# generated using pymatgen
data_Li2Mn3(P2O7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.99928800
_cell_length_b   7.47053200
_cell_length_c   9.83755703
_cell_angle_alpha   70.09852728
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Mn3(P2O7)2
_chemical_formula_sum   'Li4 Mn6 P8 O28'
_cell_volume   552.77327454
_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  0.58015000  0.70880900  0.85337200  1
  Li  Li1  1  0.91985000  0.70880900  0.35337200  1
  Li  Li2  1  0.08015000  0.29119100  0.64662800  1
  Li  Li3  1  0.41985000  0.29119100  0.14662800  1
  Mn  Mn4  1  0.00000000  0.00000000  0.50000000  1
  Mn  Mn5  1  0.62200800  0.80174900  0.52103500  1
  Mn  Mn6  1  0.50000000  0.00000000  0.00000000  1
  Mn  Mn7  1  0.87799200  0.80174900  0.02103500  1
  Mn  Mn8  1  0.12200800  0.19825100  0.97896500  1
  Mn  Mn9  1  0.37799200  0.19825100  0.47896500  1
  P  P10  1  0.79538300  0.11624000  0.19470400  1
  P  P11  1  0.70461700  0.11624000  0.69470400  1
  P  P12  1  0.05041400  0.39899600  0.22057200  1
  P  P13  1  0.55041400  0.60100400  0.27942800  1
  P  P14  1  0.44958600  0.39899600  0.72057200  1
  P  P15  1  0.94958600  0.60100400  0.77942800  1
  P  P16  1  0.20461700  0.88376000  0.80529600  1
  P  P17  1  0.29538300  0.88376000  0.30529600  1
  O  O18  1  0.29597800  0.01141400  0.14409100  1
  O  O19  1  0.91576700  0.03429400  0.10792300  1
  O  O20  1  0.62451000  0.15593300  0.12375700  1
  O  O21  1  0.20402200  0.01141400  0.64409100  1
  O  O22  1  0.58423300  0.03429400  0.60792300  1
  O  O23  1  0.86935700  0.31719700  0.19198100  1
  O  O24  1  0.70402200  0.98858600  0.85590900  1
  O  O25  1  0.08423300  0.96570600  0.89207700  1
  O  O26  1  0.37549000  0.84406700  0.87624300  1
  O  O27  1  0.79597800  0.98858600  0.35590900  1
  O  O28  1  0.41576700  0.96570600  0.39207700  1
  O  O29  1  0.13064300  0.68280300  0.80801900  1
  O  O30  1  0.82873000  0.62280800  0.89356200  1
  O  O31  1  0.12451000  0.84406700  0.37624300  1
  O  O32  1  0.89146300  0.72056400  0.62480300  1
  O  O33  1  0.49528800  0.60455700  0.70364700  1
  O  O34  1  0.36935700  0.68280300  0.30801900  1
  O  O35  1  0.67127000  0.62280800  0.39356200  1
  O  O36  1  0.60853700  0.72056400  0.12480300  1
  O  O37  1  0.99528800  0.39544300  0.79635300  1
  O  O38  1  0.00471200  0.60455700  0.20364700  1
  O  O39  1  0.39146300  0.27943600  0.87519700  1
  O  O40  1  0.32873000  0.37719200  0.60643800  1
  O  O41  1  0.63064300  0.31719700  0.69198100  1
  O  O42  1  0.50471200  0.39544300  0.29635300  1
  O  O43  1  0.10853700  0.27943600  0.37519700  1
  O  O44  1  0.87549000  0.15593300  0.62375700  1
  O  O45  1  0.17127000  0.37719200  0.10643800  1
