# generated using pymatgen
data_LiMnP2HO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.66370673
_cell_length_b   6.58967379
_cell_length_c   12.49898429
_cell_angle_alpha   96.71110131
_cell_angle_beta   99.41910660
_cell_angle_gamma   90.40910447
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMnP2HO7
_chemical_formula_sum   'Li4 Mn4 P8 H4 O28'
_cell_volume   537.54798779
_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  0.96625100  0.11939700  0.12062200  1
  Li  Li1  1  0.46625800  0.11928900  0.62058100  1
  Li  Li2  1  0.53358700  0.88065200  0.37934700  1
  Li  Li3  1  0.03386600  0.88068800  0.87945500  1
  Mn  Mn4  1  0.83082500  0.34813300  0.55224500  1
  Mn  Mn5  1  0.16972800  0.65239900  0.44786100  1
  Mn  Mn6  1  0.33020200  0.34740600  0.05205400  1
  Mn  Mn7  1  0.66982100  0.65268500  0.94784500  1
  P  P8  1  0.15775700  0.15796100  0.38643800  1
  P  P9  1  0.65779700  0.15790200  0.88640100  1
  P  P10  1  0.34218800  0.84210000  0.11355700  1
  P  P11  1  0.84212500  0.84201900  0.61354800  1
  P  P12  1  0.50261700  0.38659000  0.32001300  1
  P  P13  1  0.00264900  0.38648500  0.82007500  1
  P  P14  1  0.99738700  0.61349500  0.17997500  1
  P  P15  1  0.49734500  0.61327800  0.67998500  1
  H  H16  1  0.83092900  0.16670600  0.32803000  1
  H  H17  1  0.33102200  0.16649800  0.82798900  1
  H  H18  1  0.66898400  0.83350900  0.17197500  1
  H  H19  1  0.16893600  0.83328800  0.67198700  1
  O  O20  1  0.95669300  0.09233900  0.30232600  1
  O  O21  1  0.45674300  0.09218300  0.80230000  1
  O  O22  1  0.54324400  0.90783300  0.19765500  1
  O  O23  1  0.04319100  0.90766700  0.69766000  1
  O  O24  1  0.23318100  0.02234300  0.06569800  1
  O  O25  1  0.73316800  0.02227100  0.56568600  1
  O  O26  1  0.26669300  0.97762200  0.43429300  1
  O  O27  1  0.76677700  0.97758400  0.93422100  1
  O  O28  1  0.29401400  0.24254200  0.30765300  1
  O  O29  1  0.79403100  0.24252600  0.80762600  1
  O  O30  1  0.20596900  0.75751800  0.19236500  1
  O  O31  1  0.70595700  0.75733600  0.69236500  1
  O  O32  1  0.66905700  0.26447000  0.38441700  1
  O  O33  1  0.16906100  0.26421500  0.88444200  1
  O  O34  1  0.83096200  0.73571000  0.11558600  1
  O  O35  1  0.33089600  0.73552500  0.61561600  1
  O  O36  1  0.11193400  0.32561600  0.47299600  1
  O  O37  1  0.61194000  0.32550300  0.97300100  1
  O  O38  1  0.38808900  0.67443500  0.02697800  1
  O  O39  1  0.88806700  0.67435100  0.52704100  1
  O  O40  1  0.52843800  0.39519000  0.20308600  1
  O  O41  1  0.02866100  0.39500500  0.70315000  1
  O  O42  1  0.97150200  0.60502800  0.29693500  1
  O  O43  1  0.47146100  0.60477800  0.79689200  1
  O  O44  1  0.04225300  0.41142900  0.11568300  1
  O  O45  1  0.54230400  0.41127600  0.61565800  1
  O  O46  1  0.45766700  0.58861600  0.38434600  1
  O  O47  1  0.95776900  0.58861000  0.88434300  1
