IBS-ZINC02284894 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 -0.0240 1.4370 -0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 0.0090 -0.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 -0.6280 -0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3770 0.1080 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5980 -0.5370 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6550 -1.9240 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 -2.6640 -0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 -2.0170 -0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 -2.7400 -0.2970 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 -4.1620 -0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8920 -2.5750 -0.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0450 -1.8470 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2540 -2.4750 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4590 -1.7040 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4160 -1.0930 -0.1460 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3200 -3.9490 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3060 -4.7490 0.1180 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5550 -6.0480 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8420 -6.3850 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7820 -4.9020 -0.2840 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.4890 -7.0640 0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1710 -6.6650 0.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1840 -7.6140 0.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5000 -8.9600 0.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8060 -9.3620 0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8020 -8.4210 0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 1.8160 -0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 1.8250 -0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 1.7580 0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3350 1.1860 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0380 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5260 -3.7420 -0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 -4.5140 0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 -4.4410 -1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -4.6150 -0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9320 -3.5440 -0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0000 -0.7740 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2310 -7.3900 -0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9240 -5.6140 0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1620 -7.3060 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 -9.7000 0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0460 -10.4140 0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8220 -8.7360 0.0520 H 0 0 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 3 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 M END