IFLAB-ZINC02451814 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 1.8840 1.4240 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5070 -0.0230 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -0.5870 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 -1.9420 1.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 -2.7580 0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 -2.2070 -1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 -0.8430 -1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 -3.0580 -2.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -4.0960 0.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 -4.6870 1.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -6.1530 1.1620 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8650 -6.2250 0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 -6.9070 2.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -9.1740 3.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 -10.5980 2.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7270 -11.2720 2.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 -10.4350 0.9760 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2750 -10.3920 0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 -9.0090 1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2940 -11.0900 0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 -6.8330 0.6570 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4410 -6.2450 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9700 1.5360 -0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5530 1.8360 -1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 2.0190 0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 0.0290 2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 -2.3250 2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 -0.4150 -2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 -3.4770 -2.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 -2.4770 -3.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -3.8720 -2.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 -4.6240 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 -4.1900 1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -6.6550 3.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5770 -6.7240 2.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 -9.1410 4.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 -8.6790 3.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 -10.5900 2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 -11.1820 3.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 -12.2690 1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 -11.4180 2.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6870 -8.3900 0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3710 -8.9810 2.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1830 -11.1600 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5610 -10.5120 -0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0290 -12.1010 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 -8.3930 2.1450 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4810 -8.3750 1.5050 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 28 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 47 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 47 1 M END