NIH-ZINC04199797 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 0.1730 1.4780 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 -0.0510 -0.1300 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8540 -0.4000 -0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -0.5330 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 -1.9870 1.2990 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 -2.5340 1.1650 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3400 -2.1830 1.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3150 -2.0520 -0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 -0.5990 -0.2680 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4150 0.4050 -0.5310 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 -0.3440 -0.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0910 1.6450 0.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 0.7140 -2.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2350 -0.1190 -3.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2980 0.1210 -4.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6140 1.1980 -4.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8690 2.0310 -4.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 1.7910 -2.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6730 1.4360 -6.3210 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 2.5620 -6.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 -4.0630 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9280 -2.9900 1.5580 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 -4.2310 0.9480 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0890 -2.2430 1.2230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0130 -3.2940 3.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3330 -4.3660 3.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 -4.6070 5.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 -3.7720 6.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 -2.6970 5.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7650 -2.4640 4.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2130 -4.0060 7.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0040 -3.1050 8.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 1.8800 -0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 1.8130 -1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 1.8290 0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8910 -0.3000 1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 -0.0400 2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 -2.5460 -0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 -2.2850 -0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7670 -0.9570 -2.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8780 -0.5290 -5.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 2.8700 -4.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2390 2.4420 -2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 2.6380 -7.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 3.4700 -6.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 2.4380 -6.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -4.3960 2.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6750 -4.4650 1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 -4.4170 0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7490 -5.0160 3.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -5.4440 5.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4140 -2.0450 6.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3000 -1.6300 3.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0350 -3.1290 7.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6080 -2.0940 8.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9710 -3.4050 9.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 21 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 31 32 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 M END