NIH-ZINC04166553 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 65 0 0 1 0 0 0 0 0999 V2000 3.1840 -9.8380 -1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4110 -8.5720 -0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9660 -7.7980 -1.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 -6.6360 -1.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 -6.2500 -0.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 -7.0240 0.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1430 -8.1880 0.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -4.7690 -0.0780 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -4.3530 1.2330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 -3.9480 -1.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5130 -5.1750 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2910 -5.3250 -1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9660 -6.7000 -1.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7880 -6.8560 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8620 -6.7670 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 -5.3980 1.2650 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9360 -4.6240 1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 -5.3570 2.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -6.3240 2.5980 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 -4.2460 3.1290 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -4.1500 4.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -2.8470 3.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 -1.8340 2.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9300 -3.0940 2.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 -0.4370 3.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 0.6890 4.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 1.1370 5.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5870 2.1700 5.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2120 2.7560 4.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9390 2.3090 3.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0380 1.2790 3.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2490 -9.6110 -1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9980 -10.5530 -0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8630 -10.2650 -2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1720 -8.1000 -2.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 -6.0310 -2.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -6.7220 1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4870 -8.7950 1.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0510 -4.5450 -1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6270 -5.2470 -2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6220 -6.7870 -2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2040 -7.4790 -1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5320 -6.0620 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2890 -7.8240 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4440 -6.9010 2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1020 -7.5450 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 -4.1440 5.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -4.9990 4.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -2.7060 4.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3290 -2.8980 2.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 -1.9010 1.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7180 -0.9570 2.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5350 -3.2440 2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5790 -2.9840 3.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0490 -0.3180 2.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 -0.4200 4.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 0.6790 6.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8000 2.5200 6.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9140 3.5630 4.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4280 2.7660 2.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 0.9320 2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 -1.7200 3.9080 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 22 62 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 23 62 1 0 0 0 0 24 53 1 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 25 56 1 0 0 0 0 25 62 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 28 58 1 0 0 0 0 29 30 2 0 0 0 0 29 59 1 0 0 0 0 30 31 1 0 0 0 0 30 60 1 0 0 0 0 31 61 1 0 0 0 0 M END