NIH-ZINC04388796 MOE2007 3D CORINA 3.40 0006 02.08.2006 71 71 0 0 1 0 0 0 0 0999 V2000 1.0100 -6.7000 -0.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 -5.7700 0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 -4.3420 -0.3520 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0300 -4.3320 -1.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 -3.4340 0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 -3.8350 -0.2040 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3710 -4.5300 -0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 -3.7330 1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8580 -2.6910 1.8530 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 -4.7980 1.9050 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8450 -4.7130 3.3370 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8110 -3.6710 3.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8070 -5.5180 4.1220 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0740 -5.5230 5.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4280 -4.8800 3.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 -6.9560 3.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0560 -7.6800 4.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2190 -5.2730 3.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8030 -5.8820 2.7290 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7990 -5.0980 4.8040 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2500 -4.3030 5.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2660 -4.3700 7.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5920 -4.7330 6.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0860 -5.6780 5.2300 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9380 -6.6860 5.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0600 -5.6960 4.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0310 -4.8140 3.2480 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9630 -6.6900 3.9780 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8070 -2.5150 -0.8280 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9970 -2.4130 -2.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 -3.4140 -2.8280 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0050 -1.2020 -2.7470 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2150 -1.1680 -4.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 -1.9560 -4.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1920 0.2830 -4.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5700 -1.7950 -4.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0340 -6.3270 -0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 -7.7020 -0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -6.7350 -1.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 -6.1000 0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 -5.7940 1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3540 -3.3690 1.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 -2.4380 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7010 -3.8470 0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7220 -5.6220 1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -4.9700 2.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 -5.3890 4.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 -3.8260 4.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 -7.4750 4.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7010 -6.9440 2.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9640 -8.7420 3.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 -7.2630 3.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2140 -7.5500 5.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1170 -3.2690 5.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2960 -4.7210 6.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3490 -3.4030 7.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9890 -5.1480 7.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0660 -3.8440 5.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2720 -5.2560 7.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9860 -7.3950 4.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5900 -6.7020 3.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 -1.7140 -0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -1.5090 -4.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 -1.9300 -5.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -2.9900 -4.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9830 0.8450 -4.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 0.3090 -5.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 0.7300 -4.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5870 -2.8290 -4.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7280 -1.7690 -5.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3620 -1.2340 -4.0190 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 2 40 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 5 44 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 29 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 17 51 1 0 0 0 0 17 52 1 0 0 0 0 17 53 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 24 1 0 0 0 0 21 22 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 22 23 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 23 24 1 0 0 0 0 23 58 1 0 0 0 0 23 59 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 60 1 0 0 0 0 28 61 1 0 0 0 0 29 30 1 0 0 0 0 29 62 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 33 36 1 0 0 0 0 34 63 1 0 0 0 0 34 64 1 0 0 0 0 34 65 1 0 0 0 0 35 66 1 0 0 0 0 35 67 1 0 0 0 0 35 68 1 0 0 0 0 36 69 1 0 0 0 0 36 70 1 0 0 0 0 36 71 1 0 0 0 0 M END