IBS-ZINC05219349 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 -2.8740 -0.0940 3.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0530 -0.9750 3.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 -1.0010 2.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 -2.0740 2.0760 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.5920 1.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6990 -3.6410 0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5920 -4.2080 0.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7400 -3.7110 0.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7030 -2.6010 1.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6700 -1.9500 2.3640 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3550 -0.1490 3.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 -0.5750 3.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 1.3010 3.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 2.1560 4.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 3.5170 3.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 4.5410 4.4720 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 3.3740 2.5400 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 1.9790 2.1380 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3690 1.7720 1.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 1.6490 0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 1.2170 -0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 0.8950 -1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0160 1.0020 -1.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6720 1.4240 -0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 1.7470 0.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7300 0.6920 -2.4510 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 4.4930 1.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 5.1370 1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6330 7.2140 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 6.3360 -0.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 1.9050 5.6320 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1060 0.8420 3.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8190 -0.5810 4.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3530 0.1400 4.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6690 -2.1260 1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 -4.0810 0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6010 -5.0530 -0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7010 -4.1390 0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1970 1.1180 -0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 0.5550 -2.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7560 1.4940 -0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4610 2.0670 1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 4.1420 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 5.2370 2.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 5.3430 1.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 4.4970 0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2030 6.6270 -0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2000 7.3570 0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3530 8.1860 -0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4810 5.9280 -0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 5.6780 -1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 7.3340 -1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 2.7760 6.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 6.4660 0.3880 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1310 7.0460 1.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 28 54 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 54 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 54 1 0 0 0 0 31 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END