IFLAB-ZINC02712484 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 0 0 0 0 0 0999 V2000 7.0100 0.6490 -2.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0400 -0.2630 -1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8880 -0.9300 -1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6990 -0.6850 -1.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6680 0.2310 -2.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8300 0.8950 -3.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3960 0.5300 -3.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 -0.6100 -3.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 -0.9140 -1.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5410 -1.3780 -1.3300 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6210 -2.4530 -0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7050 -2.8940 -0.2030 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3630 -3.1060 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7960 -4.4160 1.1630 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 -4.9910 1.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -4.4170 1.0320 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5020 -4.6830 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 -4.8220 1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1770 -4.2290 0.7530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2720 -5.8670 2.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 -6.4460 2.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0650 -5.9880 2.4520 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 -7.4890 3.7100 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5580 -6.3240 2.5740 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5220 -5.4420 2.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3120 -4.2470 2.8090 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8230 -5.9230 3.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8810 -5.1420 3.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9120 -6.0140 4.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4440 -7.2720 3.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1860 -7.2140 3.5270 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9110 1.1740 -2.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9640 -0.4530 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9100 -1.6430 -0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8120 1.6080 -3.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9610 1.4530 -3.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6230 0.6520 -4.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -0.3140 -3.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7570 -1.4980 -3.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9410 -0.0110 -1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4900 -1.6930 -1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7440 -2.3610 0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8100 -3.5340 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 -7.8200 3.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 -7.8860 4.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7510 -7.2750 2.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9180 -4.0620 3.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8940 -5.7310 4.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9940 -8.1770 4.1980 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 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 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 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 22 2 0 0 0 0 16 18 2 0 0 0 0 17 19 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 29 30 2 0 0 0 0 29 48 1 0 0 0 0 30 31 1 0 0 0 0 30 49 1 0 0 0 0 M END