# generated using pymatgen
data_LiMnP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.18307300
_cell_length_b   8.44698600
_cell_length_c   13.46310058
_cell_angle_alpha   62.18206892
_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   521.31485190
_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  0.26015900  0.55823500  0.29921800  1
  Li  Li1  1  0.76015900  0.44176500  0.20078200  1
  Li  Li2  1  0.73984100  0.44176500  0.70078200  1
  Li  Li3  1  0.23984100  0.55823500  0.79921800  1
  Mn  Mn4  1  0.26109900  0.73147800  0.52923300  1
  Mn  Mn5  1  0.73890100  0.26852200  0.47076700  1
  Mn  Mn6  1  0.76109900  0.26852200  0.97076700  1
  Mn  Mn7  1  0.23890100  0.73147800  0.02923300  1
  P  P8  1  0.76301500  0.82872300  0.14705200  1
  P  P9  1  0.26301500  0.17127700  0.35294800  1
  P  P10  1  0.71344800  0.68743100  0.88572500  1
  P  P11  1  0.78655200  0.68743100  0.38572500  1
  P  P12  1  0.23698500  0.17127700  0.85294800  1
  P  P13  1  0.21344800  0.31256900  0.61427500  1
  P  P14  1  0.28655200  0.31256900  0.11427500  1
  P  P15  1  0.73698500  0.82872300  0.64705200  1
  O  O16  1  0.77514800  0.84701000  0.76137100  1
  O  O17  1  0.79386300  0.52142000  0.87169000  1
  O  O18  1  0.29386300  0.47858000  0.62831000  1
  O  O19  1  0.42201300  0.68361000  0.90821100  1
  O  O20  1  0.23114000  0.98395000  0.44806400  1
  O  O21  1  0.62208800  0.71790100  0.46655500  1
  O  O22  1  0.05466700  0.29931900  0.35453400  1
  O  O23  1  0.20613700  0.47858000  0.12831000  1
  O  O24  1  0.37791200  0.28209900  0.53344500  1
  O  O25  1  0.27514800  0.15299000  0.73862900  1
  O  O26  1  0.73114000  0.01605000  0.05193600  1
  O  O27  1  0.22485200  0.15299000  0.23862900  1
  O  O28  1  0.96700600  0.25417500  0.84099900  1
  O  O29  1  0.92201300  0.31639000  0.59178900  1
  O  O30  1  0.12208800  0.28209900  0.03344500  1
  O  O31  1  0.70613700  0.52142000  0.37169000  1
  O  O32  1  0.87791200  0.71790100  0.96655500  1
  O  O33  1  0.72485200  0.84701000  0.26137100  1
  O  O34  1  0.44533300  0.29931900  0.85453400  1
  O  O35  1  0.03299400  0.74582500  0.15900100  1
  O  O36  1  0.55466700  0.70068100  0.14546600  1
  O  O37  1  0.53299400  0.25417500  0.34099900  1
  O  O38  1  0.57798700  0.31639000  0.09178900  1
  O  O39  1  0.94533300  0.70068100  0.64546600  1
  O  O40  1  0.46700600  0.74582500  0.65900100  1
  O  O41  1  0.07798700  0.68361000  0.40821100  1
  O  O42  1  0.26886000  0.98395000  0.94806400  1
  O  O43  1  0.76886000  0.01605000  0.55193600  1
