IBS-ZINC04898588 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 3.0260 1.4400 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 0.0950 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3300 -0.8500 0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 -0.4410 0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 0.9050 0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7060 1.8440 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 3.3120 0.0430 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4590 3.4580 -0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 3.8280 1.4680 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3770 3.2250 1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4590 3.7170 2.2410 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5050 4.4360 1.5110 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4640 4.5610 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3640 5.1580 -0.3820 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4700 4.0520 -0.5690 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2900 4.3330 3.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 3.7640 4.2610 F 0 0 0 0 0 0 0 0 0 0 0 0 3.4360 4.0830 4.3940 F 0 0 0 0 0 0 0 0 0 0 0 0 2.1030 5.7140 3.5100 F 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 2.3410 2.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 5.2670 1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4900 6.1370 1.1320 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 5.6160 1.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 6.9590 1.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3990 7.2790 2.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3280 6.2750 2.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9480 4.9420 2.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6430 4.6080 1.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6110 6.5960 2.5780 F 0 0 0 0 0 0 0 0 0 0 0 0 2.6370 -2.1730 0.2070 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8120 2.1760 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3720 -0.2200 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -1.1740 0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 1.2230 0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2420 4.8300 2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4830 4.1770 -1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6510 2.1960 2.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3670 7.7420 1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7020 8.3140 2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6760 4.1650 2.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 3.5700 1.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7850 -2.5160 1.0990 H 0 0 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 15 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 21 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 38 1 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 40 1 0 0 0 0 28 41 1 0 0 0 0 30 42 1 0 0 0 0 M END