OTAVA-ZINC04425601 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 -10.0780 1.7970 5.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9420 0.9450 5.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2010 1.0180 4.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3700 1.9530 3.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5390 1.9200 1.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5360 0.9560 1.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3590 0.0170 2.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1910 0.0550 3.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3130 -0.9990 2.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4270 -2.1700 2.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6100 -2.7060 1.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6670 -2.0970 1.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3330 -3.9620 0.8780 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0620 -4.4580 1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3880 -5.9030 0.5860 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.1260 -3.2970 2.0270 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.4180 -4.6870 0.1550 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.0590 -5.7000 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6860 -4.0490 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6660 -3.0620 -1.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8570 -2.4650 -2.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0650 -2.8410 -3.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0830 -3.8140 -3.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8930 -4.4100 -2.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6420 -5.0110 1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3710 -5.1430 2.2900 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5960 1.5670 6.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7770 2.8490 5.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7770 1.6120 4.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1390 2.7170 3.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6780 2.6450 1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9050 0.9380 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0690 -0.6770 4.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3820 -0.7250 3.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2980 -2.7530 -0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6260 -1.7080 -2.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2150 -2.3770 -4.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4630 -4.1100 -4.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1180 -5.1660 -2.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7550 -5.1780 0.4800 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 25 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 23 2 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 25 26 2 0 0 0 0 25 40 1 0 0 0 0 M CHG 1 40 -1 M END