# generated using pymatgen
data_LiMnP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.60390700
_cell_length_b   4.95672200
_cell_length_c   16.60135862
_cell_angle_alpha   88.39506323
_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   543.21122682
_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  0.47877900  0.24371400  0.75958000  1
  Li  Li1  1  0.02122100  0.24371400  0.25958000  1
  Li  Li2  1  0.97877900  0.75628600  0.74042000  1
  Li  Li3  1  0.52122100  0.75628600  0.24042000  1
  Mn  Mn4  1  0.08175900  0.24916800  0.62623200  1
  Mn  Mn5  1  0.41824100  0.24916800  0.12623200  1
  Mn  Mn6  1  0.58175900  0.75083200  0.87376800  1
  Mn  Mn7  1  0.91824100  0.75083200  0.37376800  1
  P  P8  1  0.29665600  0.24014000  0.92647300  1
  P  P9  1  0.20334400  0.24014000  0.42647300  1
  P  P10  1  0.90319100  0.24991400  0.83699400  1
  P  P11  1  0.59680900  0.24991400  0.33699400  1
  P  P12  1  0.40319100  0.75008600  0.66300600  1
  P  P13  1  0.09680900  0.75008600  0.16300600  1
  P  P14  1  0.79665600  0.75986000  0.57352700  1
  P  P15  1  0.70334400  0.75986000  0.07352700  1
  O  O16  1  0.84055500  0.46231200  0.59486000  1
  O  O17  1  0.65944500  0.46231200  0.09486000  1
  O  O18  1  0.73939500  0.42834400  0.87162400  1
  O  O19  1  0.76060500  0.42834400  0.37162400  1
  O  O20  1  0.01214200  0.37213300  0.76388800  1
  O  O21  1  0.48785800  0.37213300  0.26388800  1
  O  O22  1  0.05838600  0.19477600  0.90925300  1
  O  O23  1  0.44161400  0.19477600  0.40925300  1
  O  O24  1  0.17748500  0.14950000  0.51230900  1
  O  O25  1  0.32251500  0.14950000  0.01230900  1
  O  O26  1  0.40711200  0.06401900  0.86319800  1
  O  O27  1  0.09288800  0.06401900  0.36319800  1
  O  O28  1  0.30932500  0.02883600  0.68304800  1
  O  O29  1  0.19067500  0.02883600  0.18304800  1
  O  O30  1  0.80932500  0.97116400  0.81695200  1
  O  O31  1  0.69067500  0.97116400  0.31695200  1
  O  O32  1  0.90711200  0.93598100  0.63680200  1
  O  O33  1  0.59288800  0.93598100  0.13680200  1
  O  O34  1  0.67748500  0.85050000  0.98769100  1
  O  O35  1  0.82251500  0.85050000  0.48769100  1
  O  O36  1  0.55838600  0.80522400  0.59074700  1
  O  O37  1  0.94161400  0.80522400  0.09074700  1
  O  O38  1  0.51214200  0.62786700  0.73611200  1
  O  O39  1  0.98785800  0.62786700  0.23611200  1
  O  O40  1  0.23939500  0.57165600  0.62837600  1
  O  O41  1  0.26060500  0.57165600  0.12837600  1
  O  O42  1  0.34055500  0.53768800  0.90514000  1
  O  O43  1  0.15944500  0.53768800  0.40514000  1
