IBS-ZINC05142083 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4100 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 1.2950 -0.3760 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 0.7310 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8030 -1.7950 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9550 -2.2480 -1.4090 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4120 -3.5270 -1.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7070 -4.3280 -0.6600 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1490 -5.5650 -0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2990 -6.0120 -2.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9780 -5.1420 -3.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5370 -3.9200 -2.9310 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -5.5440 -4.5430 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7720 -4.6200 -5.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0080 -5.3060 -6.9750 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3930 -6.2030 -7.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6600 -4.3390 -8.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9740 -4.2260 -8.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7300 -5.5110 -8.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3960 -5.6540 -7.1100 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7880 -7.3800 -2.4680 N 0 3 0 0 0 0 0 0 0 0 0 0 2.9960 -8.3000 -2.5760 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9820 -7.5870 -2.5920 O 0 5 0 0 0 0 0 0 0 0 0 0 3.4560 -6.3960 0.1900 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8930 2.0410 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -0.6590 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 2.8430 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7690 -1.8390 0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 -2.4400 0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 -1.6500 -2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4310 -6.4360 -4.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 -4.3320 -5.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -3.7310 -5.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8640 -4.7530 -8.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 -3.3660 -7.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7720 -4.2300 -10.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5320 -3.3340 -8.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3750 -6.3710 -9.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8050 -5.3830 -8.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3490 -6.0780 1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7770 -7.2970 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 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 6 1 0 0 0 0 4 5 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 2 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END