# generated using pymatgen
data_LiMnP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.17193400
_cell_length_b   6.91236044
_cell_length_c   8.07193663
_cell_angle_alpha   112.49916422
_cell_angle_beta   90.68579659
_cell_angle_gamma   92.31437285
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMnP2O7
_chemical_formula_sum   'Li2 Mn2 P4 O14'
_cell_volume   266.27412248
_cell_formula_units_Z   2
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  0.70438100  0.16224300  0.99082200  1
  Li  Li1  1  0.23902100  0.83634400  0.42896500  1
  Mn  Mn2  1  0.77876000  0.76642900  0.73016500  1
  Mn  Mn3  1  0.24424900  0.21573000  0.27176300  1
  P  P4  1  0.71748100  0.53861000  0.30223800  1
  P  P5  1  0.28543600  0.46257700  0.69647700  1
  P  P6  1  0.75958100  0.88701300  0.17626000  1
  P  P7  1  0.23142900  0.11067700  0.82544000  1
  O  O8  1  0.12701900  0.65142600  0.77637500  1
  O  O9  1  0.39786100  0.96411900  0.68254600  1
  O  O10  1  0.72368200  0.64540600  0.15598800  1
  O  O11  1  0.93826400  0.05524000  0.79004100  1
  O  O12  1  0.85179000  0.70162400  0.47329500  1
  O  O13  1  0.86341300  0.34020500  0.21569000  1
  O  O14  1  0.70649100  0.87510000  0.98484600  1
  O  O15  1  0.56485900  0.01804200  0.30422400  1
  O  O16  1  0.57541600  0.51074300  0.67998600  1
  O  O17  1  0.32175300  0.13952100  0.01662600  1
  O  O18  1  0.27333500  0.34758900  0.83748000  1
  O  O19  1  0.42631900  0.49985400  0.32679800  1
  O  O20  1  0.17201700  0.29415300  0.51964200  1
  O  O21  1  0.04789300  0.94485300  0.23599600  1
