NIH-ZINC02876979 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7010 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0820 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7700 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0690 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6880 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.9400 -2.7420 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 -3.9370 -2.6350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -1.9530 -3.7640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4610 -3.7420 -2.8520 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 -5.1090 -2.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7870 -5.1500 -1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0350 -4.6190 -2.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8040 -3.1660 -2.4930 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5780 -2.5640 -1.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6260 -3.1040 -3.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0460 -2.6330 -3.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9950 -2.2380 -4.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2120 -2.5950 -2.4870 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4180 -2.0780 -3.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5930 -2.1450 -2.1590 C 0 0 3 0 0 0 0 0 0 0 0 0 8.3430 -1.6320 -1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8570 -1.5240 -2.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0100 -2.4180 -2.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3060 -3.4730 -1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9480 -3.5200 -1.8940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.1290 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -4.7840 1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.1640 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6250 2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1410 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -5.3930 -1.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7750 -5.7990 -3.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5700 -4.5300 -0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 -6.1780 -1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8870 -4.6700 -1.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2360 -5.2250 -2.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8850 -3.6340 -4.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 -2.0640 -3.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2520 -2.9110 -1.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6430 -2.6790 -4.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2540 -1.0420 -3.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7960 -1.5610 -3.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9910 -0.4980 -2.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5190 -2.8970 -3.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7140 -1.8330 -1.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7860 -4.4450 -1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3200 -3.1650 -0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -4.4820 1.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 -4.5070 1.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -5.8640 1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 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 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 27 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 28 29 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 M END