IBS-ZINC02337049 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 0 0 1 0 0 0 0 0999 V2000 -0.0890 1.1850 0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 -0.1500 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 -0.7000 -0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3410 0.1220 -0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 1.4610 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 1.9590 0.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7390 2.5280 -0.0700 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5820 2.1410 -1.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2110 3.8800 -0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5200 2.2510 1.4160 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2560 0.9250 1.6140 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5040 0.4530 0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4650 1.1620 2.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7500 1.5620 1.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9410 1.0460 0.6560 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2370 0.0690 2.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2850 0.7770 2.9150 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3700 -0.5730 -0.9960 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 -2.1040 -1.3080 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -1.9510 -0.9090 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9990 1.6460 0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 -0.7310 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 2.9860 0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8030 2.2160 2.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2340 1.9200 3.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7160 0.2430 3.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5100 2.3340 2.4510 O 0 5 0 0 0 0 0 0 0 0 0 0 4.4410 -1.1710 2.5050 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 20 2 0 0 0 0 4 5 1 0 0 0 0 4 18 2 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 6 23 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 14 15 2 0 0 0 0 14 27 1 0 0 0 0 16 17 2 0 0 0 0 16 28 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 M CHG 1 27 -1 M CHG 1 28 -1 M END