# generated using pymatgen
data_LiMnP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.03963100
_cell_length_b   5.13952900
_cell_length_c   14.06615208
_cell_angle_alpha   70.56861440
_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   548.10671132
_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  0.78569600  0.03504700  0.73681000  1
  Li  Li1  1  0.28569600  0.96495300  0.76319000  1
  Li  Li2  1  0.71430400  0.03504700  0.23681000  1
  Li  Li3  1  0.21430400  0.96495300  0.26319000  1
  Mn  Mn4  1  0.35237200  0.33978600  0.38051300  1
  Mn  Mn5  1  0.64762800  0.66021400  0.61948700  1
  Mn  Mn6  1  0.14762800  0.33978600  0.88051300  1
  Mn  Mn7  1  0.85237200  0.66021400  0.11948700  1
  P  P8  1  0.70515100  0.31581100  0.48058400  1
  P  P9  1  0.03273600  0.57929200  0.67578900  1
  P  P10  1  0.53273600  0.42070800  0.82421100  1
  P  P11  1  0.29484900  0.68418900  0.51941600  1
  P  P12  1  0.96726400  0.42070800  0.32421100  1
  P  P13  1  0.46726400  0.57929200  0.17578900  1
  P  P14  1  0.79484900  0.31581100  0.98058400  1
  P  P15  1  0.20515100  0.68418900  0.01941600  1
  O  O16  1  0.40871500  0.72959900  0.60076400  1
  O  O17  1  0.53609400  0.18777400  0.78105100  1
  O  O18  1  0.14202700  0.52872900  0.33866800  1
  O  O19  1  0.59128500  0.27040100  0.39923600  1
  O  O20  1  0.29376600  0.91607900  0.41893500  1
  O  O21  1  0.46390600  0.81222600  0.21894900  1
  O  O22  1  0.13438700  0.32630500  0.74157800  1
  O  O23  1  0.82920200  0.60203700  0.99124600  1
  O  O24  1  0.10910900  0.67439700  0.56342500  1
  O  O25  1  0.32920200  0.39796300  0.50875400  1
  O  O26  1  0.63438700  0.67369500  0.75842200  1
  O  O27  1  0.67079800  0.60203700  0.49124600  1
  O  O28  1  0.20623400  0.91607900  0.91893500  1
  O  O29  1  0.90871500  0.27040100  0.89923600  1
  O  O30  1  0.36561300  0.32630500  0.24157800  1
  O  O31  1  0.17079800  0.39796300  0.00875400  1
  O  O32  1  0.89089100  0.32560300  0.43657500  1
  O  O33  1  0.64202700  0.47127100  0.16133200  1
  O  O34  1  0.79376600  0.08392100  0.08106500  1
  O  O35  1  0.39089100  0.67439700  0.06342500  1
  O  O36  1  0.60910900  0.32560300  0.93657500  1
  O  O37  1  0.86561300  0.67369500  0.25842200  1
  O  O38  1  0.96390600  0.18777400  0.28105100  1
  O  O39  1  0.85797300  0.47127100  0.66133200  1
  O  O40  1  0.35797300  0.52872900  0.83866800  1
  O  O41  1  0.03609400  0.81222600  0.71894900  1
  O  O42  1  0.70623400  0.08392100  0.58106500  1
  O  O43  1  0.09128500  0.72959900  0.10076400  1
