# generated using pymatgen
data_LiMnP3HO10
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.30471263
_cell_length_b   7.30471263
_cell_length_c   9.44800838
_cell_angle_alpha   73.53205086
_cell_angle_beta   73.53205086
_cell_angle_gamma   67.44284439
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMnP3HO10
_chemical_formula_sum   'Li2 Mn2 P6 H2 O20'
_cell_volume   437.69220992
_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  0.43439200  0.56560800  0.75000000  1
  Li  Li1  1  0.56560800  0.43439100  0.25000000  1
  Mn  Mn2  1  0.00000000  0.50000000  0.50000000  1
  Mn  Mn3  1  0.50000000  0.00000000  0.00000000  1
  P  P4  1  0.86122100  0.72310200  0.79428300  1
  P  P5  1  0.72310200  0.86122100  0.29428300  1
  P  P6  1  0.86274200  0.13725800  0.75000000  1
  P  P7  1  0.13725800  0.86274200  0.25000000  1
  P  P8  1  0.27689800  0.13877900  0.70571700  1
  P  P9  1  0.13877900  0.27689800  0.20571700  1
  H  H10  1  0.00000000  0.50000000  0.00000000  1
  H  H11  1  0.50000000  0.00000000  0.50000000  1
  O  O12  1  0.90118400  0.93054900  0.70012900  1
  O  O13  1  0.93054900  0.90118400  0.20012900  1
  O  O14  1  0.65336400  0.77229900  0.90077100  1
  O  O15  1  0.84768700  0.62537800  0.67741200  1
  O  O16  1  0.39280600  0.96160500  0.62179600  1
  O  O17  1  0.77229900  0.65336400  0.40077100  1
  O  O18  1  0.62537800  0.84768700  0.17741200  1
  O  O19  1  0.83235600  0.29760600  0.61010300  1
  O  O20  1  0.96160500  0.39280600  0.12179600  1
  O  O21  1  0.70239400  0.16764400  0.88989700  1
  O  O22  1  0.29760600  0.83235600  0.11010300  1
  O  O23  1  0.03839500  0.60719400  0.87820400  1
  O  O24  1  0.16764400  0.70239400  0.38989700  1
  O  O25  1  0.37462200  0.15231300  0.82258800  1
  O  O26  1  0.22770100  0.34663600  0.59922900  1
  O  O27  1  0.60719400  0.03839500  0.37820400  1
  O  O28  1  0.15231300  0.37462200  0.32258800  1
  O  O29  1  0.34663600  0.22770100  0.09922900  1
  O  O30  1  0.06945100  0.09881600  0.79987100  1
  O  O31  1  0.09881600  0.06945100  0.29987100  1
