CHEMDIV-ZINC05604429 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 44 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2050 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0330 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4260 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 2.0920 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6990 -0.6890 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9100 -0.1150 -0.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6570 -3.1190 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8400 -1.0450 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2270 -2.2490 -0.0590 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8470 -1.9950 -0.0390 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5800 -0.7680 -0.0740 S 0 0 0 0 0 0 0 0 0 0 0 0 7.6100 0.9940 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8310 1.6950 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1920 1.3180 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9200 2.3990 -0.0890 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0910 3.5270 -0.0760 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7920 3.1030 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6090 3.7130 -0.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4940 3.0150 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4800 1.6940 -0.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5190 4.8610 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6760 5.2200 0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0950 6.5360 0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3640 7.4960 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2110 7.1420 -0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7900 5.8270 -0.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9830 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5660 0.3050 -0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5520 3.5430 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2470 4.4700 1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9940 6.8150 1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6930 8.5240 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6420 7.8940 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8920 5.5500 -1.2890 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 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 1 0 0 0 0 7 12 2 0 0 0 0 8 10 2 0 0 0 0 9 11 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 22 2 0 0 0 0 15 16 1 0 0 0 0 15 19 2 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 36 1 0 0 0 0 25 26 1 0 0 0 0 25 37 1 0 0 0 0 26 27 2 0 0 0 0 26 38 1 0 0 0 0 27 28 1 0 0 0 0 27 39 1 0 0 0 0 28 40 1 0 0 0 0 M END