# generated using pymatgen
data_LiMnPH2O5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.14006600
_cell_length_b   10.21377400
_cell_length_c   17.14230500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMnPH2O5
_chemical_formula_sum   'Li8 Mn8 P8 H16 O40'
_cell_volume   899.96196940
_cell_formula_units_Z   8
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  0.52846600  0.14951700  0.19335800  1
  Li  Li1  1  0.47153400  0.14951700  0.69335800  1
  Li  Li2  1  0.09806200  0.42004500  0.94579100  1
  Li  Li3  1  0.90193800  0.42004500  0.44579100  1
  Li  Li4  1  0.47153400  0.64951700  0.80664200  1
  Li  Li5  1  0.52846600  0.64951700  0.30664200  1
  Li  Li6  1  0.09806200  0.92004500  0.55420900  1
  Li  Li7  1  0.90193800  0.92004500  0.05420900  1
  Mn  Mn8  1  0.46540700  0.18293400  0.50018800  1
  Mn  Mn9  1  0.53459300  0.18293400  0.00018800  1
  Mn  Mn10  1  0.90760000  0.39123100  0.25109900  1
  Mn  Mn11  1  0.09240000  0.39123100  0.75109900  1
  Mn  Mn12  1  0.46540700  0.68293400  0.99981200  1
  Mn  Mn13  1  0.53459300  0.68293400  0.49981200  1
  Mn  Mn14  1  0.09240000  0.89123100  0.74890100  1
  Mn  Mn15  1  0.90760000  0.89123100  0.24890100  1
  P  P16  1  0.01036900  0.22606700  0.09252800  1
  P  P17  1  0.98963100  0.22606700  0.59252800  1
  P  P18  1  0.41035100  0.34528400  0.34242500  1
  P  P19  1  0.58964900  0.34528400  0.84242500  1
  P  P20  1  0.98963100  0.72606700  0.90747200  1
  P  P21  1  0.01036900  0.72606700  0.40747200  1
  P  P22  1  0.58964900  0.84528400  0.65757500  1
  P  P23  1  0.41035100  0.84528400  0.15757500  1
  H  H24  1  0.09091400  0.00364200  0.37576100  1
  H  H25  1  0.90908600  0.00364200  0.87576100  1
  H  H26  1  0.63040700  0.05391100  0.37681000  1
  H  H27  1  0.36959300  0.05391100  0.87681000  1
  H  H28  1  0.16550300  0.11115700  0.31134500  1
  H  H29  1  0.83449700  0.11115700  0.81134500  1
  H  H30  1  0.65992700  0.44940200  0.05659100  1
  H  H31  1  0.34007300  0.44940200  0.55659100  1
  H  H32  1  0.09091400  0.50364200  0.12423900  1
  H  H33  1  0.90908600  0.50364200  0.62423900  1
  H  H34  1  0.36959300  0.55391100  0.62319000  1
  H  H35  1  0.63040700  0.55391100  0.12319000  1
  H  H36  1  0.83449700  0.61115700  0.68865500  1
  H  H37  1  0.16550300  0.61115700  0.18865500  1
  H  H38  1  0.65992700  0.94940200  0.44340900  1
  H  H39  1  0.34007300  0.94940200  0.94340900  1
  O  O40  1  0.54305200  0.02031900  0.42395100  1
  O  O41  1  0.45694800  0.02031900  0.92395100  1
  O  O42  1  0.02983700  0.04409300  0.32661900  1
  O  O43  1  0.97016300  0.04409300  0.82661900  1
  O  O44  1  0.87571100  0.11155600  0.04750100  1
  O  O45  1  0.12428900  0.11155600  0.54750100  1
  O  O46  1  0.69277200  0.19820700  0.59966000  1
  O  O47  1  0.30722800  0.19820700  0.09966000  1
  O  O48  1  0.57696900  0.21427100  0.79699100  1
  O  O49  1  0.42303100  0.21427100  0.29699100  1
  O  O50  1  0.88675800  0.23465100  0.17565300  1
  O  O51  1  0.11324200  0.23465100  0.67565300  1
  O  O52  1  0.45642900  0.33325200  0.92418900  1
  O  O53  1  0.54357100  0.33325200  0.42418900  1
  O  O54  1  0.95767200  0.35478300  0.04667600  1
  O  O55  1  0.04232800  0.35478300  0.54667600  1
  O  O56  1  0.12006800  0.38529100  0.35314100  1
  O  O57  1  0.87993200  0.38529100  0.85314100  1
  O  O58  1  0.55596200  0.45479400  0.29603700  1
  O  O59  1  0.44403800  0.45479400  0.79603700  1
  O  O60  1  0.54305200  0.52031900  0.07604900  1
  O  O61  1  0.45694800  0.52031900  0.57604900  1
  O  O62  1  0.02983700  0.54409300  0.17338100  1
  O  O63  1  0.97016300  0.54409300  0.67338100  1
  O  O64  1  0.12428900  0.61155600  0.95249900  1
  O  O65  1  0.87571100  0.61155600  0.45249900  1
  O  O66  1  0.69277200  0.69820700  0.90034000  1
  O  O67  1  0.30722800  0.69820700  0.40034000  1
  O  O68  1  0.57696900  0.71427100  0.70300900  1
  O  O69  1  0.42303100  0.71427100  0.20300900  1
  O  O70  1  0.88675800  0.73465100  0.32434700  1
  O  O71  1  0.11324200  0.73465100  0.82434700  1
  O  O72  1  0.45642900  0.83325200  0.57581100  1
  O  O73  1  0.54357100  0.83325200  0.07581100  1
  O  O74  1  0.95767200  0.85478300  0.45332400  1
  O  O75  1  0.04232800  0.85478300  0.95332400  1
  O  O76  1  0.87993200  0.88529100  0.64685900  1
  O  O77  1  0.12006800  0.88529100  0.14685900  1
  O  O78  1  0.44403800  0.95479400  0.70396300  1
  O  O79  1  0.55596200  0.95479400  0.20396300  1
