IBS-ZINC03213167 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 0 0 0 0 0 0 0 0999 V2000 0.3720 1.4240 -0.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 0.0480 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -0.6790 -0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 -0.0220 0.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0360 1.3560 0.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 2.0920 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 3.5580 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 4.2240 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 3.6620 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5780 2.4660 -0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3380 4.5530 -0.1820 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 5.8540 -0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1420 7.1530 -0.3910 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 5.9750 -0.2010 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7370 4.1190 -0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2660 4.0680 1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5490 4.3650 2.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8690 -0.7390 1.5140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 -2.0350 -0.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 1.9880 -1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 -0.4660 -1.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6700 1.8660 1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0920 4.1060 0.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3280 4.8230 -0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8040 3.1280 -0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7480 -0.9050 1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8970 -2.3860 -0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5350 3.6940 1.4370 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8300 3.6780 2.3580 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 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 2 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 15 25 1 0 0 0 0 16 17 2 0 0 0 0 16 28 1 0 0 0 0 18 26 1 0 0 0 0 19 27 1 0 0 0 0 28 29 1 0 0 0 0 M END