IFLAB-ZINC02711707 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9170 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9300 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -5.0430 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3420 -5.3030 -1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6900 -5.7480 -0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4680 -5.6890 0.8570 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2580 -5.3030 1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6310 -5.1210 2.7430 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0900 -5.6100 3.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7790 -5.5300 5.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0070 -4.3540 5.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7220 -4.2790 7.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 -5.3800 7.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9790 -6.5580 7.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2700 -6.6330 5.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 -7.9400 8.0060 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 -5.2860 9.5660 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4650 -4.3950 -1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9090 -6.1000 -1.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4840 -5.0620 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9290 -6.7660 -0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9170 -4.9400 3.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3660 -6.6330 3.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4080 -3.4940 5.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9000 -3.3600 7.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 -7.5520 5.2880 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 30 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 41 1 0 0 0 0 M END