NIH-ZINC06578074 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 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 0.0240 -0.8270 1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -2.1280 0.6530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -3.3320 1.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -4.4840 0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -4.4450 -0.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -3.2410 -1.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -2.0570 -0.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.7730 -1.0720 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -0.4170 2.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 -0.6180 3.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 0.1960 3.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3540 0.4780 2.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2800 1.1350 3.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4040 1.5090 3.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6910 1.2550 4.5020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 0.6940 4.4230 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5990 1.4640 4.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -0.4490 5.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -0.6210 6.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -1.6700 6.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 -2.5480 7.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1240 -2.3750 6.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2490 -1.3290 5.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 -3.5740 8.0480 F 0 0 0 0 0 0 0 0 0 0 0 0 3.2990 1.8520 5.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9920 3.3510 5.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6260 3.9750 6.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7170 6.0020 8.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 6.1100 5.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5960 0.2280 1.1730 O 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 0.0700 -3.3690 2.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -5.4340 1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -5.3630 -1.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -3.1990 -2.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 0.0640 5.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 -1.8040 7.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9460 -3.0600 6.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1690 -1.1960 5.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8900 1.3780 6.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3780 1.7030 5.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 3.8250 4.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9120 3.5000 5.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2180 3.5010 7.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7060 3.8250 6.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7860 5.8610 8.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1630 5.5140 9.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4880 7.0680 8.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6330 5.7000 4.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0680 5.9720 5.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7540 7.1730 5.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 -0.3040 4.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3320 5.4130 7.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 12 56 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 32 2 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 57 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 57 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 31 57 1 0 0 0 0 M END