NIH-ZINC06498956 MOE2007 3D CORINA 3.40 0006 02.08.2006 66 68 0 0 1 0 0 0 0 0999 V2000 1.7710 1.4420 0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 0.0220 0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0540 -0.6710 -0.6330 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7420 -1.9770 -0.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5550 -2.6010 -1.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 -3.9420 -2.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3410 -4.6890 -1.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 -4.0480 -0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 -2.7050 -0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 -6.1590 -1.9130 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8120 -6.4370 -2.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 -6.5700 -2.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 -7.3690 -1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 -7.6720 -0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 -8.3950 0.7680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 -7.0130 -0.7990 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9780 -7.2240 -0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3120 -6.8290 1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9490 -4.9570 2.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5100 -4.6230 0.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8200 -7.7190 -0.7050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 -6.3020 -3.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2740 -6.7480 -3.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 -5.5410 -4.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 -5.9890 -5.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 -4.8740 -6.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -3.8150 -5.6590 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -2.8820 -6.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7370 -4.2010 -4.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5750 -3.2200 -3.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 -4.7600 -7.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2610 -5.6760 -7.8020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 -3.4500 -7.6620 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6030 -3.2030 -8.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -7.3710 -5.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8190 1.4420 0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 1.9460 -0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 2.0190 1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 -0.4630 1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2030 0.0510 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3480 -2.0340 -2.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0090 -4.3930 -2.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -4.5800 -0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -2.2580 0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1610 -8.3000 -0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6310 -6.7170 -1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5970 -7.2730 1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3180 -7.1620 1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 -5.3450 3.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9810 -5.3960 2.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8880 -3.8670 2.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6720 -4.8730 -0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3530 -4.9540 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3520 -3.5470 0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5990 -6.4590 -4.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 -2.4150 -3.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3200 -2.7760 -4.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1080 -3.6870 -3.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5840 -2.1310 -8.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6250 -3.4850 -8.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 -3.7430 -9.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7590 -7.7020 -6.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 -7.4000 -5.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -8.0920 -4.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2670 -5.3260 1.2420 N 0 3 0 0 0 0 0 0 0 0 0 0 2.4870 -4.9690 0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 39 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 43 1 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 22 2 0 0 0 0 13 14 1 0 0 0 0 13 21 2 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 18 65 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 19 65 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 20 65 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 55 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 35 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 34 59 1 0 0 0 0 34 60 1 0 0 0 0 34 61 1 0 0 0 0 35 62 1 0 0 0 0 35 63 1 0 0 0 0 35 64 1 0 0 0 0 65 66 1 0 0 0 0 M CHG 1 65 1 M END