# generated using pymatgen
data_LiMnP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.19844700
_cell_length_b   6.97844300
_cell_length_c   9.22731253
_cell_angle_alpha   69.59218392
_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   494.78166056
_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  0.94242900  0.29945200  0.83400300  1
  Li  Li1  1  0.44242900  0.70054800  0.66599700  1
  Li  Li2  1  0.55757100  0.29945200  0.33400300  1
  Li  Li3  1  0.05757100  0.70054800  0.16599700  1
  Mn  Mn4  1  0.56991500  0.24634500  0.87000400  1
  Mn  Mn5  1  0.06991500  0.75365500  0.62999600  1
  Mn  Mn6  1  0.93008500  0.24634500  0.37000400  1
  Mn  Mn7  1  0.43008500  0.75365500  0.12999600  1
  P  P8  1  0.73720800  0.54025600  0.52923400  1
  P  P9  1  0.23720800  0.45974400  0.97076600  1
  P  P10  1  0.73809400  0.93051100  0.24723900  1
  P  P11  1  0.23809400  0.06948900  0.25276100  1
  P  P12  1  0.76190600  0.93051100  0.74723900  1
  P  P13  1  0.26190600  0.06948900  0.75276100  1
  P  P14  1  0.76279200  0.54025600  0.02923400  1
  P  P15  1  0.26279200  0.45974400  0.47076600  1
  O  O16  1  0.59902000  0.48536600  0.64558300  1
  O  O17  1  0.90075100  0.57442300  0.59876100  1
  O  O18  1  0.74386700  0.37716900  0.95212600  1
  O  O19  1  0.24386700  0.62283100  0.54787400  1
  O  O20  1  0.40075100  0.42557700  0.90123900  1
  O  O21  1  0.67698700  0.74700900  0.39982000  1
  O  O22  1  0.09902000  0.51463400  0.85441700  1
  O  O23  1  0.24636000  0.88286400  0.19807700  1
  O  O24  1  0.89161000  0.88102300  0.18313900  1
  O  O25  1  0.58852700  0.96091700  0.13578400  1
  O  O26  1  0.82301300  0.74700900  0.89982000  1
  O  O27  1  0.08852700  0.03908300  0.36421600  1
  O  O28  1  0.25364000  0.88286400  0.69807700  1
  O  O29  1  0.60839000  0.88102300  0.68313900  1
  O  O30  1  0.39161000  0.11897700  0.31686100  1
  O  O31  1  0.74636000  0.11713600  0.30192300  1
  O  O32  1  0.91147300  0.96091700  0.63578400  1
  O  O33  1  0.17698700  0.25299100  0.10018000  1
  O  O34  1  0.41147300  0.03908300  0.86421600  1
  O  O35  1  0.10839000  0.11897700  0.81686100  1
  O  O36  1  0.75364000  0.11713600  0.80192300  1
  O  O37  1  0.90098000  0.48536600  0.14558300  1
  O  O38  1  0.32301300  0.25299100  0.60018000  1
  O  O39  1  0.59924900  0.57442300  0.09876100  1
  O  O40  1  0.75613300  0.37716900  0.45212600  1
  O  O41  1  0.25613300  0.62283100  0.04787400  1
  O  O42  1  0.09924900  0.42557700  0.40123900  1
  O  O43  1  0.40098000  0.51463400  0.35441700  1
