NIH-ZINC02972763 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 66 0 0 1 0 0 0 0 0999 V2000 0.0220 1.4700 -2.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 0.0060 -1.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 -0.3840 -0.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 -1.7280 -0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 -2.6810 -1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 -2.2910 -2.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -0.9480 -2.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -4.3940 -0.8070 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 -5.0840 -1.9920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 -4.4950 0.4120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 -4.8530 -0.4660 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4140 -4.8270 -1.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6350 -5.6310 -1.0670 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3600 -6.6800 -0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7300 -5.5040 -2.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1030 -4.2560 -2.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1150 -4.1870 -3.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7130 -5.3550 -3.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3310 -6.5250 -3.4760 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3690 -6.6290 -2.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2420 -5.9090 0.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6570 -5.3880 2.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0220 -3.9680 1.9960 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8920 -3.1730 1.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4770 -3.6940 0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4770 -3.4750 3.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6460 -3.5020 4.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0970 -3.0140 5.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3760 -2.4990 5.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2100 -2.4700 4.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7630 -2.9510 3.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5800 -2.9180 2.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.8850 -2.3660 2.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 1.8120 -2.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 1.6200 -3.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3700 2.0390 -1.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 0.3610 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -2.0320 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1860 -3.0360 -3.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 -0.6430 -3.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 -5.1390 0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7100 -3.7960 -1.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0070 -5.2670 -2.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6180 -3.3600 -2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4320 -3.2320 -3.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5020 -5.3100 -4.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0800 -7.6040 -2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9440 -6.9540 0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0820 -5.8230 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5140 -5.9580 2.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8260 -5.5000 2.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1910 -2.1280 1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0530 -3.2590 2.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3080 -3.5820 -0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6210 -3.1240 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6470 -3.9030 4.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4500 -3.0350 6.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7240 -2.1200 6.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2080 -2.0670 4.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4210 -2.9470 3.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7990 -1.3320 2.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4320 -2.4000 1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1130 -5.1130 0.2220 N 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 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 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 39 1 0 0 0 0 7 40 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 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 63 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 46 1 0 0 0 0 19 20 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 21 63 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 25 63 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 56 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 29 30 2 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 30 59 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 33 62 1 0 0 0 0 M END