# generated using pymatgen
data_LiMnPO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.17989019
_cell_length_b   6.93803572
_cell_length_c   10.27596678
_cell_angle_alpha   76.82840957
_cell_angle_beta   98.12029334
_cell_angle_gamma   72.52584848
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMnPO5
_chemical_formula_sum   'Li4 Mn4 P4 O20'
_cell_volume   334.13602092
_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  0.44817000  0.58186100  0.17708600  1
  Li  Li1  1  0.94825900  0.08181000  0.67706500  1
  Li  Li2  1  0.05189800  0.91815400  0.32293100  1
  Li  Li3  1  0.55182000  0.41816300  0.82293700  1
  Mn  Mn4  1  0.49999000  0.50008600  0.50001100  1
  Mn  Mn5  1  0.99996100  0.49999500  0.00001400  1
  Mn  Mn6  1  0.99993400  0.00001700  0.99997900  1
  Mn  Mn7  1  0.50001700  0.99989500  0.49998400  1
  P  P8  1  0.00046200  0.43402000  0.32319000  1
  P  P9  1  0.50043000  0.93400900  0.82315500  1
  P  P10  1  0.49952200  0.06596800  0.17680900  1
  P  P11  1  0.99954900  0.56598200  0.67684800  1
  O  O12  1  0.28119300  0.95260500  0.16553600  1
  O  O13  1  0.78118600  0.45264900  0.66557600  1
  O  O14  1  0.21870800  0.54744900  0.33449500  1
  O  O15  1  0.71871100  0.04740700  0.83445600  1
  O  O16  1  0.36348000  0.30751800  0.11059900  1
  O  O17  1  0.86358700  0.80755200  0.61061300  1
  O  O18  1  0.13658800  0.19251200  0.38937700  1
  O  O19  1  0.63648300  0.69247400  0.88936200  1
  O  O20  1  0.64123100  0.01599300  0.33042600  1
  O  O21  1  0.14120000  0.51597200  0.83048800  1
  O  O22  1  0.85881400  0.48403600  0.16957000  1
  O  O23  1  0.35885500  0.98405300  0.66952000  1
  O  O24  1  0.74552100  0.96286400  0.11712500  1
  O  O25  1  0.24559200  0.46286600  0.61718500  1
  O  O26  1  0.75440400  0.53706200  0.38284800  1
  O  O27  1  0.25433000  0.03706600  0.88278900  1
  O  O28  1  0.13025100  0.71230300  0.02629700  1
  O  O29  1  0.63035800  0.21231500  0.52631100  1
  O  O30  1  0.36978700  0.78768800  0.47371700  1
  O  O31  1  0.86971000  0.28765500  0.97370300  1
