IFLAB-ZINC01268790 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 0 0 0 0 0 0999 V2000 0.0650 1.2440 -0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -0.0060 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 -0.5500 0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3170 0.1540 0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 1.4100 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 1.9520 -0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 2.1260 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5680 3.4700 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5120 4.0660 -0.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8620 4.2320 -0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5780 5.6670 -0.3230 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5070 6.4040 0.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6730 5.9270 1.8800 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2270 7.7820 0.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1020 8.7470 1.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8180 10.0810 1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6700 11.1360 2.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3980 12.3230 1.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3250 12.2470 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6060 10.6530 -0.4870 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0750 7.9640 -1.1750 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3910 6.2530 -1.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4450 5.5000 -3.0520 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7280 -0.5290 1.3130 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 1.6640 -1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5580 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -1.5260 1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 2.9280 -1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4290 1.6550 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4820 4.0370 0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3900 3.9120 -1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2200 8.4940 2.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 11.0450 3.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2530 13.2500 1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1190 13.0840 -0.5980 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 21 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 M END