NIH-ZINC04040749 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 65 0 0 1 0 0 0 0 0999 V2000 1.0280 1.0910 -2.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -0.1900 -1.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 -1.2920 -1.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0770 -1.8940 -0.6990 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8970 -2.9880 -0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5760 -3.5260 -1.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3750 -4.6590 -1.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4980 -5.2620 -0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8200 -4.7370 0.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0300 -3.5890 0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8990 -5.3730 2.1210 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3330 -4.7860 2.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4320 -6.8120 2.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1960 -7.2930 2.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0650 -6.4200 1.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -6.2680 0.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 -5.3790 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 -4.6480 1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 -4.8130 2.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4060 -5.7000 2.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2230 -3.5260 0.6080 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.8990 -8.6270 2.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6030 -7.6390 2.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7150 -8.8530 2.5510 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7270 -6.7090 2.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8130 -7.0590 3.2630 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2660 -5.4310 2.6210 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0540 -4.2470 2.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7360 -3.7280 4.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6270 -2.5640 6.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7870 -1.7170 6.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8960 -0.4970 6.1370 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1520 -0.7410 4.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0150 -1.5430 4.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9480 1.4270 -2.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2610 1.8380 -1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -0.4710 -1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 -2.0230 -2.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7490 -0.8980 -2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5050 -3.0930 -2.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9010 -5.0780 -2.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1250 -6.1460 -0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4840 -3.1590 1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 -6.8190 -0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 -5.2510 -1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 -4.2530 3.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -5.8170 3.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -8.7550 1.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1130 -4.5240 2.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 -3.4820 2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8040 -3.1520 4.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6380 -4.5680 5.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5770 -3.5250 6.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6730 -2.0330 6.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6130 -1.4580 7.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7370 -2.2620 6.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2410 0.2300 4.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1120 -1.2580 4.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0620 -1.0080 4.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2480 -1.7830 3.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8400 -2.8530 4.8690 N 0 3 0 0 0 0 0 0 0 0 0 0 7.7220 -3.3830 4.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 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 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 27 1 0 0 0 0 13 14 2 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 29 61 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 61 1 0 0 0 0 31 32 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 33 57 1 0 0 0 0 33 58 1 0 0 0 0 34 59 1 0 0 0 0 34 60 1 0 0 0 0 34 61 1 0 0 0 0 61 62 1 0 0 0 0 M CHG 1 61 1 M END