IFLAB-ZINC02457095 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 34 0 0 1 0 0 0 0 0999 V2000 -0.0140 1.5250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -0.0070 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3770 -0.4900 0.1630 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1780 0.0460 1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1100 1.5760 1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5920 3.4590 1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 3.8870 2.7270 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1110 3.5130 2.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0990 5.4140 2.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6980 5.9220 4.4530 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0790 5.6160 4.5950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 5.5660 5.4600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 3.3500 3.7360 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 -1.4000 -0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 -1.9090 -2.0480 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.1210 -1.9090 -0.4650 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 1.9010 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 1.8860 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 -0.3650 -0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 -0.3690 0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2140 -0.2780 1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7760 -0.3120 2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6060 1.9360 0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6070 1.9880 2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 3.9400 0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 3.7550 1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 5.7880 2.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7530 5.8240 2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 3.6410 3.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6620 -1.5690 0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4630 -2.6160 -1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 2.0000 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6530 7.4430 4.4180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9500 7.8640 5.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 14 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 4 22 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 33 1 0 0 0 0 13 29 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 33 34 1 0 0 0 0 M END