IBS-ZINC05072363 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 0 0 0 0 0 0999 V2000 -5.8500 7.8050 -1.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0690 6.7980 -2.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9600 5.5000 -1.8680 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2580 5.7150 -4.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2080 4.9100 -2.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8190 5.8490 -3.6630 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3950 7.0580 -3.2380 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7830 3.2010 -2.8150 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.7570 2.6100 -1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1530 2.1240 -0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 1.9540 -0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0070 1.5720 -1.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6380 1.4140 -1.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 1.6320 -0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6060 2.0100 0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 2.1780 0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6350 2.5540 1.9870 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8420 2.7650 3.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2210 2.6430 -1.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8930 2.2350 -0.6290 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2310 8.1760 -0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1410 8.6360 -1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7430 7.3300 -0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7450 1.8620 0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5480 1.4000 -2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 1.1190 -2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 1.5060 -0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 2.1770 1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3220 1.8420 3.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 3.5520 2.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4870 3.0600 3.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8220 3.1260 -2.6630 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7880 3.1280 -2.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 5 2 0 0 0 0 4 6 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 14 15 2 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 19 20 2 0 0 0 0 19 32 1 0 0 0 0 32 33 1 0 0 0 0 M END