NIH-ZINC04101446 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 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 1.0600 -0.5960 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -0.6940 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 -0.0920 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4690 -1.2790 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5810 -2.5030 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 -2.0880 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -3.0500 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5630 -4.3920 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8850 -4.7950 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8930 -3.8490 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2850 -6.5110 -0.0350 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.6000 -6.6130 -0.5650 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -7.1800 -0.5990 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3780 -7.0050 1.5430 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4210 -6.4650 2.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5300 -7.3310 3.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6030 -6.7760 4.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2190 -5.7850 4.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8770 -7.3800 5.7500 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9200 -6.8400 6.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0290 -7.7060 7.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1020 -7.1510 8.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4070 -7.5840 8.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3910 -7.0750 9.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0690 -6.1320 10.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7630 -5.6990 10.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7780 -6.2120 9.7460 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 -2.6250 0.5090 0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6420 0.5190 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0820 -1.2650 0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0980 -1.2560 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 -2.7410 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -5.1300 -0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9260 -4.1620 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 -7.6510 1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1650 -5.4440 2.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3750 -6.4670 1.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7860 -8.3520 3.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5760 -7.3280 4.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3840 -8.1720 6.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6640 -5.8190 6.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8740 -6.8420 6.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2850 -8.7270 7.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0740 -7.7040 8.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6590 -8.3210 7.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4120 -7.4130 9.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8380 -5.7340 11.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5120 -4.9630 11.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7570 -5.8760 9.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 M END