NIH-ZINC04019701 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 0.4690 0.4770 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 -1.0220 -0.1140 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0530 -1.7900 0.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 -1.2200 1.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9180 -1.9310 2.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5610 -3.2180 2.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 -3.8050 2.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -3.0840 1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 -3.6740 0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 -4.8650 0.7960 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 -2.8290 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4890 -3.3840 -0.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 -2.6140 -1.4000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4460 -1.1340 -1.1080 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8130 -0.9730 -0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9870 -0.6800 -1.1460 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5360 -0.9800 -2.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 -1.3400 0.0150 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6100 -0.9380 0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9240 0.7420 -1.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2810 -0.2760 -2.0390 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0350 0.7730 -1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0200 -0.6250 -3.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0880 0.2320 -4.3330 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6850 -1.9990 -3.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4740 -2.9300 -2.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1520 -4.1770 -3.2360 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5980 -2.3850 -5.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5960 -2.1280 -5.8970 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6290 -3.0230 -5.8460 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0570 0.0650 -0.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5520 0.0800 -2.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8150 -3.0670 -0.9350 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5870 -4.7290 -0.6490 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 -5.0700 2.5280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 -1.3740 -1.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5370 0.6940 0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 1.0340 -0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 0.7720 1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 -0.2140 1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7900 -1.4760 2.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1560 -3.7680 3.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3720 1.0840 -0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0440 -4.3370 -4.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4550 -3.1660 -5.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5460 -3.3390 -6.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8850 1.1410 -0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4400 -0.4010 0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1080 -0.1350 -0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4000 -0.4740 -3.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2870 1.1260 -2.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5980 0.0110 -2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9490 -4.0210 -1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4140 -5.1060 -0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 -5.1190 3.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 -1.1920 -1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7040 -0.4890 -1.7430 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 6 7 2 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 18 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 20 1 0 0 0 0 18 19 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 57 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 27 44 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 45 1 0 0 0 0 30 46 1 0 0 0 0 31 47 1 0 0 0 0 31 48 1 0 0 0 0 31 49 1 0 0 0 0 31 57 1 0 0 0 0 32 50 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 32 57 1 0 0 0 0 33 53 1 0 0 0 0 34 54 1 0 0 0 0 35 55 1 0 0 0 0 36 56 1 0 0 0 0 M END