# generated using pymatgen
data_Li2Ge(S2O7)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   14.80642442
_cell_length_b   14.80634255
_cell_length_c   15.64021063
_cell_angle_alpha   61.74852295
_cell_angle_beta   61.74840307
_cell_angle_gamma   59.99996056
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Ge(S2O7)3
_chemical_formula_sum   'Li12 Ge6 S36 O126'
_cell_volume   2486.62947547
_cell_formula_units_Z   6
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  0.64537738  0.31245537  0.02952307  1
  Li  Li1  1  0.01265532  0.64537734  0.02952544  1
  Li  Li2  1  0.31244803  0.01265132  0.02952348  1
  Li  Li3  1  0.35462262  0.68754463  0.97047693  1
  Li  Li4  1  0.98734468  0.35462266  0.97047456  1
  Li  Li5  1  0.68755197  0.98734868  0.97047652  1
  Li  Li6  1  0.84830201  0.16925483  0.53409161  1
  Li  Li7  1  0.44835800  0.84829843  0.53409318  1
  Li  Li8  1  0.16925329  0.44835176  0.53409185  1
  Li  Li9  1  0.15169799  0.83074517  0.46590839  1
  Li  Li10  1  0.55164200  0.15170157  0.46590682  1
  Li  Li11  1  0.83074671  0.55164824  0.46590815  1
  Ge  Ge12  1  0.91695980  0.91696264  0.24909688  1
  Ge  Ge13  1  0.08304020  0.08303736  0.75090312  1
  Ge  Ge14  1  0.25611155  0.25610472  0.23166033  1
  Ge  Ge15  1  0.74388845  0.74389528  0.76833967  1
  Ge  Ge16  1  0.57875058  0.57875146  0.26376943  1
  Ge  Ge17  1  0.42124942  0.42124854  0.73623057  1
  S  S18  1  0.84595577  0.84270070  0.13467373  1
  S  S19  1  0.17666490  0.84595730  0.13467254  1
  S  S20  1  0.84270812  0.17666717  0.13466945  1
  S  S21  1  0.15404423  0.15729930  0.86532627  1
  S  S22  1  0.82333510  0.15404270  0.86532746  1
  S  S23  1  0.15729188  0.82333283  0.86533055  1
  S  S24  1  0.42309152  0.11845477  0.35935101  1
  S  S25  1  0.09909226  0.42308703  0.35935338  1
  S  S26  1  0.11846207  0.09909586  0.35935020  1
  S  S27  1  0.57690848  0.88154523  0.64064899  1
  S  S28  1  0.90090774  0.57691297  0.64064662  1
  S  S29  1  0.88153793  0.90090414  0.64064980  1
  S  S30  1  0.50503844  0.13712626  0.14648509  1
  S  S31  1  0.21133976  0.50503877  0.14648880  1
  S  S32  1  0.13712979  0.21133449  0.14648764  1
  S  S33  1  0.49496156  0.86287374  0.85351491  1
  S  S34  1  0.78866024  0.49496123  0.85351120  1
  S  S35  1  0.86287021  0.78866551  0.85351236  1
  S  S36  1  0.73097839  0.82555150  0.34732015  1
  S  S37  1  0.09615325  0.73096978  0.34731663  1
  S  S38  1  0.82555506  0.09615153  0.34731565  1
  S  S39  1  0.26902161  0.17444850  0.65267985  1
  S  S40  1  0.90384675  0.26903022  0.65268337  1
  S  S41  1  0.17444494  0.90384847  0.65268435  1
  S  S42  1  0.50232206  0.52301487  0.14126568  1
  S  S43  1  0.83340254  0.50233150  0.14125689  1
  S  S44  1  0.52301562  0.83339626  0.14125921  1
  S  S45  1  0.49767794  0.47698513  0.85873432  1
  S  S46  1  0.16659746  0.49766850  0.85874311  1
  S  S47  1  0.47698438  0.16660374  0.85874079  1
  S  S48  1  0.76524483  0.42886775  0.36079186  1
  S  S49  1  0.44509872  0.76524535  0.36079210  1
  S  S50  1  0.42887063  0.44510205  0.36079129  1
  S  S51  1  0.23475517  0.57113225  0.63920814  1
  S  S52  1  0.55490128  0.23475465  0.63920790  1
  S  S53  1  0.57112937  0.55489795  0.63920871  1
