NIH-ZINC04057401 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 63 0 0 1 0 0 0 0 0999 V2000 -0.6070 1.6170 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 0.1910 0.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -0.3740 -1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 0.4270 -2.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 -0.1490 -3.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 -1.5230 -3.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7590 -2.3290 -2.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -1.7590 -1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 -2.5720 -0.1050 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -3.3750 0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 -4.1890 1.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9250 -4.2470 0.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 -3.4330 -0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 -5.9040 2.2770 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7120 -5.2790 3.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4450 -6.8070 1.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9990 -7.5910 2.8590 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4700 -8.3330 2.6930 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.7070 -9.0310 3.9080 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3580 -7.3520 2.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2970 -9.5600 1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4320 -10.8980 1.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2970 -11.8610 0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0260 -11.4840 -0.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8900 -10.1470 -0.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0310 -9.1830 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9040 -7.8750 -0.1790 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.4290 -13.1690 1.0860 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.1970 -6.7550 2.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 -6.9860 4.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 -7.7740 4.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8680 -8.3010 3.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 -8.0600 2.3720 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -7.3190 1.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 2.0430 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1960 1.9600 -0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 1.9360 0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 1.5010 -2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 0.4770 -3.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6840 -1.9680 -4.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -3.4030 -2.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 -4.0510 -0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 -2.7150 0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 -4.8080 2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 -3.5130 2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 -3.5710 1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7210 -4.9070 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1890 -2.8150 -0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 -4.1100 -1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2320 -6.1930 1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0440 -7.4800 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5040 -7.6760 3.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6430 -11.1910 2.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9200 -12.2360 -1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6790 -9.8530 -1.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 -6.5610 4.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 -7.9750 5.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6930 -8.9160 3.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 -7.1480 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 -5.0500 1.1870 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 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 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 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 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 11 60 1 0 0 0 0 12 13 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 12 60 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 29 1 0 0 0 0 14 60 1 0 0 0 0 16 17 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 17 18 1 0 0 0 0 17 52 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 24 25 2 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 56 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 32 33 2 0 0 0 0 32 58 1 0 0 0 0 33 34 1 0 0 0 0 34 59 1 0 0 0 0 M END