IFLAB-ZINC04138250 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 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 1.1500 3.5920 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 4.0870 1.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 3.2940 2.3510 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 5.4110 1.6880 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 5.8910 3.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 7.3980 3.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 8.0700 3.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 9.4470 3.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 10.1740 3.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 9.4880 3.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3050 8.0920 3.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3200 10.5200 3.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6960 11.7130 3.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3430 11.5220 3.1000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 12.2310 3.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4220 13.0390 3.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8790 12.7940 3.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4650 11.6630 2.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8150 10.3350 3.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -2.1590 -0.0200 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1820 -2.7820 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 -2.7540 -0.0340 O 0 5 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 3.3380 -0.4990 -0.0320 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 2.0300 3.9710 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 3.9460 -0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 6.0450 0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 5.5130 3.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 5.5370 3.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 7.5080 3.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 9.9610 3.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2450 7.5610 3.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3910 13.4770 2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9490 13.7130 3.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4580 13.7040 3.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9180 12.5160 4.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2660 11.8580 1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5420 11.6060 2.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1590 10.0470 4.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0810 9.5620 2.3410 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END