# generated using pymatgen
data_LiPO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.30601022
_cell_length_b   7.94786731
_cell_length_c   16.90987642
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   99.64294315
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiPO3
_chemical_formula_sum   'Li12 P12 O36'
_cell_volume   703.03850661
_cell_formula_units_Z   12
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  0.81343255  0.72350973  0.80934267  1
  Li  Li1  1  0.68656745  0.77649027  0.30934267  1
  Li  Li2  1  0.18656745  0.27649027  0.19065733  1
  Li  Li3  1  0.31343255  0.22350973  0.69065733  1
  Li  Li4  1  0.79807047  0.87154954  0.97955360  1
  Li  Li5  1  0.70192953  0.62845046  0.47955360  1
  Li  Li6  1  0.20192953  0.12845046  0.02044640  1
  Li  Li7  1  0.29807047  0.37154954  0.52044640  1
  Li  Li8  1  0.76560133  0.93848944  0.15635767  1
  Li  Li9  1  0.73439867  0.56151056  0.65635767  1
  Li  Li10  1  0.23439867  0.06151056  0.84364233  1
  Li  Li11  1  0.26560133  0.43848944  0.34364233  1
  P  P12  1  0.69581601  0.30649808  0.09965776  1
  P  P13  1  0.80418399  0.19350192  0.59965776  1
  P  P14  1  0.30418399  0.69350192  0.90034224  1
  P  P15  1  0.19581601  0.80649808  0.40034224  1
  P  P16  1  0.77629689  0.28070061  0.43647080  1
  P  P17  1  0.72370311  0.21929939  0.93647080  1
  P  P18  1  0.22370311  0.71929939  0.56352920  1
  P  P19  1  0.27629689  0.78070061  0.06352920  1
  P  P20  1  0.47966929  0.09194420  0.30893989  1
  P  P21  1  0.02033071  0.40805580  0.80893989  1
  P  P22  1  0.52033071  0.90805580  0.69106011  1
  P  P23  1  0.97966929  0.59194420  0.19106011  1
  O  O24  1  0.05055225  0.35741710  0.43333943  1
  O  O25  1  0.44944775  0.14258290  0.93333943  1
  O  O26  1  0.94944775  0.64258290  0.56666057  1
  O  O27  1  0.55055225  0.85741710  0.06666057  1
  O  O28  1  0.13163533  0.80573606  0.86726251  1
  O  O29  1  0.36836467  0.69426394  0.36726251  1
  O  O30  1  0.86836467  0.19426394  0.13273749  1
  O  O31  1  0.63163533  0.30573606  0.63273749  1
  O  O32  1  0.08557584  0.24754092  0.60369638  1
  O  O33  1  0.41442416  0.25245908  0.10369638  1
  O  O34  1  0.91442416  0.75245908  0.39630362  1
  O  O35  1  0.58557584  0.74754092  0.89630362  1
  O  O36  1  0.27259175  0.84844077  0.49064859  1
  O  O37  1  0.22740825  0.65155923  0.99064859  1
  O  O38  1  0.72740825  0.15155923  0.50935141  1
  O  O39  1  0.77259175  0.34844077  0.00935141  1
  O  O40  1  0.21751447  0.64782352  0.13336489  1
  O  O41  1  0.28248553  0.85217648  0.63336489  1
  O  O42  1  0.78248553  0.35217648  0.86663511  1
  O  O43  1  0.71751447  0.14782352  0.36663511  1
  O  O44  1  0.06350567  0.46836719  0.24634995  1
  O  O45  1  0.43649433  0.03163281  0.74634995  1
  O  O46  1  0.93649433  0.53163281  0.75365005  1
  O  O47  1  0.56350567  0.96836719  0.25365005  1
  O  O48  1  0.08283885  0.89653663  0.05998181  1
  O  O49  1  0.41716115  0.60346337  0.55998181  1
  O  O50  1  0.91716115  0.10346337  0.94001819  1
  O  O51  1  0.58283885  0.39653663  0.44001819  1
  O  O52  1  0.11844155  0.25483824  0.78127252  1
  O  O53  1  0.38155845  0.24516176  0.28127252  1
  O  O54  1  0.88155845  0.74516176  0.21872748  1
  O  O55  1  0.61844155  0.75483824  0.71872748  1
  O  O56  1  0.26337097  0.99463084  0.36634040  1
  O  O57  1  0.23662903  0.50536916  0.86634040  1
  O  O58  1  0.73662903  0.00536916  0.63365960  1
  O  O59  1  0.76337097  0.49463084  0.13365960  1
