NCID-ZINC05390285 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 1.2220 -0.2210 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -1.5390 0.7560 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -1.6710 2.3820 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3840 -3.0520 2.6970 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6590 -0.9030 2.6510 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -0.8640 3.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -1.5790 3.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0120 -0.9490 4.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9240 0.4030 4.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 1.1180 4.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 0.4810 3.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 2.5590 4.4830 N 0 3 0 0 0 0 0 0 0 0 0 0 0.3520 3.1600 4.2760 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6450 3.1440 4.9550 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.9780 1.0430 5.1650 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8970 0.8370 6.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9780 1.6680 7.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3550 1.2430 6.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3960 1.4220 5.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2740 0.5980 4.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2230 -1.7150 4.5750 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.7940 -2.3920 3.7390 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6490 -1.6670 5.7150 O 0 5 0 0 0 0 0 0 0 0 0 0 2.1990 0.2420 0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 -0.3330 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 0.4080 0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 -2.3340 0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 -2.6300 3.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 1.0350 3.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0490 -0.2180 6.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9150 1.1470 6.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9280 1.5030 8.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8190 2.7250 7.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5300 0.1960 7.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1250 1.8620 7.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3580 1.0800 4.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2590 2.4750 5.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2920 0.7340 3.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4190 -0.4560 4.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 3 4 2 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M CHG 1 21 1 M CHG 1 23 -1 M END