# generated using pymatgen
data_Li3V5(H8O11)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.39430548
_cell_length_b   10.50242039
_cell_length_c   17.85584896
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3V5(H8O11)2
_chemical_formula_sum   'Li12 V20 H64 O88'
_cell_volume   1761.71065142
_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  -0.00000000  0.59700210  0.76605897  1
  Li  Li1  1  -0.00000000  0.40299790  0.23394103  1
  Li  Li2  1  0.50000000  0.90299790  0.26605897  1
  Li  Li3  1  0.50000000  0.09700210  0.73394103  1
  Li  Li4  1  -0.00000000  0.27889969  0.69646572  1
  Li  Li5  1  -0.00000000  0.72110031  0.30353428  1
  Li  Li6  1  0.50000000  0.22110031  0.19646572  1
  Li  Li7  1  0.50000000  0.77889969  0.80353428  1
  Li  Li8  1  -0.00000000  0.10528906  0.56452716  1
  Li  Li9  1  -0.00000000  0.89471094  0.43547284  1
  Li  Li10  1  0.50000000  0.39471094  0.06452716  1
  Li  Li11  1  0.50000000  0.60528906  0.93547284  1
  V  V12  1  0.83400460  0.16190963  0.85339238  1
  V  V13  1  0.83400460  0.83809037  0.14660762  1
  V  V14  1  0.66599540  0.33809037  0.35339238  1
  V  V15  1  0.66599540  0.66190963  0.64660762  1
  V  V16  1  0.16599540  0.83809037  0.14660762  1
  V  V17  1  0.16599540  0.16190963  0.85339238  1
  V  V18  1  0.33400460  0.66190963  0.64660762  1
  V  V19  1  0.33400460  0.33809037  0.35339238  1
  V  V20  1  -0.00000000  0.90168360  0.85802944  1
  V  V21  1  -0.00000000  0.09831640  0.14197056  1
  V  V22  1  0.50000000  0.59831640  0.35802944  1
  V  V23  1  0.50000000  0.40168360  0.64197056  1
  V  V24  1  0.82423627  0.00000000  0.00000000  1
  V  V25  1  0.67576373  0.50000000  0.50000000  1
  V  V26  1  0.17576373  0.00000000  -0.00000000  1
  V  V27  1  0.32423627  0.50000000  0.50000000  1
  V  V28  1  -0.00000000  0.73600382  0.00502526  1
  V  V29  1  -0.00000000  0.26399618  0.99497474  1
  V  V30  1  0.50000000  0.76399618  0.50502526  1
  V  V31  1  0.50000000  0.23600382  0.49497474  1
  H  H32  1  0.84045512  0.44174844  0.84655892  1
  H  H33  1  0.84045512  0.55825156  0.15344108  1
  H  H34  1  0.65954488  0.05825156  0.34655892  1
  H  H35  1  0.65954488  0.94174844  0.65344108  1
  H  H36  1  0.15954488  0.55825156  0.15344108  1
  H  H37  1  0.15954488  0.44174844  0.84655892  1
  H  H38  1  0.34045512  0.94174844  0.65344108  1
  H  H39  1  0.34045512  0.05825156  0.34655892  1
  H  H40  1  0.76337979  0.47769575  0.77008264  1
  H  H41  1  0.76337979  0.52230425  0.22991736  1
  H  H42  1  0.73662021  0.02230425  0.27008264  1
  H  H43  1  0.73662021  0.97769575  0.72991736  1
  H  H44  1  0.23662021  0.52230425  0.22991736  1
  H  H45  1  0.23662021  0.47769575  0.77008264  1
  H  H46  1  0.26337979  0.97769575  0.72991736  1
  H  H47  1  0.26337979  0.02230425  0.27008264  1
  H  H48  1  0.91718212  0.49470353  0.63704432  1
  H  H49  1  0.91718212  0.50529647  0.36295568  1
  H  H50  1  0.58281788  0.00529647  0.13704432  1
  H  H51  1  0.58281788  0.99470353  0.86295568  1
  H  H52  1  0.08281788  0.50529647  0.36295568  1
  H  H53  1  0.08281788  0.49470353  0.63704432  1
  H  H54  1  0.41718212  0.99470353  0.86295568  1
  H  H55  1  0.41718212  0.00529647  0.13704432  1
  H  H56  1  0.78321615  0.13833364  0.65407510  1
