IBS-ZINC01322987 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 53 0 0 1 0 0 0 0 0999 V2000 0.2060 1.1400 0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 -0.2890 0.1340 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0620 -1.0350 1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -2.5280 0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -2.9040 -0.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 -4.2440 -0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -4.6340 -2.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -3.6720 -3.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 -2.3310 -2.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 -1.9470 -1.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -0.4800 -1.2530 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1320 -0.0140 -1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 0.1520 -1.4420 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1040 -0.4930 -1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1040 0.3740 -1.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4910 1.6800 -1.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1010 1.4820 -1.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 2.5590 -1.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 3.8020 -2.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1340 3.9920 -2.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9950 2.9500 -2.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -1.3880 -3.8910 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 -1.0380 -4.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 -4.2990 -4.4710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 -5.6800 -4.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 -5.8640 -2.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 -0.7880 0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 1.4870 0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 1.7030 -0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 1.2900 1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0970 -0.8320 0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 -0.7330 2.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 -3.1010 1.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 -2.7540 1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 -4.9900 -0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2310 -1.5430 -1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1610 0.1500 -1.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 2.4210 -1.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 4.6370 -2.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5240 4.9730 -2.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0610 3.1050 -2.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1870 -1.9220 -4.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 -0.6480 -3.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 -0.2770 -5.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 -5.8620 -4.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 -6.3340 -4.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8810 -0.2360 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2470 -1.8480 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5310 -0.6480 1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 11 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 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 35 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 2 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 M CHG 1 2 1 M END