CHEMDIV-ZINC01076462 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -1.1290 0.3620 3.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 -0.9390 2.8360 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7960 -1.3350 1.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6990 -0.6470 1.4430 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5750 -2.7360 1.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 -3.3940 1.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 -4.7110 1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 -5.3780 0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3390 -4.7330 0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5720 -3.4100 0.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7820 -2.7290 0.4500 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8950 -3.1940 -0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0010 -4.2790 -0.7950 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0400 -2.1970 -0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2270 -2.7210 0.4470 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3740 -2.8420 1.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6540 -3.3070 2.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2900 -3.4870 0.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3890 -3.1410 -0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6000 -3.1870 -1.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9090 -3.9400 -2.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3870 -3.7400 -3.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4380 -2.8510 -3.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8400 -2.2640 -2.3380 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.3120 -2.5100 2.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5940 -3.7630 3.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3990 -3.4700 4.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8850 -2.3210 4.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 0.5530 4.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 1.1200 2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1230 0.4140 3.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -2.8950 2.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -5.2190 1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 -6.4080 0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0760 -5.3000 -0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8040 -1.7680 0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7760 -1.2560 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2840 -1.9400 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0760 -3.5030 3.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2960 -3.8490 0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0970 -4.6090 -2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9840 -4.2280 -4.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9930 -2.5190 -4.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6090 -1.7770 2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7850 -2.0120 3.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3010 -4.4020 3.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2260 -4.3540 2.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0550 -4.4350 4.9650 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 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 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 15 19 1 0 0 0 0 16 17 2 0 0 0 0 16 25 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 M CHG 1 48 -1 M END