  H  H57  1  0.78321615  0.86166636  0.34592490  1
  H  H58  1  0.71678385  0.36166636  0.15407510  1
  H  H59  1  0.71678385  0.63833364  0.84592490  1
  H  H60  1  0.21678385  0.86166636  0.34592490  1
  H  H61  1  0.21678385  0.13833364  0.65407510  1
  H  H62  1  0.28321615  0.63833364  0.84592490  1
  H  H63  1  0.28321615  0.36166636  0.15407510  1
  H  H64  1  0.77698295  0.26418305  0.60702673  1
  H  H65  1  0.77698295  0.73581695  0.39297327  1
  H  H66  1  0.72301705  0.23581695  0.10702673  1
  H  H67  1  0.72301705  0.76418305  0.89297327  1
  H  H68  1  0.22301705  0.73581695  0.39297327  1
  H  H69  1  0.22301705  0.26418305  0.60702673  1
  H  H70  1  0.27698295  0.76418305  0.89297327  1
  H  H71  1  0.27698295  0.23581695  0.10702673  1
  H  H72  1  0.91740981  0.29680683  0.46465531  1
  H  H73  1  0.91740981  0.70319317  0.53534469  1
  H  H74  1  0.58259019  0.20319317  0.96465531  1
  H  H75  1  0.58259019  0.79680683  0.03534469  1
  H  H76  1  0.08259019  0.70319317  0.53534469  1
  H  H77  1  0.08259019  0.29680683  0.46465531  1
  H  H78  1  0.41740981  0.79680683  0.03534469  1
  H  H79  1  0.41740981  0.20319317  0.96465531  1
  H  H80  1  -0.00000000  0.94270817  0.69356953  1
  H  H81  1  -0.00000000  0.05729183  0.30643047  1
  H  H82  1  0.50000000  0.55729183  0.19356953  1
  H  H83  1  0.50000000  0.44270817  0.80643047  1
  H  H84  1  -0.00000000  0.87509883  0.61460007  1
  H  H85  1  -0.00000000  0.12490117  0.38539993  1
  H  H86  1  0.50000000  0.62490117  0.11460007  1
  H  H87  1  0.50000000  0.37509883  0.88539993  1
  H  H88  1  0.77280692  0.06007913  0.47432655  1
  H  H89  1  0.77280692  0.93992087  0.52567345  1
  H  H90  1  0.72719308  0.43992087  0.97432655  1
  H  H91  1  0.72719308  0.56007913  0.02567345  1
  H  H92  1  0.22719308  0.93992087  0.52567345  1
  H  H93  1  0.22719308  0.06007913  0.47432655  1
  H  H94  1  0.27280692  0.56007913  0.02567345  1
  H  H95  1  0.27280692  0.43992087  0.97432655  1
  O  O96  1  -0.00000000  0.21276305  0.80387489  1
  O  O97  1  -0.00000000  0.78723695  0.19612511  1
  O  O98  1  0.50000000  0.28723695  0.30387489  1
  O  O99  1  0.50000000  0.71276305  0.69612511  1
  O  O100  1  0.85524445  0.29164291  0.92629733  1
  O  O101  1  0.85524445  0.70835709  0.07370267  1
  O  O102  1  0.64475555  0.20835709  0.42629733  1
  O  O103  1  0.64475555  0.79164291  0.57370267  1
  O  O104  1  0.14475555  0.70835709  0.07370267  1
  O  O105  1  0.14475555  0.29164291  0.92629733  1
  O  O106  1  0.35524445  0.79164291  0.57370267  1
  O  O107  1  0.35524445  0.20835709  0.42629733  1
  O  O108  1  0.70458403  0.21554760  0.80207595  1
  O  O109  1  0.70458403  0.78445240  0.19792405  1
  O  O110  1  0.79541597  0.28445240  0.30207595  1
  O  O111  1  0.79541597  0.71554760  0.69792405  1
  O  O112  1  0.29541597  0.78445240  0.19792405  1
  O  O113  1  0.29541597  0.21554760  0.80207595  1
  O  O114  1  0.20458403  0.71554760  0.69792405  1
  O  O115  1  0.20458403  0.28445240  0.30207595  1
  O  O116  1  0.85495188  0.99331099  0.81510950  1
  O  O117  1  0.85495188  0.00668901  0.18489050  1
  O  O118  1  0.64504812  0.50668901  0.31510950  1
  O  O119  1  0.64504812  0.49331099  0.68489050  1
  O  O120  1  0.14504812  0.00668901  0.18489050  1
