# generated using pymatgen
data_Li2MnP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.35005589
_cell_length_b   7.35005589
_cell_length_c   11.63824669
_cell_angle_alpha   89.06021983
_cell_angle_beta   89.06021983
_cell_angle_gamma   120.07062803
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2MnP2O7
_chemical_formula_sum   'Li8 Mn4 P8 O28'
_cell_volume   543.82061029
_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  0.74635400  0.30824600  0.49128200  1
  Li  Li1  1  0.30824600  0.74635400  0.99128200  1
  Li  Li2  1  0.72880500  0.27119500  0.25000000  1
  Li  Li3  1  0.28927200  0.71072800  0.25000000  1
  Li  Li4  1  0.71072800  0.28927200  0.75000000  1
  Li  Li5  1  0.27119500  0.72880500  0.75000000  1
  Li  Li6  1  0.69175400  0.25364600  0.00871800  1
  Li  Li7  1  0.25364600  0.69175400  0.50871800  1
  Mn  Mn8  1  0.67406500  0.67759200  0.38075200  1
  Mn  Mn9  1  0.67759200  0.67406500  0.88075200  1
  Mn  Mn10  1  0.32240800  0.32593500  0.11924800  1
  Mn  Mn11  1  0.32593500  0.32240800  0.61924800  1
  P  P12  1  0.72891900  0.92851300  0.12170300  1
  P  P13  1  0.92851300  0.72891900  0.62170300  1
  P  P14  1  0.90626800  0.66469800  0.13517100  1
  P  P15  1  0.66469800  0.90626800  0.63517100  1
  P  P16  1  0.33530200  0.09373200  0.36482900  1
  P  P17  1  0.09373200  0.33530200  0.86482900  1
  P  P18  1  0.07148700  0.27108100  0.37829700  1
  P  P19  1  0.27108100  0.07148700  0.87829700  1
  O  O20  1  0.93837100  0.90257700  0.12331400  1
  O  O21  1  0.90257700  0.93837100  0.62331400  1
  O  O22  1  0.61749100  0.84615800  0.00713500  1
  O  O23  1  0.84615800  0.61749100  0.50713500  1
  O  O24  1  0.82015500  0.57710700  0.25741900  1
  O  O25  1  0.57710700  0.82015500  0.75741900  1
  O  O26  1  0.58904300  0.78996400  0.22447000  1
  O  O27  1  0.78996400  0.58904300  0.72447000  1
  O  O28  1  0.73754900  0.53812100  0.04483400  1
  O  O29  1  0.53812100  0.73754900  0.54483400  1
  O  O30  1  0.31075700  0.87853300  0.38318500  1
  O  O31  1  0.87853300  0.31075700  0.88318500  1
  O  O32  1  0.83750900  0.18611900  0.37188900  1
  O  O33  1  0.18611900  0.83750900  0.87188900  1
  O  O34  1  0.81388100  0.16249100  0.12811100  1
  O  O35  1  0.16249100  0.81388100  0.62811100  1
  O  O36  1  0.12146700  0.68924300  0.11681500  1
  O  O37  1  0.68924300  0.12146700  0.61681500  1
  O  O38  1  0.46187900  0.26245100  0.45516600  1
  O  O39  1  0.26245100  0.46187900  0.95516600  1
  O  O40  1  0.21003600  0.41095700  0.27553000  1
  O  O41  1  0.41095700  0.21003600  0.77553000  1
  O  O42  1  0.42289300  0.17984500  0.24258100  1
  O  O43  1  0.17984500  0.42289300  0.74258100  1
  O  O44  1  0.15384200  0.38250900  0.49286500  1
  O  O45  1  0.38250900  0.15384200  0.99286500  1
  O  O46  1  0.09742300  0.06162900  0.37668600  1
  O  O47  1  0.06162900  0.09742300  0.87668600  1
