# generated using pymatgen
data_LiMnP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.89532500
_cell_length_b   7.28930200
_cell_length_c   9.26896147
_cell_angle_alpha   73.23096288
_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   510.75746870
_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  0.49006700  0.68676600  0.79236100  1
  Li  Li1  1  0.00993300  0.68676600  0.29236100  1
  Li  Li2  1  0.99006700  0.31323400  0.70763900  1
  Li  Li3  1  0.50993300  0.31323400  0.20763900  1
  Mn  Mn4  1  0.00836700  0.72271100  0.75748600  1
  Mn  Mn5  1  0.49163300  0.72271100  0.25748600  1
  Mn  Mn6  1  0.50836700  0.27728900  0.74251400  1
  Mn  Mn7  1  0.99163300  0.27728900  0.24251400  1
  P  P8  1  0.26937500  0.89714200  0.96079000  1
  P  P9  1  0.23062500  0.89714200  0.46079000  1
  P  P10  1  0.72354200  0.67808400  0.54317900  1
  P  P11  1  0.22354200  0.32191600  0.95682100  1
  P  P12  1  0.77645800  0.67808400  0.04317900  1
  P  P13  1  0.27645800  0.32191600  0.45682100  1
  P  P14  1  0.76937500  0.10285800  0.53921000  1
  P  P15  1  0.73062500  0.10285800  0.03921000  1
  O  O16  1  0.61343500  0.19412200  0.58803600  1
  O  O17  1  0.42586500  0.91270200  0.86376600  1
  O  O18  1  0.69972000  0.89011300  0.55572400  1
  O  O19  1  0.78762600  0.68258700  0.87651300  1
  O  O20  1  0.20769500  0.79794900  0.63078600  1
  O  O21  1  0.88656500  0.19412200  0.08803600  1
  O  O22  1  0.07413500  0.91270200  0.36376600  1
  O  O23  1  0.58586500  0.56595600  0.64422100  1
  O  O24  1  0.80028000  0.89011300  0.05572400  1
  O  O25  1  0.40347300  0.38846900  0.89441300  1
  O  O26  1  0.71237400  0.68258700  0.37651300  1
  O  O27  1  0.29230500  0.79794900  0.13078600  1
  O  O28  1  0.90347300  0.61153100  0.60558700  1
  O  O29  1  0.08586500  0.43404400  0.85577900  1
  O  O30  1  0.91413500  0.56595600  0.14422100  1
  O  O31  1  0.09652700  0.38846900  0.39441300  1
  O  O32  1  0.70769500  0.20205100  0.86921400  1
  O  O33  1  0.28762600  0.31741300  0.62348700  1
  O  O34  1  0.59652700  0.61153100  0.10558700  1
  O  O35  1  0.19972000  0.10988700  0.94427600  1
  O  O36  1  0.41413500  0.43404400  0.35577900  1
  O  O37  1  0.92586500  0.08729800  0.63623400  1
  O  O38  1  0.11343500  0.80587800  0.91196400  1
  O  O39  1  0.79230500  0.20205100  0.36921400  1
  O  O40  1  0.21237400  0.31741300  0.12348700  1
  O  O41  1  0.30028000  0.10988700  0.44427600  1
  O  O42  1  0.57413500  0.08729800  0.13623400  1
  O  O43  1  0.38656500  0.80587800  0.41196400  1
