IBS-ZINC06754674 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3830 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -0.6920 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 0.0180 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3730 1.4320 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 2.1050 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 2.1230 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7700 3.4870 0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0030 4.1020 0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1520 3.3640 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0680 2.0090 -0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8330 1.3760 -0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7490 0.0530 -0.5760 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7120 -0.6380 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8640 -1.7610 0.3930 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3190 1.2200 -0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0850 -0.0910 0.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6190 -0.6290 1.7680 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8670 -1.2610 2.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9070 -1.4390 1.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9760 -0.7200 2.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1050 0.0470 3.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9560 0.4640 2.6380 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3630 3.9780 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5510 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -1.7720 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 3.1850 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8790 4.0600 0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0780 5.1600 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0820 0.3950 -1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0580 1.8690 -1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8360 0.5500 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8600 -0.9240 -0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7790 -2.4690 1.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1820 -1.4110 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6230 -1.4400 2.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5610 -0.0280 1.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7990 -0.6130 4.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6420 0.9120 3.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8010 3.9790 0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8620 0.6860 0.6820 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0290 1.4260 1.3460 H 0 0 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 14 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 23 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 24 41 1 0 0 0 0 42 43 1 0 0 0 0 M END