NIH-ZINC01114239 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 1.0430 1.0020 -0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 -0.3500 -0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 -0.8180 1.1030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 -2.0160 1.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 -2.7240 0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 -3.9420 1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 -4.4560 2.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 -3.7560 3.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 -2.5360 2.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 -1.8280 3.5580 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8740 -2.6140 3.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9040 -1.7410 4.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2750 -1.1780 5.7310 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9810 -0.4940 5.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 -1.4150 4.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8680 -1.2870 6.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8860 -1.9410 7.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3330 -0.6700 8.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0280 -0.6490 9.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3320 -0.6710 10.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0200 -0.6500 11.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4030 -0.6070 11.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1000 -0.5840 10.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4160 -0.6110 9.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8350 -0.5290 10.4400 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 0.8900 -0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 1.3600 -1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 1.7200 0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 -0.2370 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -1.0680 -0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 -2.3250 -0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7170 -4.4920 0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0220 -5.4080 2.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 -4.1600 4.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6310 -3.4780 4.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2870 -2.9500 2.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7630 -2.3490 4.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2260 -0.9330 3.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 -0.2770 6.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 0.4340 5.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -0.8830 4.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -2.2970 5.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 -0.2420 7.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 -0.7050 10.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4790 -0.6680 12.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9390 -0.5910 12.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9610 -0.5970 8.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 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 32 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 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 43 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 47 1 0 0 0 0 M END