CHEMDIV-ZINC05008044 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 0 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 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 -1.7570 -0.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9650 -2.1870 -0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1370 -3.5340 -1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5410 -3.9460 -1.2090 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 -5.1100 -1.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1180 -5.8160 -2.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3750 -5.5330 -1.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5780 -7.1270 -2.5290 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.3080 -7.3740 -2.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0740 -6.4430 -1.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4470 -6.6580 -1.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1080 -5.8240 -0.8610 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.0580 -7.7560 -1.9340 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.3560 -8.7300 -2.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9760 -8.5740 -2.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2620 -9.5520 -3.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9190 -10.6630 -4.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2830 -10.8140 -3.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0000 -9.8620 -3.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4980 -7.9240 -1.7230 C 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 -1.6620 -1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 -2.5050 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2650 -2.2820 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5880 -1.4390 -1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8370 -3.4400 -2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5140 -4.2830 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1910 -3.3820 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6750 -5.6280 -0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9980 -4.7850 -2.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6140 -5.5490 -1.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2000 -9.4380 -3.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3700 -11.4210 -4.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7870 -11.6900 -4.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0610 -9.9900 -2.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8860 -7.0680 -1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0000 -7.9920 -2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6780 -8.8360 -1.1540 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 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 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 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 24 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 M END