IBS-ZINC04370896 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 1.2230 0.9440 3.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4050 -0.4960 3.2730 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7780 -1.1610 3.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 -0.5940 1.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 -1.9890 1.3620 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1580 -2.5930 0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4240 -2.1540 0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7680 -0.9990 0.4750 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2530 -3.0240 -0.3190 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1260 -2.7240 -0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8860 -4.3010 -0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6600 -5.0580 -1.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6840 -4.7620 -0.1320 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7890 -3.9160 0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 -4.0770 0.9930 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -2.9440 1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 -2.7570 2.1080 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 -4.0410 2.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0080 -3.7840 3.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9180 -3.0460 2.3540 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3270 -1.7630 1.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 -2.0190 1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1620 -2.8560 2.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1680 -2.1780 2.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3980 -1.9920 2.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6270 -2.4800 4.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6270 -3.1560 4.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3980 -3.3500 4.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 -6.1610 -0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7750 -0.8770 3.4170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 1.2350 3.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 1.0130 4.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 1.6090 3.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -0.2360 1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6740 0.0170 1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8700 -4.6510 1.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9990 -4.5630 3.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4610 -4.7360 3.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8190 -3.1960 4.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0140 -1.2410 1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1430 -1.1520 2.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5520 -1.0670 0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1940 -2.6070 0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9890 -1.7950 1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1800 -1.4640 2.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5890 -2.3330 4.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8100 -3.5370 5.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6190 -3.8820 4.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1450 -6.6670 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1200 -6.6550 0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4310 -6.2020 -1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 -0.8390 4.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 30 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 6 14 2 0 0 0 0 7 8 2 0 0 0 0 7 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 13 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 M END