IBS-ZINC05180186 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 3.3380 0.6450 2.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7280 -0.6890 2.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 -1.1000 2.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4420 -2.4650 2.8340 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -3.4140 2.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 -4.6980 3.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0780 -5.0720 3.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0650 -4.1560 3.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7680 -2.7930 3.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5510 -1.7410 3.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 -0.3540 2.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6840 -0.8290 1.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 1.0340 2.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 1.4620 3.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 2.9330 3.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 3.6320 4.9220 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 3.2950 2.6730 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3610 2.1400 1.7950 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3710 2.2450 0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7580 2.0390 1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9670 1.7230 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2610 1.6650 -0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3150 1.9320 0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1620 2.2380 1.5380 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8950 2.2650 2.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 4.6730 2.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 5.2010 1.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 6.6440 1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 6.5990 -0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8580 8.7310 0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 0.7480 5.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2750 1.2440 3.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3960 0.5480 2.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 1.1860 1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5930 -3.0780 2.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -5.4620 3.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 -6.1150 3.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0930 -4.4270 3.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1290 1.5120 -0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4410 1.4130 -1.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3420 1.9070 -0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8230 2.5010 3.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 4.7360 1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 5.2870 3.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7490 5.1330 2.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 4.5620 0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 6.7280 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 7.2640 1.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6110 6.6950 -1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 5.5520 -0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3150 7.1190 -1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6170 9.1490 1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0740 8.9570 -0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8270 9.1100 0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 1.3880 5.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9640 7.2330 0.5360 N 0 3 0 0 0 0 0 0 0 0 0 0 2.7030 7.0540 1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 18 20 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 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 56 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 29 56 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 56 1 0 0 0 0 31 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END