IBS-ZINC02228397 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 23 0 0 1 0 0 0 0 0999 V2000 -0.0310 1.4670 0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1950 0.0540 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 -0.3260 0.2230 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 1.3980 0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2450 2.2650 0.0590 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1430 3.7960 -1.5380 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1870 3.6190 -1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5040 4.8220 -0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 3.8880 0.9030 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1700 4.1900 -3.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5790 3.2750 -3.8140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 1.9080 -0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 1.4260 1.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 -0.6640 0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -0.0030 -1.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4920 1.4760 1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3650 1.6310 0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 5.6680 -0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 5.2020 -1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3550 2.5470 -1.3760 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8270 1.8030 -1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8300 5.3770 -3.3040 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 2 3 1 0 0 0 0 2 14 1 0 0 0 0 2 15 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 4 17 1 0 0 0 0 5 9 1 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 6 20 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 8 19 1 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 20 21 1 0 0 0 0 M CHG 1 22 -1 M END