IBS-ZINC02090535 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 1 0 0 0 0 0999 V2000 -0.1790 1.2410 -0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -0.2250 -0.1880 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4840 -0.7620 -0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -0.3600 1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -1.7450 1.5330 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0960 -2.2670 0.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2910 -2.7150 1.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3760 -3.3220 0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4350 -2.5390 0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4220 -3.1050 -0.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3570 -4.4550 -0.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3020 -5.2400 -0.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3140 -4.6760 0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 -2.8740 1.9640 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 -4.1020 2.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8670 -2.2410 3.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0170 -2.9090 0.7410 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.4190 -0.7440 -0.2150 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3550 -1.6980 0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 1.7010 -0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 1.3380 -1.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 1.8080 0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 0.2930 1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 -0.0250 1.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 -3.0840 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4300 -1.4890 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6940 -1.8590 2.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9920 -3.4410 2.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4980 -1.4850 0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2380 -2.4890 -1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1250 -4.8950 -1.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2420 -6.2900 -0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4920 -5.2960 0.6280 H 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 4 1 0 0 0 0 2 18 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 14 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 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 2 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 18 19 1 0 0 0 0 M CHG 1 17 -1 M END