CHEMDIV-ZINC06938006 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 -1.3900 0.9800 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 -0.2820 0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 -0.7430 1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 -1.9090 0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 -2.6030 -0.2640 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.0870 -1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 -0.9500 -1.0880 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 -2.9350 -2.7780 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 -4.2590 -2.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 -0.0240 2.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 1.1960 2.4110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -0.7950 3.5630 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5330 -0.1980 4.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 -1.2100 5.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 -0.6090 7.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 0.9460 6.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7830 0.3520 5.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 0.3970 9.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 0.5600 9.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 -0.5660 10.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1880 -0.4170 10.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7180 0.8550 11.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0010 1.9800 10.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7530 1.8360 10.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7330 1.8550 0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0640 1.0660 -0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0070 0.9860 1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5730 -2.3380 1.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 -4.9090 -1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1350 -4.8640 -3.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 -3.8460 -2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 -1.7920 3.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 0.6370 4.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 -2.1000 5.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 -1.5560 5.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 -1.3740 7.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 0.2310 7.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 1.8090 6.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5680 1.2430 7.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 1.1210 4.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5350 -0.4480 5.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 1.3340 9.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 -0.3430 9.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 -1.5700 10.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7470 -1.2940 11.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6890 0.9700 11.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4150 2.9730 10.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 2.7300 9.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.0940 7.7510 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.6540 -0.8870 7.7800 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 9 31 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 32 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 15 49 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 49 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END