NIH-ZINC00251461 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 -1.1310 1.9790 1.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7990 0.5090 1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 -0.1110 2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0590 -0.2320 0.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1180 0.3570 0.8390 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0090 -1.5500 0.6060 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2340 -2.2710 0.2500 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0730 -1.8620 0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4990 -2.1140 -1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0690 -3.7540 0.5860 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9710 -3.8730 1.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8340 -4.2890 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 -4.4890 0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 -4.9900 -0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 -5.1960 -1.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7270 -4.7520 -1.7860 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.4770 -3.9740 0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6810 -4.7350 0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5090 -6.1340 0.4070 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3200 -6.6760 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1020 -5.9350 0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 2.5150 1.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5650 2.4210 0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8460 2.0480 2.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 0.4400 0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 -0.0420 3.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -1.1580 2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 0.4250 2.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1620 -2.0220 0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3470 -2.7380 -1.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7240 -1.0710 -1.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6160 -2.4230 -1.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 -4.2770 1.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 -5.1970 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -5.5800 -2.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5760 -2.9140 0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4330 -4.1090 1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5910 -4.3900 0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7570 -4.5560 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2460 -7.7360 0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3570 -6.5540 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0360 -6.1020 1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1980 -6.3070 -0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2460 -4.4970 0.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 44 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 M END