IBS-ZINC04981689 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 -0.3450 0.7940 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 0.5640 2.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 2.8490 1.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6210 3.4980 2.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 5.0190 2.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4470 5.6360 3.4730 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2040 5.9100 4.8850 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8200 4.9790 5.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5710 6.3040 5.4940 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.4400 6.4390 4.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7140 5.9720 3.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2140 5.8940 1.9540 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5960 6.8300 4.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0740 5.2140 6.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9310 4.0240 6.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7430 5.5900 7.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5080 6.7510 7.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1080 7.0650 9.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9470 6.2240 10.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1910 5.0560 10.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5980 4.7400 8.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9550 4.1510 11.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5190 4.4360 12.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 7.0000 5.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 6.7820 5.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 7.7700 6.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7690 8.9920 5.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 9.2150 4.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 8.2370 4.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3630 10.3930 4.0430 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 -0.2570 0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 0.8970 0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 1.3460 -0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4910 0.7010 2.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 -0.4860 2.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 0.9090 3.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 3.2870 0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 2.9600 1.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6580 3.2380 2.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 3.1210 3.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 5.3130 2.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6210 5.4020 1.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5100 7.2640 6.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6740 7.4160 6.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7100 7.9670 9.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4290 6.5070 11.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0130 3.8260 8.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1220 5.3720 12.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6130 4.4570 12.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2320 3.6280 12.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 5.8390 6.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6670 7.5860 6.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 9.7690 5.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 8.4610 3.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 1.3660 1.4720 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9850 1.2610 1.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 55 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 55 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 55 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 12 2 0 0 0 0 14 15 2 0 0 0 0 14 16 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 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 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 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 55 1 M END