NIH-ZINC04195892 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 1 0 0 0 0 0999 V2000 -0.6010 1.9520 0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 0.2000 0.1940 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -0.1930 1.4990 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8750 -0.4110 0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9150 -1.9260 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3430 -2.4640 0.1010 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8130 -2.2160 1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2830 -4.0050 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6530 -4.3590 -1.2770 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1400 -1.9530 -1.0770 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7340 -1.4480 -0.7920 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.3840 -1.2710 -2.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3280 -2.2650 0.2440 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4590 0.1740 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1630 1.2250 -1.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9220 2.4960 -0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9880 2.7100 0.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3040 1.6590 1.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5460 0.3850 1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 2.5390 0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1620 2.2500 -0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 2.1220 1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3420 -0.1100 1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 0.0810 -0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 -2.2020 -0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3070 -2.3990 0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1310 -2.7430 -1.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1050 1.0580 -2.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6810 3.3180 -1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7960 3.7010 1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3590 1.8340 2.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7860 -0.4300 1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8830 -4.6850 0.8720 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 17 18 2 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 19 32 1 0 0 0 0 M CHG 1 33 -1 M END