ANALYTICONDISCOVERY-ZINC04222667 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 70 0 0 1 0 0 0 0 0999 V2000 0.0940 1.7140 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 0.2080 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -0.4580 1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -1.8510 1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 -2.6100 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -1.9520 -1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -0.5400 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 0.1780 -2.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 -0.6930 -3.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 -2.0100 -3.7060 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2870 -1.7730 -3.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 -2.7740 -2.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -2.8900 -4.9560 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1140 -3.1850 -4.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -2.1740 -6.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7990 -4.1590 -4.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9190 -4.2020 -4.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 -5.2370 -5.5490 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -6.5290 -5.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8860 -6.5830 -6.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5950 -7.9130 -6.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7350 -8.1180 -5.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3800 -9.3560 -5.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8910 -10.4090 -6.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7420 -10.2130 -7.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1020 -8.9670 -7.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3240 -11.2950 -8.3020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 -11.1310 -9.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4580 -11.6590 -6.8320 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6090 -11.8960 -6.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -4.1200 0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -2.5650 2.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -1.8390 3.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 -2.8510 4.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 -3.2710 5.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 2.1000 -0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 2.0880 -0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 2.1200 0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 0.1390 2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 0.5800 -2.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 1.0250 -2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 -0.1220 -4.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6440 -0.8960 -3.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 -3.1860 -2.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 -3.6140 -2.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -1.3760 -6.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 -2.8650 -7.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 -1.7370 -6.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -5.1340 -5.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -7.2790 -5.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 -6.7360 -4.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6250 -5.7800 -6.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 -6.3950 -7.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1270 -7.3140 -5.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2620 -9.4650 -5.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 -8.7900 -8.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 -12.0800 -9.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 -10.3660 -9.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 -10.9060 -8.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9200 -12.9330 -6.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3840 -11.7800 -4.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4400 -11.2500 -6.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 -4.5080 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8340 -4.5520 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 -4.4820 1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 -1.1980 3.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9830 -1.2320 3.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 -3.1160 5.2560 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 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 39 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 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 15 46 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 21 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 54 1 0 0 0 0 23 24 1 0 0 0 0 23 55 1 0 0 0 0 24 25 2 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 29 30 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 30 62 1 0 0 0 0 31 63 1 0 0 0 0 31 64 1 0 0 0 0 31 65 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 33 66 1 0 0 0 0 33 67 1 0 0 0 0 34 35 2 0 0 0 0 34 68 1 0 0 0 0 M CHG 1 68 -1 M END