CHEMBRIDGE-ZINC01050271 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 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 0.7450 -0.5130 1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -0.0240 2.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 0.3850 3.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4880 -0.0700 2.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 0.1150 3.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6580 0.0780 3.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2500 -0.1430 2.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4720 -0.3320 1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0910 -0.3020 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 -0.4990 0.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6030 -0.1750 2.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3480 0.0260 3.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8220 -0.0420 2.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1980 -0.2440 1.8270 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8070 0.1350 4.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3780 0.3670 5.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3060 0.5320 6.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6600 0.4690 6.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0920 0.2390 4.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1760 0.0780 3.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5410 0.1720 4.4860 N 0 3 0 0 0 0 0 0 0 0 0 0 -13.3510 0.3190 5.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.9230 -0.0300 3.3470 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.6990 0.3280 4.7230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -0.4980 -1.2570 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 0.7750 -1.6030 1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 -0.1130 1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2750 0.2210 4.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9450 -0.5050 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0900 -0.7490 3.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1090 1.0040 3.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3230 0.4160 5.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9770 0.7120 7.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3820 0.5990 6.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5140 -0.0970 2.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5410 1.2610 4.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -0.1210 -1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -1.5880 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 -0.1370 -2.1400 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 12 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 41 1 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END