IBS-ZINC02270913 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 0 0 0 0 0 0 0 0999 V2000 0.9240 1.3000 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 -0.0970 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 -0.8690 1.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -2.1650 1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 -2.7220 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8050 -1.9750 -1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 -0.6620 -1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 0.0460 -2.4160 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 -0.2210 -3.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0290 0.6960 -4.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 1.5120 -3.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 1.1330 -2.6930 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 2.6470 -4.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 2.8650 -5.8450 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.2400 -1.1750 -3.4620 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -3.1040 2.7260 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4840 -3.6410 2.6070 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -2.0790 3.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 1.3790 -0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 2.0360 -0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 1.5730 1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -0.4580 2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 -3.7310 0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 -2.4740 -1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4970 0.7920 -5.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7230 -1.1270 -4.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 3.3340 -4.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9460 -4.0850 2.6290 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 5 6 2 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 27 2 0 0 0 0 15 26 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 28 1 0 0 0 0 M CHG 1 14 -1 M CHG 1 28 -1 M END