NIH-ZINC04035474 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 63 0 0 1 0 0 0 0 0999 V2000 1.2890 -2.0380 -2.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 -3.3700 -2.4350 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 -3.5580 -2.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0810 -4.8270 -2.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4060 -5.0180 -1.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1820 -3.9390 -1.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 -2.6690 -1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 -2.4810 -1.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5260 -4.1320 -1.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1560 -2.8640 -0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5970 -3.1300 -0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7060 -5.0260 -1.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2640 -4.7610 -2.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7460 -3.9610 -0.9970 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.1780 -3.0140 -0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5110 -4.4830 -2.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3200 -3.5660 -3.3410 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7120 -4.0470 -4.8760 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.4470 -2.9380 -5.7240 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1180 -5.3240 -5.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.4550 -4.2980 -4.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2520 -3.4930 -5.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6220 -3.6910 -5.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.1940 -4.6960 -4.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3970 -5.5020 -4.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0260 -5.3070 -4.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2460 -6.0980 -3.3880 F 0 0 0 0 0 0 0 0 0 0 0 0 -14.4010 -2.9030 -6.5100 F 0 0 0 0 0 0 0 0 0 0 0 0 -8.8410 -4.9650 0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5570 -6.3020 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6580 -7.1900 0.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0360 -6.7150 2.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2980 -5.4350 2.3780 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.2070 -4.5620 1.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3390 -2.0280 -2.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7210 -1.3880 -3.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 -1.6800 -1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 -5.6650 -2.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 -6.0060 -1.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2270 -1.8300 -1.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -1.4940 -1.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5980 -2.4240 0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1540 -2.1780 -1.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5970 -3.7940 0.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0760 -2.1870 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2630 -5.4670 -2.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7070 -5.7130 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2640 -4.0960 -3.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7860 -5.7040 -2.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1380 -5.4710 -2.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5730 -4.5480 -1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9640 -2.6760 -3.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8060 -2.7080 -6.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.2620 -4.8500 -5.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8430 -6.2850 -3.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2640 -6.6450 -1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4440 -8.2390 0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1170 -7.3990 3.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4260 -3.5210 1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3360 -3.7590 -1.3540 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 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 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 11 60 1 0 0 0 0 12 13 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 12 60 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 29 1 0 0 0 0 14 60 1 0 0 0 0 16 17 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 17 18 1 0 0 0 0 17 52 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 24 25 2 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 56 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 32 33 2 0 0 0 0 32 58 1 0 0 0 0 33 34 1 0 0 0 0 34 59 1 0 0 0 0 M END