COMGENEX-ZINC06687783 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 2.5880 3.3800 1.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7360 2.2670 1.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4960 1.1320 1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7810 1.5090 1.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8210 2.8640 1.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 -0.2690 1.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 -0.5850 2.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8560 -1.2330 0.6850 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8970 -0.9440 -0.3090 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7560 -0.4960 0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2610 -2.3060 -0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8680 -3.2220 0.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 -2.6790 0.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7400 -3.2350 2.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3950 -3.4260 2.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -4.0270 2.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 -3.2920 0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 -3.2140 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2270 -5.2170 2.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -5.7870 3.4830 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 -5.7930 1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9910 -7.1220 1.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 -7.8680 0.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 -6.5580 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4890 -0.1600 -1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2490 0.0010 -1.7570 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 4.4260 1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 2.2730 1.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7810 3.3010 0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7350 -2.5850 -1.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3360 -2.4100 -1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2210 -4.2230 2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3980 -2.6180 2.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 -4.0480 3.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9790 -2.4870 3.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 -3.7660 0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 -2.3020 1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 -2.6150 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 -4.2250 -0.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0320 -5.0300 1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0010 -7.3850 2.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0150 -7.1990 1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -8.1900 1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 -8.7120 0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 -6.4590 -0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 -6.3530 -0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4600 0.2090 -2.2950 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 25 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 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 23 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 M CHG 1 47 -1 M END