IBS-ZINC05219305 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 -3.9650 0.5020 3.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2100 -0.7470 3.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1160 -0.9700 2.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 -2.3280 2.8220 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 -3.1180 2.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8570 -4.4350 2.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8170 -5.0060 3.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7470 -4.2400 3.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8050 -2.8440 3.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6120 -1.9080 4.1660 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 -0.0650 1.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 -0.3120 0.6890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 1.1950 2.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 1.4960 3.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 2.8940 3.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 3.4810 4.7620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 3.3540 2.4430 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 2.3250 1.4850 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4020 2.6730 0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 2.0580 0.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 2.4100 -0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 2.1990 -1.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 1.6320 -1.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8450 1.2750 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 1.4900 0.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 1.1660 2.1110 F 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 4.7150 2.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7540 4.9670 2.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6310 7.4700 2.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6440 6.4340 1.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 0.7310 4.8110 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8870 1.1980 2.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0270 0.2830 3.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5890 0.9980 4.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 -2.6340 1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 -5.0840 2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 -6.0720 3.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4630 -4.6590 4.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 2.8440 -1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 2.4690 -2.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4190 1.4620 -2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7830 0.8280 0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 4.9150 1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 5.3780 2.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0930 4.8990 3.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3130 4.2370 1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0010 7.3440 3.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 7.4540 2.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9900 8.4080 2.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9600 5.6460 0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1150 6.3140 2.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8740 7.4130 1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 1.2910 5.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1490 6.3360 1.6870 N 0 3 0 0 0 0 0 0 0 0 0 0 1.7500 6.4470 0.7450 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 27 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 24 42 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 28 54 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 54 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 54 1 0 0 0 0 31 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END