IBS-ZINC05350767 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 -0.0220 1.0100 -0.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -0.3710 -0.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 -0.9050 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1050 -0.0280 0.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8750 1.3440 0.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 1.8760 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 3.2780 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 4.0300 -0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 3.5820 -1.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 5.4840 -0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 6.1240 -0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 7.8220 -0.2320 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7940 7.7440 -0.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 6.4500 -0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7410 6.1590 -0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5930 7.3530 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0840 8.6730 -0.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6450 8.9730 -0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1670 -0.5240 1.3710 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 -2.3740 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6140 -2.6700 0.6690 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8620 1.3730 -1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 -1.0300 -1.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5410 1.9760 1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 3.7770 0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0200 5.6860 -0.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9890 5.9160 -1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9940 5.2870 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6370 7.1890 -0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5720 7.4220 1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1280 8.6130 -1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7390 9.4980 -0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 9.3140 0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2390 9.7870 -0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1380 -1.5290 1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 -3.1660 -0.7110 O 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 2 0 0 0 0 M CHG 1 21 -1 M END