  O  O121  1  0.14504812  0.99331099  0.81510950  1
  O  O122  1  0.35495188  0.49331099  0.68489050  1
  O  O123  1  0.35495188  0.50668901  0.31510950  1
  O  O124  1  -0.00000000  0.06768889  0.93707513  1
  O  O125  1  -0.00000000  0.93231111  0.06292487  1
  O  O126  1  0.50000000  0.43231111  0.43707513  1
  O  O127  1  0.50000000  0.56768889  0.56292487  1
  O  O128  1  -0.00000000  0.76787155  0.81164067  1
  O  O129  1  -0.00000000  0.23212845  0.18835933  1
  O  O130  1  0.50000000  0.73212845  0.31164067  1
  O  O131  1  0.50000000  0.26787155  0.68835933  1
  O  O132  1  0.86586216  0.84938969  0.94360542  1
  O  O133  1  0.86586216  0.15061031  0.05639458  1
  O  O134  1  0.63413784  0.65061031  0.44360542  1
  O  O135  1  0.63413784  0.34938969  0.55639458  1
  O  O136  1  0.13413784  0.15061031  0.05639458  1
  O  O137  1  0.13413784  0.84938969  0.94360542  1
  O  O138  1  0.36586216  0.34938969  0.55639458  1
  O  O139  1  0.36586216  0.65061031  0.44360542  1
  O  O140  1  0.71333766  0.92821733  0.06622649  1
  O  O141  1  0.71333766  0.07178267  0.93377351  1
  O  O142  1  0.78666234  0.57178267  0.56622649  1
  O  O143  1  0.78666234  0.42821733  0.43377351  1
  O  O144  1  0.28666234  0.07178267  0.93377351  1
  O  O145  1  0.28666234  0.92821733  0.06622649  1
  O  O146  1  0.21333766  0.42821733  0.43377351  1
  O  O147  1  0.21333766  0.57178267  0.56622649  1
  O  O148  1  -0.00000000  0.61051394  0.95197870  1
  O  O149  1  -0.00000000  0.38948606  0.04802130  1
  O  O150  1  0.50000000  0.88948606  0.45197870  1
  O  O151  1  0.50000000  0.11051394  0.54802130  1
  O  O152  1  0.82807266  0.50976267  0.80950287  1
  O  O153  1  0.82807266  0.49023733  0.19049713  1
  O  O154  1  0.67192734  0.99023733  0.30950287  1
  O  O155  1  0.67192734  0.00976267  0.69049713  1
  O  O156  1  0.17192734  0.49023733  0.19049713  1
  O  O157  1  0.17192734  0.50976267  0.80950287  1
  O  O158  1  0.32807266  0.00976267  0.69049713  1
  O  O159  1  0.32807266  0.99023733  0.30950287  1
  O  O160  1  -0.00000000  0.47047374  0.66793167  1
  O  O161  1  -0.00000000  0.52952626  0.33206833  1
  O  O162  1  0.50000000  0.02952626  0.16793167  1
  O  O163  1  0.50000000  0.97047374  0.83206833  1
  O  O164  1  0.84403935  0.20758529  0.63371840  1
  O  O165  1  0.84403935  0.79241471  0.36628160  1
  O  O166  1  0.65596065  0.29241471  0.13371840  1
  O  O167  1  0.65596065  0.70758529  0.86628160  1
  O  O168  1  0.15596065  0.79241471  0.36628160  1
  O  O169  1  0.15596065  0.20758529  0.63371840  1
  O  O170  1  0.34403935  0.70758529  0.86628160  1
  O  O171  1  0.34403935  0.29241471  0.13371840  1
  O  O172  1  -0.00000000  0.24052054  0.47232306  1
  O  O173  1  -0.00000000  0.75947946  0.52767694  1
  O  O174  1  0.50000000  0.25947946  0.97232306  1
  O  O175  1  0.50000000  0.74052054  0.02767694  1
  O  O176  1  -0.00000000  0.95839487  0.63974258  1
  O  O177  1  -0.00000000  0.04160513  0.36025742  1
  O  O178  1  0.50000000  0.54160513  0.13974258  1
  O  O179  1  0.50000000  0.45839487  0.86025742  1
  O  O180  1  0.83617401  0.00000000  0.50000000  1
  O  O181  1  0.66382599  0.50000000  0.00000000  1
  O  O182  1  0.16382599  0.00000000  0.50000000  1
  O  O183  1  0.33617401  0.50000000  -0.00000000  1
