IBS-ZINC01271184 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 1 0 0 0 0 0999 V2000 0.9790 1.2920 -0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -0.0850 -0.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -0.7380 1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -2.0250 0.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -2.1810 -0.5260 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 -0.9980 -1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 -0.6800 -2.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6420 -0.4170 -3.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6780 -1.3550 -2.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9280 -1.1160 -3.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1540 0.0570 -4.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1310 0.9920 -4.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8810 0.7560 -3.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -3.0840 1.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -1.2100 3.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -0.2360 2.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -3.6520 4.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 -3.6470 5.3440 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0850 -2.7400 5.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1030 -4.8660 6.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 -4.7810 7.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -5.9130 8.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -7.1470 7.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -7.2410 6.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 -6.1090 5.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 -8.1720 8.7710 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 -9.4470 8.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 -3.5550 4.6280 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0150 1.3130 -0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 1.7490 -0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 1.8400 0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 -1.5190 -3.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 0.1770 -2.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5150 -2.2810 -2.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7230 -1.8500 -3.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1250 0.2380 -4.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9020 -4.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 1.4940 -3.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2210 -3.2630 1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 -4.0130 1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 -1.0020 4.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0450 -1.1340 3.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1650 2.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 0.7590 2.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 -4.6330 3.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 -3.3880 4.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -3.8370 7.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -5.8350 9.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 -8.1800 6.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 -6.2130 4.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 -10.1420 9.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -9.8260 7.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 -9.4130 8.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0950 -3.8320 5.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 -2.6630 3.2060 N 0 3 0 0 0 0 0 0 0 0 0 0 1.4210 -2.7360 3.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 14 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 55 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 55 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 17 55 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 28 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 55 1 M END