CHEMBRIDGE-ZINC04983900 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0270 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 -2.5130 -2.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8870 -1.7150 -3.3030 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5830 -3.8350 -2.7270 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 -4.3310 -3.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 -5.3630 -4.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 -6.3990 -3.6430 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 -5.8330 -2.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -4.8210 -1.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 -7.4440 -4.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 -7.1900 -4.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5720 -8.2290 -5.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 -9.5210 -5.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -9.7700 -4.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 -8.7340 -4.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0840 -9.0030 -3.5220 N 0 3 0 0 0 0 0 0 0 0 0 0 2.5340 -10.1340 -3.4860 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6840 -8.0920 -2.9790 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.7200 -10.5340 -6.1040 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.7730 -7.9780 -6.2220 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7840 -7.4190 -5.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2410 -6.0690 -5.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8820 -6.2070 -7.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5690 -7.0260 -7.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -2.3880 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.4050 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 -3.5020 -4.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2110 -4.8000 -3.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -4.8700 -4.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9010 -5.8210 -5.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 -5.3340 -2.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 -6.6330 -1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 -5.3360 -1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -4.3150 -1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 -6.1870 -4.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 -10.7730 -4.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6330 -8.0980 -5.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3450 -7.2630 -4.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3150 -5.9350 -5.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6910 -5.2440 -5.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6570 -6.7530 -7.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7110 -5.2300 -7.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7240 -6.3720 -7.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4110 -7.5640 -8.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 23 1 0 0 0 0 16 17 2 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END