IFLAB-ZINC02458709 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 0 0 0 0 0 0999 V2000 -0.4900 1.3740 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3630 -0.1210 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -0.8430 1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 -2.2320 1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 -2.8990 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -2.1920 -1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -0.8040 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -4.6640 0.0090 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -5.0490 -1.1770 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -5.0360 1.3270 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -5.2030 -0.1130 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 -4.7750 -1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9680 -5.1240 -2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7730 -4.6550 -3.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8600 -3.8800 -3.3430 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1940 -3.5380 -2.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4240 -3.9790 -0.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4210 -2.6620 -1.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6650 -2.3910 -0.5620 O 0 5 0 0 0 0 0 0 0 0 0 0 0.4810 1.8320 0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8480 1.7350 -0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2100 1.7070 0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 -0.3250 2.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 -2.7750 2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -2.7040 -2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 -0.2560 -2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9830 -5.2720 0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 -5.7510 -2.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5620 -4.8960 -4.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6980 -3.6900 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1140 -2.2650 -2.7750 O 0 0 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 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 26 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 31 2 0 0 0 0 M CHG 1 19 -1 M END