CHEMDIV-ZINC02959398 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 63 0 0 1 0 0 0 0 0999 V2000 -0.4520 1.5630 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 1.2510 2.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3510 1.4760 3.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5800 3.5140 2.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1080 3.2350 1.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 3.2240 5.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 4.6890 5.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 4.9670 7.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 6.3800 7.5000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9660 7.2750 7.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9850 6.9390 6.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7470 8.7040 7.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8610 9.5200 7.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7010 10.8800 7.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 11.4580 8.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3210 10.6250 7.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 9.2640 7.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 12.8050 8.3700 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8910 13.7060 9.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5770 14.9780 9.1430 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5570 15.6560 10.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4540 15.8820 9.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 16.9450 10.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2830 17.1440 11.9920 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.3280 18.0480 11.5600 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5540 17.3380 13.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9360 15.4570 11.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8710 14.7350 11.1730 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9810 14.5790 11.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1720 13.2220 10.2660 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 0.4890 -0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 2.0560 -0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 1.9260 -0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 1.7000 2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 0.1700 2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 0.9610 3.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 1.1400 4.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6560 4.5930 3.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5450 3.0400 3.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8770 3.6070 0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 3.8060 1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 2.5900 6.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9940 2.9190 5.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 4.9600 5.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3160 5.3350 5.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1160 4.6400 7.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 4.4350 7.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 6.7000 8.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8660 9.1070 7.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5970 11.4800 8.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 11.0340 7.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 8.6770 7.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3570 13.1950 7.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 16.8610 11.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1450 17.8050 9.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0420 15.0880 12.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9050 15.4790 11.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 1.8000 1.2840 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 2.9610 3.9520 N 0 3 0 0 0 0 0 0 0 0 0 0 0.3290 3.4280 3.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 58 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 58 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 59 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 4 59 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 5 58 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 6 59 1 0 0 0 0 7 8 1 0 0 0 0 7 44 1 0 0 0 0 7 45 1 0 0 0 0 8 9 1 0 0 0 0 8 46 1 0 0 0 0 8 47 1 0 0 0 0 9 10 1 0 0 0 0 9 48 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 17 2 0 0 0 0 13 14 2 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 14 50 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 51 1 0 0 0 0 17 52 1 0 0 0 0 18 19 1 0 0 0 0 18 53 1 0 0 0 0 19 20 2 0 0 0 0 19 30 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 28 1 0 0 0 0 23 24 1 0 0 0 0 23 54 1 0 0 0 0 23 55 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 59 60 1 0 0 0 0 M CHG 1 59 1 M END