NIH-ZINC04039035 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 63 0 0 1 0 0 0 0 0999 V2000 -1.0330 1.0060 -0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 -0.2490 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -0.7460 1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -1.9390 0.8200 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4260 -2.8800 1.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 -3.9720 1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9140 -4.1430 -0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 -3.2410 -1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6990 -2.0870 -0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -1.0930 -1.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -0.2700 2.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 0.4360 3.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 0.9670 4.4580 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8220 0.1560 5.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4330 1.3470 4.6910 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2260 1.2920 3.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4120 1.5540 3.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 0.7660 2.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7630 0.6360 1.3150 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9580 1.7260 5.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7570 0.5810 6.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6710 -0.0150 8.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6250 0.5340 9.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9010 1.0220 10.3210 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0260 2.0940 9.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9860 1.6350 8.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 2.1200 4.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 1.9140 5.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0570 2.9730 5.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6700 4.2200 4.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 4.4670 4.3540 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 3.4160 4.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 -0.5710 3.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 1.8730 -0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2730 1.1020 -1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9710 1.0260 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 -2.7000 2.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4790 -4.7300 1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 -5.0270 -0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -3.3680 -2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6160 2.5900 5.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 2.0400 6.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0960 -0.1720 7.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3870 0.0890 5.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2170 -0.3350 7.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0680 -0.8400 8.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2890 -0.2630 9.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2530 1.3370 8.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5220 2.4330 10.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6180 2.9330 9.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3650 0.8250 9.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3610 2.4720 8.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 0.9240 5.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0330 2.8270 5.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3300 5.0780 5.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 3.6660 3.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6900 -0.9940 2.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6950 1.0800 7.7080 N 0 3 0 0 0 0 0 0 0 0 0 0 5.2670 1.8360 7.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 27 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 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 21 58 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 58 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 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 51 1 0 0 0 0 26 52 1 0 0 0 0 26 58 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 31 2 0 0 0 0 30 55 1 0 0 0 0 31 32 1 0 0 0 0 32 56 1 0 0 0 0 33 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END