0.90192000  0.40375100  0.78043700  1
  O  O41  1  0.81561400  0.17038900  0.83417700  1
  O  O42  1  0.77031300  0.34695400  0.99640400  1
  O  O43  1  0.97974300  0.73485800  0.08240900  1
  O  O44  1  0.88332800  0.92182800  0.29522700  1
  O  O45  1  0.93505200  0.06475800  0.11063300  1
  O  O46  1  0.87061700  0.46348300  0.22620900  1
  O  O47  1  0.82012700  0.70833500  0.41322800  1
  O  O48  1  0.83462200  0.17705800  0.31011400  1
  O  O49  1  0.78689700  0.94213000  0.51859000  1
  O  O50  1  0.72050800  0.43611000  0.48111600  1
  O  O51  1  0.67144900  0.67436500  0.69568400  1
  O  O52  1  0.68119100  0.20970400  0.58295900  1
  O  O53  1  0.62921100  0.95994100  0.78279100  1
  O  O54  1  0.62257600  0.42253800  0.70577600  1
  O  O55  1  0.55889900  0.56439000  0.89121800  1
  O  O56  1  0.52062700  0.22547500  0.92358000  1
  O  O57  1  0.72305900  0.86014200  0.00032000  1
  O  O58  1  0.67770700  0.67060700  0.16326800  1
  O  O59  1  0.59420700  0.90276400  0.21861200  1
  O  O60  1  0.58279900  0.41267900  0.27264100  1
  O  O61  1  0.60883200  0.14485200  0.14682700  1
  O  O62  1  0.48026200  0.92028900  0.62701100  1
  O  O63  1  0.53243100  0.64970400  0.43255700  1
  O  O64  1  0.46756900  0.35029600  0.56744300  1
  O  O65  1  0.51973800  0.07971100  0.37298900  1
  O  O66  1  0.39116800  0.85514800  0.85317300  1
  O  O67  1  0.41720100  0.58732100  0.72735900  1
  O  O68  1  0.40579300  0.09723600  0.78138800  1
  O  O69  1  0.32229300  0.32939300  0.83673200  1
  O  O70  1  0.27694100  0.13985800  0.99968000  1
  O  O71  1  0.47937300  0.77452500  0.07642000  1
  O  O72  1  0.44110100  0.43561000  0.10878200  1
  O  O73  1  0.37742400  0.57746200  0.29422400  1
  O  O74  1  0.37078900  0.04005900  0.21720900  1
  O  O75  1  0.31880900  0.79029600  0.41704100  1
  O  O76  1  0.32855100  0.32563500  0.30431600  1
  O  O77  1  0.27949200  0.56389000  0.51888400  1
  O  O78  1  0.21310300  0.05787000  0.48141000  1
  O  O79  1  0.16537800  0.82294200  0.68988600  1
  O  O80  1  0.17987300  0.29166500  0.58677200  1
  O  O81  1  0.12938300  0.53651700  0.77379100  1
  O  O82  1  0.06494800  0.93524200  0.88936700  1
  O  O83  1  0.11667200  0.07817200  0.70477300  1
  O  O84  1  0.02025700  0.26514200  0.91759100  1
  O  O85  1  0.22968700  0.65304600  0.00359600  1
  O  O86  1  0.18438600  0.82961100  0.16582300  1
  O  O87  1  0.09808000  0.59624900  0.21956300  1
  O  O88  1  0.10573000  0.34964400  0.15529000  1
  O  O89  1  0.08526100  0.08714300  0.26861500  1
  O  O90  1  0.03065500  0.83790000  0.43854900  1
  O  O91  1  0.02292700  0.41985900  0.37697800  1