  O  O54  1  0.92505315  0.85358537  0.16252801  1
  O  O55  1  0.05882985  0.92505817  0.16252694  1
  O  O56  1  0.85358993  0.05883147  0.16252287  1
  O  O57  1  0.07494685  0.14641463  0.83747199  1
  O  O58  1  0.94117015  0.07494183  0.83747306  1
  O  O59  1  0.14641007  0.94116853  0.83747713  1
  O  O60  1  0.77851513  0.90268947  0.33639257  1
  O  O61  1  0.98240424  0.77851751  0.33638853  1
  O  O62  1  0.90268765  0.98240391  0.33639083  1
  O  O63  1  0.22148487  0.09731053  0.66360743  1
  O  O64  1  0.01759576  0.22148249  0.66361147  1
  O  O65  1  0.09731235  0.01759609  0.66360917  1
  O  O66  1  0.49309614  0.06172779  0.26659077  1
  O  O67  1  0.17858329  0.49308929  0.26659587  1
  O  O68  1  0.06172846  0.17858382  0.26659094  1
  O  O69  1  0.50690386  0.93827221  0.73340923  1
  O  O70  1  0.82141671  0.50691071  0.73340413  1
  O  O71  1  0.93827154  0.82141618  0.73340906  1
  O  O72  1  0.72984423  0.86391157  0.23029621  1
  O  O73  1  0.17594685  0.72984677  0.23028754  1
  O  O74  1  0.86391321  0.17594941  0.23029374  1
  O  O75  1  0.27015577  0.13608843  0.76970379  1
  O  O76  1  0.82405315  0.27015323  0.76971246  1
  O  O77  1  0.13608679  0.82405059  0.76970626  1
  O  O78  1  0.33586246  0.22272340  0.31704938  1
  O  O79  1  0.12435977  0.33585878  0.31705065  1
  O  O80  1  0.22272499  0.12436422  0.31705142  1
  O  O81  1  0.66413754  0.77727660  0.68295062  1
  O  O82  1  0.87564023  0.66414122  0.68294935  1
  O  O83  1  0.77727501  0.87563578  0.68294858  1
  O  O84  1  0.81424380  0.93077246  0.04877433  1
  O  O85  1  0.20620388  0.81425219  0.04876634  1
  O  O86  1  0.93077888  0.20619645  0.04876994  1
  O  O87  1  0.18575620  0.06922754  0.95122567  1
  O  O88  1  0.79379612  0.18574781  0.95123366  1
  O  O89  1  0.06922112  0.79380355  0.95123006  1
  O  O90  1  0.80065548  0.71260358  0.37213699  1
  O  O91  1  0.11461116  0.80065341  0.37213292  1
  O  O92  1  0.71259924  0.11460581  0.37213705  1
  O  O93  1  0.19934452  0.28739642  0.62786301  1
  O  O94  1  0.88538884  0.19934659  0.62786708  1
  O  O95  1  0.28740076  0.88539419  0.62786295  1
  O  O96  1  0.38028742  0.03752353  0.44352895  1
  O  O97  1  0.13864943  0.38028265  0.44353353  1
  O  O98  1  0.03752248  0.13865444  0.44353113  1
  O  O99  1  0.61971258  0.96247647  0.55647105  1
  O  O100  1  0.86135057  0.61971735  0.55646647  1
  O  O101  1  0.96247752  0.86134556  0.55646887  1
  O  O102  1  0.88447646  0.73188370  0.13647283  1
  O  O103  1  0.24716060  0.88447755  0.13647709  1
  O  O104  1  0.73188726  0.24716477  0.13647190  1
  O  O105  1  0.11552354  0.26811630  0.86352717  1
  O  O106  1  0.75283940  0.11552245  0.86352291  1
  O  O107  1  0.26811274  0.75283523  0.86352810  1
  O  O108  1  0.57215863  0.05783743  0.09320276  1
  O  O109  1  0.27679365  0.57216296  0.09320690  1
  O  O110  1  0.05783550  0.27678594  0.09320553  1
  O  O111  1  0.42784137  0.94216257  0.90679724  1
  O  O112  1  0.72320635  0.42783704  0.90679310  1
  O  O113  1  0.94216450  0.72321406  0.90679447  1
  O  O114  1  0.54067631  0.22152242  0.12523291  1
  O  O115  1  0.11255656  0.54068731  0.12524062  1
  O  O116  1  0.22152016  0.11255928  0.12523921  1
