CHEMBRIDGE-ZINC01110557 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 1.7390 2.2850 4.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 1.1220 3.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 0.2070 2.9990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -0.8900 2.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -1.8190 2.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 -2.9340 1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 -3.1240 0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7410 -2.1940 0.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5210 -1.0770 1.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9470 -4.2550 -0.1480 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 -5.4310 0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -5.4920 1.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6940 -6.6710 -0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -7.8320 -0.1210 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2180 -7.5380 -0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 -9.0280 -1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 -9.1700 -1.9940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9830 -9.9420 -0.7430 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7730 -9.8280 0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9290 -10.5800 0.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6940 -10.4560 1.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3120 -9.5870 2.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1600 -8.8310 2.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3920 -8.9480 1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -8.1860 1.2510 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -7.7930 2.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 -7.9660 3.4380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8270 -7.1520 2.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 -7.5520 1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8640 -6.9500 0.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2910 -5.9520 1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 -5.5500 2.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 -6.1490 2.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9550 -4.4810 3.6660 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.0390 -3.9550 3.4870 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2520 -4.1260 4.5960 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8890 2.7980 3.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 1.9010 5.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5690 2.9830 4.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 1.5060 2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0150 0.6080 3.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 -1.6710 2.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 -3.6570 1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 -2.3420 0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3090 -0.3510 1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 -4.1920 -0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4880 -6.4890 -1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 -6.9220 -0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1210 -10.6860 -1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2310 -11.2610 -0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5940 -11.0420 1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9130 -9.4980 3.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8630 -8.1530 3.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3070 -8.3310 0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4930 -7.2590 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2510 -5.4830 1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6450 -5.8380 3.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 44 1 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 46 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 47 1 0 0 0 0 13 48 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 25 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 49 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 22 23 2 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 31 32 2 0 0 0 0 31 56 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 33 57 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 M CHG 1 34 1 M CHG 1 36 -1 M END