IBS-ZINC05363768 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 1 0 0 0 0 0999 V2000 0.1510 0.7690 1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 -0.5630 0.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -0.9940 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5100 -0.0400 -0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3670 1.3010 0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 1.7100 0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5760 1.9760 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4060 1.0270 -0.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7570 -0.1770 -0.6840 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1360 -1.0460 -1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8860 3.4270 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3130 3.7520 1.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5940 5.2420 1.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9160 5.6020 3.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1040 4.7670 3.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9840 6.9570 3.2840 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2170 7.6330 4.5720 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6060 7.1420 5.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6990 7.6890 4.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2800 6.1690 5.7870 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5430 5.3100 5.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8060 9.1270 4.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7480 9.5690 3.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 1.0820 1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 -1.2790 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 -2.0330 -0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 2.7450 1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4050 1.1090 -1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6810 3.7230 -0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0020 4.0190 -0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5290 3.4440 2.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2070 3.1720 1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4430 5.5420 1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7200 5.8250 1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8480 7.6180 2.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3220 7.8370 4.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9200 8.5110 5.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5720 9.7060 5.5690 O 0 5 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 22 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 21 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 M CHG 1 38 -1 M END