# generated using pymatgen
data_LiMnP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.95310500
_cell_length_b   5.13228000
_cell_length_c   9.23401624
_cell_angle_alpha   59.50271834
_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   528.94118858
_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  0.82615400  0.93127100  0.35734300  1
  Li  Li1  1  0.32615400  0.06872900  0.14265700  1
  Li  Li2  1  0.67384600  0.93127100  0.85734300  1
  Li  Li3  1  0.17384600  0.06872900  0.64265700  1
  Mn  Mn4  1  0.64180400  0.62335300  0.65418300  1
  Mn  Mn5  1  0.14180400  0.37664700  0.84581700  1
  Mn  Mn6  1  0.85819600  0.62335300  0.15418300  1
  Mn  Mn7  1  0.35819600  0.37664700  0.34581700  1
  P  P8  1  0.02247500  0.08842600  0.20363200  1
  P  P9  1  0.69184800  0.23585300  0.05584300  1
  P  P10  1  0.19184800  0.76414700  0.44415700  1
  P  P11  1  0.52247500  0.91157400  0.29636800  1
  P  P12  1  0.47752500  0.08842600  0.70363200  1
  P  P13  1  0.80815200  0.23585300  0.55584300  1
  P  P14  1  0.30815200  0.76414700  0.94415700  1
  P  P15  1  0.97752500  0.91157400  0.79636800  1
  O  O16  1  0.77939800  0.95498300  0.54928600  1
  O  O17  1  0.76312300  0.29609600  0.16890700  1
  O  O18  1  0.02797800  0.72118000  0.73303400  1
  O  O19  1  0.43937400  0.05211200  0.35273300  1
  O  O20  1  0.68297100  0.52706900  0.88228000  1
  O  O21  1  0.10754500  0.25728700  0.07303900  1
  O  O22  1  0.57789100  0.19149000  0.13544800  1
  O  O23  1  0.07789100  0.80851000  0.36455200  1
  O  O24  1  0.60754500  0.74271300  0.42696100  1
  O  O25  1  0.18297100  0.47293100  0.61772000  1
  O  O26  1  0.93937400  0.94788800  0.14726700  1
  O  O27  1  0.52797800  0.27882000  0.76696600  1
  O  O28  1  0.27939800  0.04501700  0.95071400  1
  O  O29  1  0.26312300  0.70390400  0.33109300  1
  O  O30  1  0.73687700  0.29609600  0.66890700  1
  O  O31  1  0.72060200  0.95498300  0.04928600  1
  O  O32  1  0.47202200  0.72118000  0.23303400  1
  O  O33  1  0.06062600  0.05211200  0.85273300  1
  O  O34  1  0.81702900  0.52706900  0.38228000  1
  O  O35  1  0.39245500  0.25728700  0.57303900  1
  O  O36  1  0.92210900  0.19149000  0.63544800  1
  O  O37  1  0.42210900  0.80851000  0.86455200  1
  O  O38  1  0.89245500  0.74271300  0.92696100  1
  O  O39  1  0.31702900  0.47293100  0.11772000  1
  O  O40  1  0.56062600  0.94788800  0.64726700  1
  O  O41  1  0.97202200  0.27882000  0.26696600  1
  O  O42  1  0.23687700  0.70390400  0.83109300  1
  O  O43  1  0.22060200  0.04501700  0.45071400  1
