40

C         -4.28700       -0.67540        3.92580
C         -5.20920        0.02000        3.16620
C         -4.87450        0.45020        1.89590
C         -3.61760        0.18500        1.38510
C         -2.69730       -0.51490        2.14270
C         -3.03020       -0.94060        3.41500
S         -3.19110        0.73300       -0.23430
O         -4.41150        0.88410       -0.94650
O         -2.14460       -0.11480       -0.68740
C         -2.49910        2.34530       -0.07340
C         -1.17500        2.70200       -0.07640
O         -1.14370        4.03950        0.06950
N         -2.25520        4.50540        0.16090
C         -3.18070        3.57740        0.09230
C         -4.64780        3.77830        0.16660
O         -5.39630        2.82450        0.08840
C         -5.19900        5.13710        0.33560
C         -4.34060        6.23590        0.43160
C         -4.86230        7.50290        0.58310
C         -6.23350        7.68700        0.65220
C         -7.08970        6.60170        0.56390
C         -6.58150        5.33000        0.40600
Br        -6.93970        9.42790        0.86740
C         -0.02000        1.80310       -0.21740
C          1.07460        1.65290        0.61440
C          2.04160        0.73970        0.26480
C          1.89350        0.01890       -0.87760
S          0.33920        0.62630       -1.51120
H         -4.54870       -1.01180        4.91810
H         -6.19130        0.22690        3.56510
H         -5.59510        0.99320        1.30230
H         -1.71680       -0.72590        1.74190
H         -2.30990       -1.48420        4.00830
H         -3.27120        6.09310        0.38280
H         -4.20030        8.35340        0.65230
H         -8.15780        6.75220        0.61840
H         -7.25020        4.48470        0.33660
H          1.16790        2.23900        1.51670
H          2.90940        0.59670        0.89170
H          2.54920       -0.73060       -1.29570