NIH-ZINC03958847 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 1 0 0 0 0 0999 V2000 1.1140 1.2190 -1.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 -0.3060 -1.5670 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0520 -0.5900 -1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7360 -0.8440 -2.7950 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5760 -1.9200 -2.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 -0.5640 -2.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1400 -1.4680 -2.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4320 -0.9770 -2.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5520 0.3260 -2.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9700 1.0060 -2.8930 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 -0.5170 -4.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 0.2510 -5.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 0.2350 -6.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 -0.5330 -5.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 0.5620 -7.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 -0.8710 -0.3530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8630 -0.9720 0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 -0.5950 0.7830 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 -1.5410 1.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -1.6460 3.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 -2.1780 4.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 -2.6090 4.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3490 -2.5050 3.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7900 -1.9810 1.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1570 -3.1450 5.4410 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 -3.3720 6.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5820 -3.4840 5.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1560 1.5000 -1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 1.6330 -2.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 1.6090 -0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9020 -2.5060 -2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2790 -1.6020 -2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4800 0.8790 -2.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 -0.2380 -3.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 -1.5880 -4.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 -0.0170 -5.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 1.3220 -5.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6100 1.3060 -6.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0930 -0.0440 -7.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9570 -1.6040 -5.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0720 -0.2660 -4.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 1.6430 -7.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 0.2450 -8.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 0.2860 -8.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5170 -1.1720 -0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 -1.3110 3.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -2.2590 5.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3760 -2.8410 3.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3770 -1.9040 1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 -4.3750 6.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9410 -3.2710 7.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 -2.6380 6.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0510 -3.1560 4.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0580 -2.9840 6.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6980 -4.5620 5.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -0.1840 -4.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 -0.0980 -6.6170 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 56 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 11 56 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 57 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 57 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 14 56 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 15 57 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 M END