IFLAB-ZINC01131688 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 -0.4740 1.4850 0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 -0.0170 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 -0.8000 1.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5110 -2.1770 1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 -2.7730 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 -1.9900 -1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 -0.6120 -1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 0.2410 -2.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 -4.5290 -0.1420 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.5980 -4.9840 0.7250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 -4.8230 -1.5320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -5.0920 0.4880 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0610 -4.8340 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2480 -3.6380 -0.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4450 -3.3670 -1.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -4.2870 -1.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3080 -5.5200 -0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0940 -5.7950 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9390 -7.0210 0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9560 -7.9270 0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1520 -7.6550 -0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3330 -6.4800 -0.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6300 -4.0080 -2.1490 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6460 -1.8500 -2.3060 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 -3.0310 2.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 1.8330 0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 1.9250 -0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9670 1.7850 1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 -0.3340 2.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 -2.4550 -2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 0.4330 -2.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0890 -0.2790 -3.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 1.1880 -2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 -5.6010 1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 -2.9020 -0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -7.2460 1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8340 -8.8700 1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9430 -8.3890 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2650 -6.2830 -1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2940 -3.5710 -1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -3.3060 2.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -3.9320 2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -2.4700 3.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 23 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 M END