CHEMBRIDGE-ZINC04998253 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 62 0 0 1 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 3.3360 -5.3420 -3.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 -6.3810 -2.6670 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1700 -5.8130 -1.4270 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 3.6220 -7.4090 -2.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8030 -7.1310 -1.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7000 -8.1530 -1.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4140 -9.4540 -1.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2370 -9.7260 -2.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3390 -8.7100 -2.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 -9.0070 -3.5000 N 0 3 0 0 0 0 0 0 0 0 0 0 1.8270 -10.1470 -3.8470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2870 -8.1110 -3.7400 O 0 5 0 0 0 0 0 0 0 0 0 0 6.2860 -10.4510 -1.5820 F 0 0 0 0 0 0 0 0 0 0 0 0 6.8910 -7.8770 -0.7650 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6220 -7.4010 0.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9420 -7.2480 1.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8390 -6.2530 0.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0640 -6.7480 -0.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7120 -6.9150 -1.5110 C 0 0 3 0 0 0 0 0 0 0 0 0 7.2010 -5.9530 -1.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9310 -7.4300 -2.9360 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 1.5480 -4.8170 -4.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7410 -3.4990 -4.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7790 -5.8020 -4.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1120 -4.8320 -2.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7670 -6.6130 -0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9620 -5.2960 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -4.3120 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 -5.3550 -2.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0240 -6.1210 -1.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0160 -10.7360 -2.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1160 -6.4360 0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9860 -8.1200 1.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7430 -6.8800 2.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4420 -8.2150 1.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3560 -5.2760 0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7970 -6.1740 1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6670 -6.0220 -1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5820 -7.7070 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9680 -7.5480 -3.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5400 -6.7150 -3.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4420 -8.3920 -2.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 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 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 9 43 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 44 1 0 0 0 0 11 45 1 0 0 0 0 12 46 1 0 0 0 0 12 47 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 48 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 49 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 28 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 30 58 1 0 0 0 0 30 59 1 0 0 0 0 30 60 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END