IBS-ZINC00533452 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9860 -0.1020 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -2.0580 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 -0.1620 1.2730 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4540 -0.0510 1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1000 0.3080 2.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3860 0.5640 3.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0590 0.9060 4.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4480 1.0030 4.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1740 0.7600 3.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5140 0.4060 2.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1810 0.1570 1.4140 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5300 -0.1730 0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2030 -0.2720 0.2660 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3090 -0.4400 -0.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6980 -0.3380 -0.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4110 -0.5900 -2.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7110 -0.9360 -3.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3300 -1.0190 -3.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6760 -0.7680 -2.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 -2.4890 0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4380 -2.4350 -0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -2.3340 -1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5450 0.0060 2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3080 0.4920 3.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5080 1.1040 5.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9580 1.2750 5.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2510 0.8380 3.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2110 -0.0670 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4890 -0.5200 -2.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2380 -1.1390 -4.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7820 -1.2880 -4.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 16 2 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 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 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 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 M END