CHEMBRIDGE-ZINC00311461 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 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 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9700 -0.1110 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 -2.0360 0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0240 -2.6550 1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 -4.0330 1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3780 -4.7920 0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7680 -4.1740 -0.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7900 -2.7960 -0.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -0.1370 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2030 0.5990 -1.3720 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4530 0.6880 -2.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5210 0.0080 -3.3130 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7500 -0.4660 -2.5060 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5750 1.4210 -3.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7090 1.4270 -4.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7540 2.1100 -5.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6680 2.7880 -4.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5410 2.7860 -3.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5020 2.1020 -2.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7870 3.5200 -5.1600 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.9020 3.5230 -6.3720 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5940 4.1180 -4.4700 O 0 5 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 0.5120 -0.3560 -0.8950 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 -2.5150 -2.0610 1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 -4.5160 2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -5.8690 0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 -4.7670 -1.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 -2.3130 -1.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9950 0.8980 -5.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8590 2.1140 -6.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2570 3.3180 -2.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4060 2.0970 -1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 11 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END