NIH-ZINC04411543 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 56 0 0 1 0 0 0 0 0999 V2000 -0.3480 1.6320 0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 0.1030 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7800 -0.4140 0.1950 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2210 -0.0160 1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6080 0.0380 -1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7670 -1.9430 0.2600 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7910 -2.3150 0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 -2.3860 1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 -3.0790 1.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -2.0140 2.7200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8330 -2.4450 3.9380 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2410 -2.4800 3.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 -1.4550 5.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -0.0820 4.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 0.9400 5.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 -0.1620 4.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3200 -3.8150 4.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1610 -4.3760 3.6640 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 -4.4180 5.4310 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 -2.4750 -0.9130 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7350 -2.6580 -2.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9160 -2.3820 -2.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 -3.1480 -3.1470 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 -3.3190 -4.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4400 -1.9670 -4.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 -3.8810 -5.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0250 -4.2910 -4.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 2.0000 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 2.0270 -0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 1.9570 1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -0.2230 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 -0.2930 0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1670 -0.3600 -1.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6290 -0.3300 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6170 1.1270 -1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 -1.4600 2.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2020 -1.3750 5.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6590 -1.8070 5.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 0.2240 3.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6270 0.6100 6.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 1.9080 5.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0580 1.0330 5.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 -0.8910 3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 0.8160 4.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 -0.4680 5.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 -3.9690 5.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 -5.3000 5.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 -2.6950 -0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6200 -1.2740 -4.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0270 -2.0950 -5.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0770 -1.5660 -4.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 -4.8440 -5.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5680 -4.0090 -6.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 -3.1880 -5.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6620 -3.8910 -3.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6120 -4.4190 -4.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6220 -5.2540 -3.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 20 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 M END