IBS-ZINC02198285 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 32 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.5920 0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1180 3.9410 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 4.1100 -1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0620 4.6980 -1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7570 4.8750 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0620 4.6740 1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8430 4.0820 1.1990 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4450 4.0530 2.5360 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 4.6050 3.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3880 4.9790 2.3990 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6250 5.1310 -2.3680 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 3.9740 -2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 3.8670 -3.4870 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -2.1590 -0.0200 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1820 -2.7820 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 -2.7540 -0.0340 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3380 -0.4990 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6930 5.1280 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 4.7370 4.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1490 5.0140 -3.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4980 5.5540 -2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 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 2 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 17 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 16 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 18 19 3 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END