  O  O117  1  0.45932369  0.77847758  0.87476709  1
  O  O118  1  0.88744344  0.45931269  0.87475938  1
  O  O119  1  0.77847984  0.88744072  0.87476079  1
  O  O120  1  0.61755438  0.85793296  0.40561817  1
  O  O121  1  0.11889701  0.61755032  0.40560632  1
  O  O122  1  0.85793406  0.11889752  0.40561128  1
  O  O123  1  0.38244562  0.14206704  0.59438183  1
  O  O124  1  0.88110299  0.38244968  0.59439368  1
  O  O125  1  0.14206594  0.88110248  0.59438872  1
  O  O126  1  0.58917726  0.51557616  0.17361408  1
  O  O127  1  0.72163493  0.58918091  0.17360799  1
  O  O128  1  0.51558028  0.72163331  0.17361130  1
  O  O129  1  0.41082274  0.48442384  0.82638592  1
  O  O130  1  0.27836507  0.41081909  0.82639201  1
  O  O131  1  0.48441972  0.27836669  0.82638870  1
  O  O132  1  0.38759008  0.18149570  0.14443753  1
  O  O133  1  0.28646238  0.38759467  0.14443243  1
  O  O134  1  0.18149946  0.28646792  0.14443234  1
  O  O135  1  0.61240992  0.81850430  0.85556247  1
  O  O136  1  0.71353762  0.61240533  0.85556757  1
  O  O137  1  0.81850054  0.71353208  0.85556766  1
  O  O138  1  0.65503620  0.45094990  0.35449925  1
  O  O139  1  0.53951601  0.65503560  0.35450622  1
  O  O140  1  0.45094686  0.53951895  0.35449963  1
  O  O141  1  0.34496380  0.54905010  0.64550075  1
  O  O142  1  0.46048399  0.34496440  0.64549378  1
  O  O143  1  0.54905314  0.46048105  0.64550037  1
  O  O144  1  0.49520762  0.14989998  0.36747527  1
  O  O145  1  0.98741227  0.49520510  0.36747628  1
  O  O146  1  0.14990848  0.98741743  0.36747027  1
  O  O147  1  0.50479238  0.85010002  0.63252473  1
  O  O148  1  0.01258773  0.50479490  0.63252372  1
  O  O149  1  0.85009152  0.01258257  0.63252973  1
  O  O150  1  0.44569309  0.63220137  0.08736076  1
  O  O151  1  0.83474968  0.44569862  0.08735310  1
  O  O152  1  0.63219904  0.83475082  0.08735345  1
  O  O153  1  0.55430691  0.36779863  0.91263924  1
  O  O154  1  0.16525032  0.55430138  0.91264690  1
  O  O155  1  0.36780096  0.16524918  0.91264655  1
  O  O156  1  0.79788411  0.32376012  0.43336268  1
  O  O157  1  0.44500867  0.79788703  0.43336348  1
  O  O158  1  0.32375205  0.44499946  0.43336120  1
  O  O159  1  0.20211589  0.67623988  0.56663732  1
  O  O160  1  0.55499133  0.20211297  0.56663652  1
  O  O161  1  0.67624795  0.55500054  0.56663880  1
  O  O162  1  0.84989869  0.40720644  0.25129233  1
  O  O163  1  0.49161511  0.84989592  0.25129456  1
  O  O164  1  0.40720176  0.49160394  0.25129274  1
  O  O165  1  0.15010131  0.59279356  0.74870767  1
  O  O166  1  0.50838489  0.15010408  0.74870544  1
  O  O167  1  0.59279824  0.50839606  0.74870726  1
  O  O168  1  0.54619015  0.43688363  0.09914799  1
  O  O169  1  0.91778027  0.54618960  0.09914408  1
  O  O170  1  0.43688499  0.91777915  0.09914910  1
  O  O171  1  0.45380985  0.56311637  0.90085201  1
  O  O172  1  0.08221973  0.45381040  0.90085592  1
  O  O173  1  0.56311501  0.08222085  0.90085090  1
  O  O174  1  0.76924378  0.52106704  0.36546644  1
  O  O175  1  0.34423199  0.76924922  0.36547119  1
  O  O176  1  0.52106030  0.34423427  0.36546911  1
  O  O177  1  0.23075622  0.47893296  0.63453356  1
  O  O178  1  0.65576801  0.23075078  0.63452881  1
  O  O179  1  0.47893970  0.65576573  0.63453089  1
