31

C          5.52550        3.68950        2.85930
S          3.91920        2.87190        3.06510
C          3.23170        2.82670        1.38700
C          1.85840        2.15290        1.41650
C          1.27850        2.11470        0.00120
H          1.98720        1.62790       -0.66880
C         -0.01620        1.34360        0.00940
O         -1.07460        1.93560        0.01770
N          0.00210       -0.00410        0.00200
C         -1.25650       -0.75380        0.01000
H         -2.00510       -0.21330       -0.56940
C         -1.03160       -2.13460       -0.60920
O         -0.13850       -2.88650        0.21490
C         -1.73800       -0.91200        1.42920
O         -1.09560       -0.44640        2.34050
H          6.14490        3.10700        2.17730
H          5.37490        4.68850        2.45020
H          6.02170        3.76410        3.82690
H          3.89940        2.26240        0.73590
H          3.12940        3.84380        1.00880
H          1.19080        2.71720        2.06760
H          1.96070        1.13580        1.79480
H          0.84860       -0.47760       -0.00860
H         -1.98440       -2.65860       -0.68470
H         -0.59970       -2.02100       -1.60350
H          0.04990       -3.77480       -0.11760
H          0.37430        3.95890        0.14230
H          1.89090        4.00470       -0.53870
O         -2.88030       -1.57030        1.68100
N          1.01870        3.48110       -0.48550
H          0.59980        3.43200       -1.42170