IBS-ZINC05349096 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 0 0 0 0 0 0999 V2000 0.2590 1.5130 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 0.0300 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -0.7950 1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -2.1210 0.6890 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 -2.1120 -0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 -0.8000 -1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 -0.5930 -2.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 -1.6840 -3.3390 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4230 -2.9000 -2.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 -3.2030 -1.4710 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 0.6650 -3.1250 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 0.8250 -4.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 2.3110 -4.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 2.5210 -6.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 4.1340 -8.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 4.9030 -6.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 -3.2940 1.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6520 -4.4340 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5630 -5.5730 2.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 -5.5980 3.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 -4.4720 3.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 -3.3280 2.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 -6.7700 3.8240 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -6.8270 4.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -0.3720 2.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0650 1.8210 -0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 1.9930 -0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 1.8950 1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -3.7380 -3.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 1.4710 -2.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 0.2700 -5.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 0.4320 -4.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 2.8610 -4.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 2.7070 -4.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 1.9320 -6.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 2.2430 -6.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 3.8140 -8.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 3.5160 -8.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 5.1860 -8.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 4.8800 -5.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1130 4.5720 -6.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 5.9150 -6.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 -4.4560 0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1620 -6.4470 1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7300 -4.4510 4.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6110 -2.4930 2.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 -6.7270 4.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -6.0720 5.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 -7.8110 5.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 -1.0750 3.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -0.2570 2.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4500 0.5930 2.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 3.9770 -6.8000 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7830 4.2760 -6.3140 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 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 14 53 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 15 53 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END