IBS-ZINC00138428 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 0 0 1 0 0 0 0 0999 V2000 0.2700 0.8800 1.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -0.1810 0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 -0.4840 -0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2210 0.2700 -0.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4260 1.3620 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4350 1.6400 1.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 2.2230 -0.0090 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2210 2.0830 -0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6140 4.3130 0.6090 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3830 4.2760 -0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0670 3.5350 1.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8340 1.8000 1.3440 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3100 5.8100 0.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7990 6.4200 -0.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2250 -0.1100 -1.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8910 -1.2350 -2.6020 F 0 0 0 0 0 0 0 0 0 0 0 0 3.3820 0.8660 -2.8450 F 0 0 0 0 0 0 0 0 0 0 0 0 4.4660 -0.3500 -1.4020 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 1.1210 1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 -0.7730 0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8550 -1.3210 -1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 2.4690 1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1160 3.7240 2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4550 3.7390 2.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3780 3.6460 0.1280 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0960 4.0730 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6380 6.2570 2.0030 O 0 5 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 19 1 0 0 0 0 2 3 2 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 4 15 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 25 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 9 25 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 25 26 1 0 0 0 0 M CHG 1 27 -1 M END