CHEMBRIDGE-ZINC00724559 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 0 0 0 0 0 0999 V2000 0.1790 1.0470 0.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -0.0110 0.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 -0.6440 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1910 -0.2520 0.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4150 -0.8930 0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6540 -1.9300 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6620 -2.3250 -0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4370 -1.6800 -0.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 -2.0610 -1.7220 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7800 -3.1310 -2.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8950 -2.5790 0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0310 -1.8620 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9660 -0.1520 0.1600 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.2170 -2.4920 0.2600 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3520 -1.7750 0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3060 -0.5610 0.3840 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6530 -2.4660 0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7100 -3.8610 0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9270 -4.4990 0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0910 -3.7600 0.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0440 -2.3790 0.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8310 -1.7260 0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7720 0.0090 0.6420 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 1.4640 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 1.8260 0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 0.6580 2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 0.5540 1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1870 -0.5870 1.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -3.1320 -1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -3.3350 -3.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 -4.0240 -2.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 -2.8510 -3.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9380 -3.5440 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2540 -3.4620 0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8020 -4.4390 0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9710 -5.5780 0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0420 -4.2660 0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9560 -1.8090 0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 17 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 18 35 1 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 23 1 0 0 0 0 M END