IBS-ZINC04044110 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 52 0 0 1 0 0 0 0 0999 V2000 5.9950 2.4280 1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0320 2.7290 0.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2610 1.7090 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4440 0.3770 0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4140 0.0850 1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1850 1.1070 1.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6140 -0.7240 -0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0500 -1.0770 -1.7290 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1360 -0.1690 -2.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3440 -1.8720 -1.8080 C 0 0 3 0 0 0 0 0 0 0 0 0 6.7030 -1.2610 -1.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5200 -2.2850 -1.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6590 -3.5270 -1.3350 C 0 0 3 0 0 0 0 0 0 0 0 0 7.0210 -4.3220 -0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4450 -2.9250 -0.8140 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2270 -3.8790 -2.7670 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1080 -3.8220 -3.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2650 -2.7200 -3.0930 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5780 -2.1560 -3.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7680 -2.9540 -3.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2130 -3.7840 -3.8920 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1220 -1.9560 -2.4510 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 -1.7890 -2.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 -0.4610 -3.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5790 -0.1370 -4.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 1.1000 -4.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 2.0200 -4.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 1.7040 -2.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 0.4680 -2.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6930 -5.2980 -2.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3630 -5.9010 -1.8650 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5960 3.2210 1.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8830 3.7580 0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5150 1.9560 -0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5810 -0.9430 1.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9390 0.8680 2.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6140 -1.6130 0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5750 -0.3760 -0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9770 -0.2300 -1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5890 -2.2510 -1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -2.5900 -3.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -1.9060 -1.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1230 -0.8480 -4.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 1.3410 -5.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 2.9830 -4.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 2.4210 -2.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 0.2380 -1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7160 -5.7280 -4.1120 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 22 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 18 1 0 0 0 0 11 12 2 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 30 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 28 2 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 29 47 1 0 0 0 0 30 31 2 0 0 0 0 30 48 1 0 0 0 0 M CHG 1 48 -1 M END