IBS-ZINC04795831 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -0.6000 -1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 0.0700 -1.9210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -2.1040 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 -2.5980 -2.6370 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -2.1950 -3.7540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8730 -2.1730 -2.5480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4740 -4.4080 -2.5220 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9750 -4.7300 -1.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 -5.0220 -3.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 -6.5300 -3.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -6.5130 -3.3420 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7290 -6.4330 -4.5410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2450 -7.5390 -2.3970 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -4.8890 -2.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 -2.4910 -0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 -2.5070 -1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 -4.5470 -4.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2570 -4.8980 -3.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 -6.9610 -4.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 -7.0680 -2.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 -4.9980 -1.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 -4.1900 -3.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 5 21 1 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 12 25 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 M END