40

C          3.84040        2.33560       -1.78340
C          2.53350        1.66810       -1.35080
S          1.26450        2.93380       -1.09790
C         -0.09210        1.91580       -0.62050
S          0.10300        0.21750       -0.52800
N         -1.28500        2.47370       -0.33340
C         -1.44680        3.93470       -0.24920
C         -2.40070        4.36060       -1.37140
C         -3.62230        3.47980       -1.39890
C         -4.75070        3.96690       -2.04890
C         -5.90290        3.20750       -2.12350
C         -5.93350        1.94300       -1.54230
C         -4.81100        1.46330       -0.89320
C         -3.65660        2.23190       -0.81800
C         -2.47300        1.64970       -0.08640
C         -2.21720        0.22560       -0.58410
C         -2.76370        1.61950        1.39190
O         -3.90670        1.58790        1.78230
O         -7.06000        1.18430       -1.61290
C         -7.01540       -0.10240       -0.99280
O         -7.00150        3.69330       -2.76120
H          3.67970        2.88000       -2.71390
H          4.16810        3.02900       -1.00880
H          4.60460        1.57340       -1.93560
H          2.69420        1.12380       -0.42020
H          2.20580        0.97480       -2.12540
H         -1.86890        4.20380        0.71910
H         -0.47990        4.42100       -0.37890
H         -1.88540        4.28890       -2.32920
H         -2.70710        5.39350       -1.20570
H         -4.72660        4.94820       -2.49950
H         -4.83200        0.48270       -0.44100
H         -1.64060       -0.32170        0.16160
H         -3.16960       -0.27830       -0.74860
H         -1.65920        0.26240       -1.51970
H         -6.22980       -0.70090       -1.45400
H         -6.80670        0.01380        0.07070
H         -7.97580       -0.60150       -1.12220
H         -7.03620        3.47890       -3.70350
O         -1.75290        1.62780        2.27500