ANALYTICONDISCOVERY-ZINC04221820 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 0 0 1 0 0 0 0 0999 V2000 0.1550 1.6170 0.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 0.1480 0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 -0.3320 -0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -1.6990 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 -2.6070 -0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 -2.1230 1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 -0.7580 1.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 -3.9990 -0.3690 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 -4.6990 -1.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 -4.2260 -2.6810 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 -6.0650 -1.3420 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 -7.0320 -2.4280 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4710 -6.6120 -3.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5720 -7.2040 -3.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3380 -8.3000 -2.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9140 -9.4600 -2.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6590 -9.1920 -1.1780 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9330 -8.6790 -0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 -8.3710 -1.9430 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7440 -8.9540 -2.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 -8.1750 -1.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1080 -7.5410 -1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -10.4380 -0.7910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -10.1980 -0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6470 -8.3010 -3.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8760 -7.5430 -4.5320 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5630 -9.2330 -3.1570 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9650 -9.2110 -3.5850 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.2590 -8.1660 -3.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8620 -9.8470 -2.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9500 -9.0690 -1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4610 -7.9080 -1.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0820 -9.9260 -4.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3810 -9.3250 -5.9610 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8070 -8.5000 -5.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4240 -9.7000 -6.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7810 -10.9130 -5.1590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 2.0840 0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5490 1.7910 1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 2.1050 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 0.3530 -1.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -2.0220 -2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 -2.8000 1.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 -0.4090 2.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 -4.5460 0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 -6.4190 -0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9200 -6.3740 -3.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7050 -9.7390 -1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7530 -10.3360 -2.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3080 -9.9510 -2.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8850 -9.9330 -2.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5190 -10.8660 -2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5180 -9.7030 -0.2840 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 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 41 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 45 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 2 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 33 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 32 2 0 0 0 0 31 53 1 0 0 0 0 33 34 1 0 0 0 0 33 37 2 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 M CHG 1 53 -1 M END