IBS-ZINC02539628 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 26 0 0 1 0 0 0 0 0999 V2000 -0.1640 1.4980 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 -0.0300 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 -0.5550 1.3290 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0360 -1.4540 1.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8660 -1.0150 0.9290 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 -0.5500 -0.2870 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9510 0.4380 -0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 -0.6310 -1.3940 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4060 -1.7970 -0.1740 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1710 -2.6530 -0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7950 -1.9150 1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9550 -2.6110 2.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 0.4680 2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5490 1.1580 2.6650 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4810 -0.6390 -0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 1.9700 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 1.8000 -1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 1.9270 0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9200 -0.3200 -1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 -1.7340 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1670 -0.3270 0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8200 -1.3850 -0.2090 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1920 -1.2750 -1.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4390 -2.0410 0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 0.5160 3.0900 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 15 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 13 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 22 1 0 0 0 0 11 12 2 0 0 0 0 13 14 2 0 0 0 0 13 25 1 0 0 0 0 15 19 1 0 0 0 0 15 20 1 0 0 0 0 15 21 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 25 -1 M END