IBS-ZINC02348437 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 -0.1720 1.4540 -0.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3150 0.0310 -0.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 -0.2650 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1020 -1.5290 -0.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4630 -1.5720 -0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2620 -1.9890 0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6430 -2.0730 0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -1.7540 -0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4110 -1.3470 -1.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0270 -1.2630 -1.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5850 -1.8890 -0.6750 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2300 -1.5500 -1.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -0.8550 -1.0920 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 -2.1820 -1.2900 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7480 -2.7850 -2.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 -2.2210 -3.5860 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 -3.2500 -4.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4810 -3.2700 -5.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4680 -4.4640 -6.5100 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 -5.5710 -5.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 -5.6660 -4.4810 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 -4.4620 -3.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 -4.1590 -2.5690 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 -5.1470 -1.5200 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1400 -5.9550 -1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7640 -5.6420 -0.8350 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6010 -5.0250 -1.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -5.2620 0.6450 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0100 -4.3000 0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -5.1610 0.7540 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4580 -6.1450 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -4.5560 -0.4870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 -4.2920 1.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8640 -4.1810 1.8760 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0830 -4.0190 0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0630 -6.2570 1.5130 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 -6.9860 0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8630 -6.9690 -0.8990 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.7650 -2.1280 -6.5860 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 1.8440 -1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 1.5030 0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 2.1220 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 0.4750 0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8190 -2.2470 1.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2710 -2.4000 1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8170 -1.1010 -2.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3900 -0.9670 -2.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0660 -0.4980 -2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3060 -1.6950 -1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9080 -2.2100 -2.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 -0.4550 -1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -2.7390 -0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 -6.5060 -6.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -3.2770 1.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 -4.7210 2.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 -1.2370 -6.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9590 -2.2170 -7.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 2 3 2 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 43 1 0 0 0 0 4 5 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 44 1 0 0 0 0 7 8 1 0 0 0 0 7 45 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 46 1 0 0 0 0 10 47 1 0 0 0 0 11 12 1 0 0 0 0 12 48 1 0 0 0 0 12 49 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 13 51 1 0 0 0 0 14 15 1 0 0 0 0 14 52 1 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 32 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 38 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 36 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 33 1 0 0 0 0 33 34 1 0 0 0 0 33 54 1 0 0 0 0 33 55 1 0 0 0 0 34 35 1 0 0 0 0 36 37 1 0 0 0 0 39 56 1 0 0 0 0 39 57 1 0 0 0 0 M CHG 1 38 -1 M END