CHEMBRIDGE-ZINC01210771 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 35 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3820 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0050 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -0.6880 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0220 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 1.4260 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 2.0970 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 1.8360 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0190 2.7520 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4720 0.7090 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7070 -0.3550 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2340 0.6890 -0.0500 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5280 -1.0970 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0110 -1.3620 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7930 -0.4350 -0.0920 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4690 -2.6300 -0.0890 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8420 -2.8770 -0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7580 -2.0140 0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1110 -2.2600 0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5560 -3.3650 -0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6460 -4.2270 -1.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2890 -3.9890 -0.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2070 -5.6130 -1.9130 Cl 0 0 0 0 0 0 0 0 0 0 0 0 14.2590 -3.6700 -0.5920 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9050 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5540 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -1.7680 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 3.1770 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0940 -1.5400 0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0660 -1.5380 -0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8480 -3.3710 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4120 -1.1510 0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8240 -1.5880 0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5790 -4.6640 -1.3630 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 9 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 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 33 1 0 0 0 0 M END