IFLAB-ZINC04291859 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7890 -1.2300 0.9190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -0.4890 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0540 -0.6000 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 -0.2970 0.1770 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7830 -1.0990 2.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2860 -1.1290 2.1140 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4970 -1.7090 1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0380 -1.6910 3.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8660 -2.8180 3.7120 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8980 -0.8490 3.8450 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0500 0.4120 3.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8680 1.3400 3.7840 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6240 1.0970 4.8000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4380 2.0200 5.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2950 1.7440 6.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1850 2.6130 6.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7870 1.9340 8.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2460 0.6990 8.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3420 0.5890 7.0930 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9430 0.5650 1.9530 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -0.7310 1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 -0.4340 3.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 -2.1040 2.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4240 -1.1260 4.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4760 2.9850 4.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3880 3.6260 6.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5410 2.3260 8.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4960 -0.0730 8.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2520 -0.2070 -0.9840 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1490 -0.5660 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 24 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 32 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 33 1 0 0 0 0 21 22 2 0 0 0 0 21 34 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 36 37 1 0 0 0 0 M END