NIH-ZINC00217107 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9170 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9300 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -5.0430 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -4.7540 -1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6350 -5.6310 -1.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5350 -5.3340 -2.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2080 -4.5020 -3.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7030 -5.9920 -2.3770 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5770 -5.7030 -3.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0340 -6.0540 -3.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4780 -7.1400 -4.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1540 -7.7940 -4.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1880 -6.5870 -4.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -5.5350 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6750 -3.7040 -1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 -4.9640 -2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3450 -6.6810 -1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1670 -5.4210 -0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9650 -6.6570 -1.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5020 -4.6490 -3.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0900 -6.4400 -2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6650 -5.1720 -3.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1160 -7.8750 -3.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9970 -6.6890 -5.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8020 -8.5180 -3.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2760 -8.2640 -5.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3370 -6.0460 -5.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1530 -6.9180 -4.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 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 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 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 27 1 0 0 0 0 7 28 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 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 M END