IFLAB-ZINC04106249 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 39 0 0 0 0 0 0 0 0999 V2000 0.0740 1.5080 0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 0.1260 0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 -0.5820 0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 0.0960 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 1.4840 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 2.1860 0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6530 -0.6190 0.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -0.3020 -0.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6940 -1.2560 -0.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1840 -2.1640 0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9600 -1.7830 0.7250 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1160 -3.3070 0.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7640 -2.7090 0.2450 S 0 0 0 0 0 0 0 0 0 0 0 0 8.4600 -3.7600 -0.4120 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1090 -1.5370 -1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8430 0.7930 -1.5980 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6670 0.7350 -2.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2390 -0.3050 -2.9340 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8760 1.9240 -3.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6840 1.9910 -4.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6940 3.2320 -5.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9230 4.1500 -4.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1220 3.4920 -3.2380 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 2.0600 0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 -0.4010 0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.6620 0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4060 2.0150 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 3.2660 0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0980 -3.4760 1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8460 -4.2170 0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0900 -1.9990 -1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6990 -0.6210 -1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3270 1.5960 -1.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2570 1.1530 -4.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2820 3.4490 -6.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8180 5.1710 -4.9300 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 31 1 0 0 0 0 15 32 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 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 21 22 2 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 M END