IBS-ZINC02106049 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 0.0020 1.7950 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 0.4530 0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -0.4140 0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 0.1150 0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3670 1.4530 0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3030 2.3080 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7780 1.6380 0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3040 0.4100 0.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2770 -0.4910 1.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3750 -1.4630 1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5390 2.9170 0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3830 3.9030 1.6000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3330 4.0550 1.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9830 5.2170 1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1710 5.4460 1.4210 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1260 3.4700 2.7950 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6210 2.6760 3.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4480 2.3170 3.8730 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6410 2.3520 4.8920 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8070 3.2480 5.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9520 1.7700 4.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4310 0.8860 5.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1430 0.4450 6.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0100 -0.4870 6.9520 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1540 1.3120 5.7650 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8190 2.4550 -0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 0.0750 0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 -1.4570 0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 3.3570 -0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3190 0.1100 1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6020 2.6800 0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1990 3.3700 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0720 3.8510 2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7870 1.1540 3.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6840 2.5410 4.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0070 0.0300 5.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0150 1.4570 6.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1830 1.2240 6.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2290 5.8880 0.2760 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 38 1 0 0 0 0 M CHG 1 39 -1 M END