IBS-ZINC02203201 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 -0.3000 1.9620 0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 0.4370 0.3780 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3740 0.1800 -0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 -0.1480 1.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 -0.5200 2.6120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7830 -0.1540 1.5780 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 -0.5980 2.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0490 -0.1290 2.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9240 -0.7830 3.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3760 -0.3220 3.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4960 1.2020 3.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6050 1.8750 2.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1560 1.4020 2.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9310 1.7290 3.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7940 0.8800 3.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5750 -0.1950 0.1820 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6720 0.1880 0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8610 -0.3050 0.8080 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0520 -1.3250 -0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3270 -1.8760 -0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5540 -2.9040 -1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5040 -3.3890 -1.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2270 -2.8460 -1.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0120 -1.8180 -0.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6760 -1.2250 -0.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7370 -1.6540 -1.4170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 2.3740 0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 2.3830 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 2.3170 1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 0.1390 0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1450 -0.2390 3.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5440 -1.6930 2.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4270 -0.4420 1.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5350 -0.5410 4.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8860 -1.8750 3.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9610 -0.7790 4.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7980 -0.6940 2.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1750 1.5270 4.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6280 2.9650 2.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9910 1.6650 1.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5800 1.8730 1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7230 1.7520 3.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 0.9750 1.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1480 -1.5030 0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5490 -3.3270 -1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6800 -4.1900 -2.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 -3.2270 -2.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0750 2.9670 3.6210 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 48 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 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 24 25 1 0 0 0 0 25 26 2 0 0 0 0 M CHG 1 48 -1 M END