42

S            5.336601   1.930606   0.253688
S           -3.725455  -3.803841   1.607936
O            2.221232  -1.646324  -1.083097
O            2.596844   2.701541   2.145470
O            5.071734   3.292391  -0.254119
O            5.813807   0.957749  -0.753421
O            6.052876   1.890124   1.547299
O            0.176944  -1.639863   2.061125
O            1.878671  -1.426675  -3.326308
O           -3.042933   0.783868  -0.266577
O           -4.591552   3.337640  -2.247789
O           -5.324062   1.296475  -1.579932
N            3.737036   1.291374   0.607012
N            0.688246   0.319247   1.018973
N           -1.795051   0.610157   0.255157
N            1.320117  -3.351784  -2.206684
N           -3.910926  -1.208091   1.492318
N           -5.939015  -2.257798   2.103699
C            3.190715  -0.064976   0.378870
C            2.064097   0.309203   1.413368
C            2.775020   1.679939   1.514772
C            2.777432  -0.319730  -1.057985
C           -0.173527  -0.670522   1.388033
C           -1.601622  -0.490071   0.909002
C            1.798428  -2.082756  -2.298962
C           -2.591197  -1.542347   1.211653
C           -2.298727  -2.879020   1.234091
C           -4.623207  -2.273498   1.720572
C           -3.120027   2.055161  -0.955418
C           -4.492230   2.229809  -1.659000
H            3.853706  -0.860437   0.731574
H            2.163126  -0.272788   2.332366
H            3.647825  -0.259426  -1.715220
H            2.032694   0.406565  -1.396157
H            0.306282   1.075778   0.465537
H            0.803064  -3.703381  -2.997279
H            1.102737  -3.732290  -1.298076
H           -1.349177  -3.360143   1.065748
H           -2.970277   2.864671  -0.232124
H           -2.315019   2.109507  -1.696832
H           -6.492655  -3.075163   1.886564
H           -6.412174  -1.386077   1.900453
