IBS-ZINC02416578 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 0 0 0 0 0 0999 V2000 1.0550 0.8290 -0.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3370 0.2280 0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 0.6690 1.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 -0.4000 2.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1220 -0.5810 3.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 -1.7690 3.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -2.7760 2.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4480 -2.6270 1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7890 -1.4320 1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 -1.0290 0.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 -1.5890 -0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4440 1.9590 2.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 2.0670 3.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 3.1410 1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 4.7540 1.9920 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 4.6330 2.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3890 4.4960 1.6240 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1630 4.6840 4.0770 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 4.3820 4.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1900 3.2540 5.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 3.9530 6.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 5.0430 4.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8710 2.5470 7.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 2.9770 8.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 3.8910 9.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 4.3120 10.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 3.8250 11.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1590 2.9120 10.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 2.4880 9.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 1.2420 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 0.0830 -1.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 1.6240 -1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9990 0.1950 4.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1710 -1.9060 4.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4600 -3.6940 3.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 -3.4160 0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7560 3.0600 0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 3.1270 0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7190 5.3010 5.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2240 4.0890 4.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0930 3.0950 6.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9010 2.3200 5.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5730 3.0260 5.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 4.3150 6.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8770 5.2710 4.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 5.9700 5.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 1.6580 7.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8620 2.2950 8.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 4.2790 9.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 5.0190 11.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3390 4.1550 11.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1740 2.5290 10.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7170 1.7760 8.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0700 3.6200 6.7830 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.3570 4.4700 7.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 54 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 54 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END