# generated using pymatgen
data_LiMnP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.35484400
_cell_length_b   5.04960000
_cell_length_c   9.61579636
_cell_angle_alpha   60.99132423
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMnP2O7
_chemical_formula_sum   'Li4 Mn4 P8 O28'
_cell_volume   567.10549320
_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  0.62456400  0.99256400  0.65830200  1
  Li  Li1  1  0.37543600  0.00743600  0.34169800  1
  Li  Li2  1  0.87543600  0.99256400  0.15830200  1
  Li  Li3  1  0.12456400  0.00743600  0.84169800  1
  Mn  Mn4  1  0.83642300  0.04529400  0.75381000  1
  Mn  Mn5  1  0.16357700  0.95470600  0.24619000  1
  Mn  Mn6  1  0.33642300  0.95470600  0.74619000  1
  Mn  Mn7  1  0.66357700  0.04529400  0.25381000  1
  P  P8  1  0.32402700  0.26919100  0.96189800  1
  P  P9  1  0.02955600  0.48288000  0.22483100  1
  P  P10  1  0.17597300  0.26919100  0.46189800  1
  P  P11  1  0.67597300  0.73080900  0.03810200  1
  P  P12  1  0.82402700  0.73080900  0.53810200  1
  P  P13  1  0.47044400  0.48288000  0.72483100  1
  P  P14  1  0.97044400  0.51712000  0.77516900  1
  P  P15  1  0.52955600  0.51712000  0.27516900  1
  O  O16  1  0.68875900  0.95352400  0.86321400  1
  O  O17  1  0.05785400  0.31771600  0.41690100  1
  O  O18  1  0.72270200  0.84693700  0.14586200  1
  O  O19  1  0.18875900  0.04647600  0.63678600  1
  O  O20  1  0.42528500  0.40132300  0.29571400  1
  O  O21  1  0.88988800  0.26119900  0.85810500  1
  O  O22  1  0.38988800  0.73880100  0.64189500  1
  O  O23  1  0.04657200  0.23123300  0.17812000  1
  O  O24  1  0.61011200  0.26119900  0.35810500  1
  O  O25  1  0.77729800  0.84693700  0.64586200  1
  O  O26  1  0.57471500  0.59867700  0.70428600  1
  O  O27  1  0.28220800  0.58237700  0.92024900  1
  O  O28  1  0.95342800  0.76876700  0.82188000  1
  O  O29  1  0.92528500  0.59867700  0.20428600  1
  O  O30  1  0.22270200  0.15306300  0.35413800  1
  O  O31  1  0.11011200  0.73880100  0.14189500  1
  O  O32  1  0.27729800  0.15306300  0.85413800  1
  O  O33  1  0.81124100  0.95352400  0.36321400  1
  O  O34  1  0.54657200  0.76876700  0.32188000  1
  O  O35  1  0.31124100  0.04647600  0.13678600  1
  O  O36  1  0.45342800  0.23123300  0.67812000  1
  O  O37  1  0.94214600  0.68228400  0.58309900  1
  O  O38  1  0.07471500  0.40132300  0.79571400  1
  O  O39  1  0.71779200  0.41762300  0.07975100  1
  O  O40  1  0.21779200  0.58237700  0.42024900  1
  O  O41  1  0.78220800  0.41762300  0.57975100  1
  O  O42  1  0.55785400  0.68228400  0.08309900  1
  O  O43  1  0.44214600  0.31771600  0.91690100  1
