OTAVA-ZINC05374866 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 0.2960 -0.4230 0.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -1.1690 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 -1.2340 -0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0660 -0.5500 0.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5260 0.1960 1.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 0.2590 1.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5140 -0.6010 0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2190 0.2940 -0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6860 0.1960 -0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3530 -0.6980 0.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1740 1.2490 -1.1910 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2480 2.1610 -1.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5010 3.5470 -2.5540 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6370 1.6800 -1.1320 S 0 0 0 0 0 0 0 0 0 0 0 0 8.6150 1.3070 -1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9850 0.3950 -2.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1880 0.0710 -3.4860 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3090 0.0220 -2.5970 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9600 -0.8580 -3.5850 C 0 0 3 0 0 0 0 0 0 0 0 0 10.7120 -0.4710 -4.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5050 -2.3150 -3.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6270 -3.1580 -4.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7150 -3.8720 -5.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8410 -3.1420 -5.3050 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0210 -3.7040 -6.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6140 -2.5300 -4.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5110 -0.7960 -3.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8790 -0.0560 -2.4170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7810 -0.3700 1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 -1.6980 -0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6110 -1.8170 -1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1770 0.7360 2.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 0.8410 2.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0110 -1.4430 0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9400 2.3230 -1.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1460 0.9740 -0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9700 0.3590 -1.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0680 -2.8210 -2.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4490 -2.3520 -3.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1960 -1.4970 -4.1840 O 0 5 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 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 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 14 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 15 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 27 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 27 28 2 0 0 0 0 27 40 1 0 0 0 0 M CHG 1 40 -1 M END