COMGENEX-ZINC06838862 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 -0.8220 -2.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 -1.2700 -3.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9800 -1.3910 -3.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7350 -1.0600 -2.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 -0.5990 -1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0760 -0.3470 -0.3230 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9200 -0.0220 0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3050 -0.6250 -0.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1680 -1.0680 -2.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2800 -1.4790 -3.0470 C 0 0 3 0 0 0 0 0 0 0 0 0 4.8570 -1.7790 -4.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0460 -2.6550 -2.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0780 -3.1450 -3.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1880 -2.6070 -4.5030 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8770 -4.1810 -3.0990 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8800 -4.6580 -4.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6350 -5.8160 -3.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3000 -7.1140 -3.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2770 -7.8490 -2.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1520 -6.9570 -2.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7610 -5.7270 -2.7290 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2190 -0.3190 -3.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8770 0.2360 -2.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7390 1.3010 -2.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9420 1.8100 -3.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2840 1.2550 -4.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 0.1870 -4.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5010 1.8010 -6.0670 N 0 3 0 0 0 0 0 0 0 0 0 0 8.2600 2.7390 -6.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9220 1.3110 -7.0190 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 -0.7330 -2.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -1.5270 -4.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4690 -1.7410 -4.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2460 -0.5140 -0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5420 -2.3300 -1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3510 -3.4620 -2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7890 -4.6110 -2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3840 -4.9820 -4.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5750 -3.8500 -4.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4470 -7.5170 -4.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3140 -8.9220 -2.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0230 -7.1900 -1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7190 -0.1610 -1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2530 1.7350 -1.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6140 2.6430 -3.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9150 -0.2490 -5.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 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 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 6 7 2 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 25 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 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 48 1 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 30 54 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 M CHG 1 31 1 M CHG 1 33 -1 M END