NIH-ZINC04111460 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4210 -1.6190 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1000 -0.1510 1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2580 -0.9580 2.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -0.3840 3.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2660 0.8870 3.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 1.4290 1.6710 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5650 -0.4390 -1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3200 0.2360 -2.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6370 -0.0210 -3.5110 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2830 0.4410 -3.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5080 -0.2320 -2.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -0.4890 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0540 -0.6000 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 -0.2970 0.1770 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7830 -1.0990 2.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2640 -1.1280 2.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1080 -0.1200 2.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4270 -0.3780 2.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6540 -1.5960 1.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1450 -2.4990 1.4580 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 -1.9800 2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0940 -0.9260 4.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7770 1.4920 4.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0500 -0.1980 -0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5700 -1.5190 -1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3320 -0.1640 -2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3620 1.3110 -2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 0.1890 -4.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2660 1.5220 -3.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4790 -1.3090 -2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 0.1590 -2.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -0.7310 1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 -0.4340 3.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 -2.1040 2.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7870 0.8260 2.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2120 0.3510 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6170 -1.9720 1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1780 0.0480 -1.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 45 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 M END