IBS-ZINC04655872 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1240 -0.9400 -1.4230 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9000 -0.0060 -2.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2810 -0.2300 -3.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8680 -1.4170 -4.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -1.6400 -5.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1080 -2.3040 -3.3270 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8230 -3.1220 -3.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7470 -2.0670 -2.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0660 -2.8830 -1.4620 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0770 0.7140 -4.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3570 1.5280 -3.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3440 0.5470 -4.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2810 1.1240 -1.4330 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -0.1100 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -1.6640 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8230 1.7160 -1.9720 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 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 9 10 2 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 17 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 15 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 20 28 1 0 0 0 0 M END