CHEMDIV-ZINC01018916 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 0.2470 1.4150 -0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -0.0800 -0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 -0.8020 0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -2.2020 0.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -2.9330 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 -2.1850 -1.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6300 -0.7850 -1.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -4.3240 -0.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -5.0240 1.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -4.5920 2.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2930 -4.6310 1.7150 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4950 -4.8970 0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0650 -4.3790 2.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7950 -4.2880 3.3820 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 -5.1000 -1.2920 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2290 -4.4730 -2.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3300 -6.0290 -1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4370 -5.6800 -0.8550 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -7.2970 -1.6990 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 -7.5660 -1.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 -8.6290 -2.2730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3110 -6.1600 -1.5920 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0140 -8.3280 -1.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5030 -8.4370 -3.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 -9.1880 -4.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2510 -9.3080 -5.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4390 -8.6850 -5.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1780 -7.9240 -5.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6880 -7.7980 -3.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4790 -7.2650 -5.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9970 -6.4600 -4.5920 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0530 1.7220 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 1.8460 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 1.8320 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5670 -0.2860 1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 -2.7110 1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -2.6750 -1.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2290 -0.2520 -1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -6.1080 1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 -4.8660 1.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5960 -9.2950 -1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8610 -8.1270 -1.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -9.6930 -3.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6910 -9.8930 -6.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7970 -8.7940 -6.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2550 -7.2020 -2.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9520 -7.5630 -6.5730 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 22 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 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 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 28 2 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 46 1 0 0 0 0 30 31 1 0 0 0 0 30 47 2 0 0 0 0 M CHG 1 31 -1 M END