NIH-ZINC03958843 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 0.7360 1.8190 0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 0.3600 0.1730 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8060 0.3610 0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7290 -0.2390 -1.2230 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3350 0.4490 -1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 -0.2620 -1.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9110 0.2930 -2.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3200 0.1060 -2.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6840 -0.5870 -1.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3340 -1.0070 -0.3630 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 -2.6010 -2.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 -3.8880 -2.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1860 -2.6450 -2.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -1.3210 -2.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 -4.8890 -3.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 -0.4000 1.3620 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 -1.7070 1.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 -2.3190 0.7970 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -2.3890 2.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -3.4960 3.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 -4.2210 4.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8550 -3.8810 5.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5320 -2.7570 4.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0540 -2.0200 3.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3470 -4.6160 6.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6290 -5.7780 6.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -4.2560 6.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 1.9070 0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 2.4200 -0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 2.2600 1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 0.8160 -3.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0320 0.4640 -3.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6820 -0.8670 -1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6470 -2.8370 -1.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 -2.1700 -3.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -4.5950 -3.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2050 -4.3450 -1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3770 -3.0260 -1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1600 -2.4350 -2.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 -0.8650 -3.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 -0.6230 -1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3880 -5.3450 -2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7130 -5.6140 -3.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2090 -4.7090 -3.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 0.0810 2.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 -3.8160 2.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -5.0750 4.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4710 -2.4310 4.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6590 -1.1930 3.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5340 -6.5490 5.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 -6.2410 7.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 -5.4950 6.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5380 -3.2490 7.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8420 -4.9360 7.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4360 -4.3010 6.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -1.5560 -1.5090 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1890 -1.9970 -0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4670 -3.6430 -2.9840 N 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 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 56 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 11 56 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 58 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 58 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 14 56 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 15 58 1 0 0 0 0 16 17 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 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END