NIH-ZINC04057154 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 64 0 0 1 0 0 0 0 0999 V2000 -1.0860 0.8500 0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -0.0050 -0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 -0.6190 1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 -1.4620 0.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3430 -2.0860 1.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 -1.8680 3.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 -1.0230 3.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 -0.3970 2.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5390 -2.5010 4.2320 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2340 -1.6640 5.2020 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5070 -1.2230 5.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2390 -2.4940 6.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0590 -2.8010 5.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5240 -3.7360 6.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1520 -4.6390 5.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4690 -3.8310 4.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8230 -4.4190 3.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7780 -1.6720 7.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3960 -0.5320 7.3040 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6840 -2.2040 7.9890 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1010 -1.4840 9.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1140 -1.9900 9.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5180 -1.2650 11.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8930 -0.0540 11.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8940 0.3880 10.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5330 -0.3220 9.3880 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9680 -0.5650 4.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6180 -0.8380 3.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2920 0.1660 2.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3180 1.4500 3.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6640 1.7240 4.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9850 0.7140 5.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6870 2.9820 4.8540 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9940 3.1910 6.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9810 2.4390 2.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6300 2.0840 1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 1.6540 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4880 1.2750 -0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8610 0.2740 0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 -1.6320 -0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1810 -2.7430 1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 -0.8540 4.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 0.2640 2.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1880 -4.2720 7.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6210 -3.4350 7.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0560 -5.0920 4.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 -5.4240 5.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0460 -3.0870 7.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5780 -2.9370 9.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3020 -1.6340 11.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1850 0.5360 12.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4040 1.3300 10.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5990 -1.8380 2.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8000 -0.0490 1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4720 0.9260 5.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9390 2.9470 5.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4220 2.5500 6.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0900 4.2340 6.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1200 2.9630 0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3740 1.3120 1.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8910 1.7080 0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 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 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 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 42 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 27 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 17 2 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 48 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 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 31 2 0 0 0 0 30 35 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 32 55 1 0 0 0 0 33 34 1 0 0 0 0 34 56 1 0 0 0 0 34 57 1 0 0 0 0 34 58 1 0 0 0 0 35 36 1 0 0 0 0 36 59 1 0 0 0 0 36 60 1 0 0 0 0 36 61 1 0 0 0 0 M END