ANALYTICONDISCOVERY-ZINC04221807 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 60 0 0 1 0 0 0 0 0999 V2000 -0.3890 0.7490 0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 -0.6510 0.4650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5490 -1.0780 -0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 -2.4550 -0.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -3.0270 -1.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9940 -2.2250 -2.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 -0.8450 -2.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -0.2740 -1.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7610 -2.8420 -3.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9800 -2.8690 -5.2280 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7140 -1.8470 -5.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8570 -3.4620 -6.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2820 -3.4600 -7.5950 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -3.1260 -7.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8010 -3.7950 -8.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0140 -3.8390 -6.1890 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -3.6360 -5.1010 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 -3.4980 -5.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -2.7920 -6.9840 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 -4.2930 -5.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6420 -4.0620 -6.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9770 -4.7210 -6.1820 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.7460 -3.9410 -6.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0470 -5.5420 -4.8790 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2850 -4.8770 -4.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7300 -6.2650 -4.5890 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5570 -7.0490 -5.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5410 -5.3050 -4.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8350 -6.9210 -3.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7080 -7.3640 -3.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0800 -6.5390 -4.9160 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7410 -6.2630 -5.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2760 -5.5450 -7.3460 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9770 -5.0620 -8.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3520 -3.8950 -8.5330 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2170 -6.0790 -9.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2600 -7.4340 -8.9190 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.6200 -8.2320 -10.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5090 -9.4380 -10.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7400 -9.1870 -10.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 1.2940 0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 1.1210 -0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 0.9240 1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 -3.0890 0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6730 -4.1000 -1.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1370 -0.1990 -3.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 0.8010 -1.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 -2.2810 -4.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0650 -3.8620 -3.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 -4.2720 -4.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6180 -3.3330 -7.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 -5.9160 -4.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5200 -4.7810 -3.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9630 -6.5110 -7.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7160 -5.5760 -10.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2550 -6.4730 -9.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1500 -7.5380 -11.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6900 -8.5490 -10.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9160 -10.5570 -10.1990 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 45 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 8 47 1 0 0 0 0 9 10 1 0 0 0 0 9 48 1 0 0 0 0 9 49 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 16 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 28 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 33 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 31 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 31 32 1 0 0 0 0 33 34 1 0 0 0 0 33 54 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 36 37 1 0 0 0 0 36 55 1 0 0 0 0 36 56 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 38 57 1 0 0 0 0 38 58 1 0 0 0 0 39 40 2 0 0 0 0 39 59 1 0 0 0 0 M CHG 1 59 -1 M END