NIH-ZINC04003639 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 1.4720 2.2980 0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8840 0.9540 0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 0.4970 -1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 -0.0860 1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 0.3010 2.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3050 1.3100 2.6030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 -0.4730 3.6960 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1970 -0.0660 4.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 0.6320 4.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0170 1.0360 5.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 0.7350 7.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 0.0400 7.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -0.3680 6.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5440 -1.0590 6.1710 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0720 -1.3340 7.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2960 1.7840 5.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0060 2.2340 7.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1130 2.8680 6.5220 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1590 3.5010 7.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1330 4.0490 6.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0430 3.9520 4.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0260 3.3380 4.4060 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0560 2.7910 5.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9510 2.1400 4.8230 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5440 2.1900 0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 3.0390 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 2.6240 1.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 1.0620 0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 0.3890 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 -0.4610 -1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3810 1.2380 -1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 -1.0630 1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1960 -0.1300 1.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 -1.3130 3.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8370 0.8640 3.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9220 1.0480 8.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 -0.1920 8.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 -0.3960 7.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3540 -1.9270 8.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0050 -1.8890 7.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7440 2.1120 8.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2100 3.5640 8.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9700 4.5540 6.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8140 4.3860 4.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 M END