IBS-ZINC00064872 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 40 0 0 0 0 0 0 0 0999 V2000 -0.1710 1.4070 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 0.2260 0.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -0.4450 0.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 0.0590 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 1.2540 -0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 1.9220 -0.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5930 -0.6220 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8570 -0.0780 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9140 -1.0470 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3250 -0.9690 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0210 -2.1220 -0.1590 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3640 -3.2680 -0.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0430 -3.4460 -0.5050 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3780 -2.2950 -0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6860 -2.3080 -0.4240 S 0 0 0 0 0 0 0 0 0 0 0 0 7.9590 0.2540 0.2850 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3140 0.6310 0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6110 1.9290 0.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9280 2.3750 0.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9790 1.5270 0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7290 0.2230 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3890 -0.2070 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8770 -0.6930 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5860 -1.8630 -0.6200 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.1250 1.9270 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 -0.1750 1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 -1.3590 1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 1.6700 -1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 2.8430 -1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0160 0.9750 0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9810 -4.1500 -0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3180 1.0150 0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8110 2.6140 1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1340 3.3820 1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0050 1.8790 0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2110 -1.2180 -0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0530 -0.2240 -0.0900 O 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 21 2 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 2 0 0 0 0 M CHG 1 24 -1 M END