CHEMBRIDGE-ZINC01157716 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.0220 1.3500 0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -0.0210 0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -0.6910 0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 0.0140 0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 1.3920 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 2.0550 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9450 -0.8360 0.2020 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1480 0.4980 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5400 -0.0770 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1020 -0.4990 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3780 -1.0260 -1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0980 -1.1330 -0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5310 -0.7080 1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2560 -0.1770 1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3900 -1.6670 -0.1010 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1920 -1.4670 -1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8300 -0.7430 -2.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5130 -2.1270 -1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3470 -1.9220 -2.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5780 -2.5410 -2.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9880 -3.3640 -1.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1670 -3.5720 -0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9360 -2.9540 -0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3110 -4.0260 -1.4160 N 0 3 0 0 0 0 0 0 0 0 0 0 17.0350 -3.8450 -2.3780 O 0 0 0 0 0 0 0 0 0 0 0 0 16.6740 -4.7510 -0.5070 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9680 1.8700 0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 -0.5690 0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 -1.7610 0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2860 1.9430 -0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 3.1250 -0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9490 0.9890 -1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0620 1.2240 0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5410 -0.4160 -2.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8160 -1.3560 -2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0880 -0.7900 2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8160 0.1570 2.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7100 -2.1810 0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0280 -1.2800 -3.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2240 -2.3830 -3.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4920 -4.2160 0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2980 -3.1130 0.6690 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 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 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END