IBS-ZINC04023862 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 0 0 0 0 0999 V2000 0.6630 0.0770 -1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 -1.2430 -1.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 -1.3860 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5650 -2.7010 0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9630 -2.9870 1.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1370 -1.9620 2.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9170 -0.6420 2.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5170 -0.3560 1.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5810 -2.3250 4.1620 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4210 -3.4060 4.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7430 -1.7040 5.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 -0.2740 5.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 0.5150 5.8870 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4980 0.0350 5.5160 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4400 -0.9170 5.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0330 -2.0280 4.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0190 -3.0530 3.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6440 -4.0790 3.3910 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4890 -2.7890 4.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7060 -1.9970 5.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9090 -0.6970 5.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8760 1.3710 5.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3610 1.9480 7.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 3.2460 7.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6050 4.0070 6.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1060 3.4340 5.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7440 2.1370 5.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9980 5.4110 7.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 5.8710 8.1640 O 0 5 0 0 0 0 0 0 0 0 0 0 1.5560 0.7100 -1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 0.0160 -2.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 0.5170 -1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 -3.5140 -0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1470 -4.0240 2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 0.1990 3.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 0.6850 0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -1.7460 5.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8770 -2.2670 6.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0120 -3.7480 4.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8730 -2.2530 3.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3920 -2.5910 6.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7710 -1.7770 5.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3620 -0.0400 4.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0170 -0.2200 6.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6810 1.3930 7.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3130 3.6670 8.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7780 4.0100 4.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1180 1.7590 4.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8200 6.0180 6.3430 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 16 2 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 2 0 0 0 0 M CHG 1 29 -1 M END