47

C          3.66740        1.61630        0.76010
C          2.48750        1.11790       -0.03400
C          2.58310       -0.00180       -0.79730
C          1.46490       -0.44770       -1.53150
O          1.56430       -1.45310       -2.21180
O          0.29390        0.20760       -1.50030
C          0.13170        1.32650       -0.76180
C          1.20700        1.82770       -0.00410
C          1.04400        2.98700        0.76280
C         -0.16140        3.62660        0.77790
C         -1.22890        3.13870        0.02470
C         -1.08450        1.99090       -0.74040
N         -2.45350        3.80700        0.04590
C         -3.60320        3.11010       -0.04820
O         -3.57860        1.89760       -0.05470
C         -4.91950        3.83750       -0.14530
H         -4.80720        4.70690       -0.79310
C         -5.35440        4.29320        1.24900
S         -6.93880        5.16880        1.13210
C         -7.30930        5.63630        2.84520
C         -8.61850        6.38130        2.89070
C         -8.63550        7.75740        2.76120
C         -9.83690        8.44030        2.79760
C        -11.02020        7.74800        2.97460
C        -11.00270        6.37240        3.10980
C         -9.80180        5.68900        3.06770
H          3.65410        1.16550        1.75240
H          4.59070        1.34300        0.24920
H          3.61090        2.70090        0.85290
H          3.51300       -0.54930       -0.84130
H          1.86850        3.37180        1.34460
H         -0.28810        4.51860        1.37340
H         -1.91680        1.61630       -1.31780
H         -2.47740        4.77320        0.12820
H         -5.46670        3.42380        1.89680
H         -4.60000        4.96110        1.66470
H         -7.38040        4.73870        3.45950
H         -6.51380        6.27600        3.22740
H         -7.71060        8.29870        2.62740
H         -9.85060        9.51490        2.69160
H        -11.95850        8.28180        3.00680
H        -11.92720        5.83150        3.24810
H         -9.78810        4.61430        3.17340
H         -5.70390        2.67340       -1.65130
H         -6.05890        2.12300       -0.12270
N         -5.95640        2.95260       -0.70480
H         -6.85110        3.45580       -0.73140