NIH-ZINC05686227 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 -0.3990 2.0330 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 0.5960 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 0.1130 -1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3470 -1.2820 -1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9630 -1.8230 -2.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 -1.8500 -3.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 -0.4680 -3.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 0.0880 -2.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 -2.6250 -6.0250 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2760 -1.7040 -6.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 -3.7390 -5.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 -5.0620 -5.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -5.8300 -6.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5440 -5.1410 -6.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4420 -4.0000 -7.3720 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 -2.8470 -7.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8690 -1.9560 -8.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 2.7140 -0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 2.1380 -0.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 2.3490 0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 0.5250 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 -0.0630 0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5400 0.8050 -1.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1210 -1.2400 -0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -1.9820 -0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8230 -1.1990 -2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 -2.8330 -2.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 -2.5910 -3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0860 0.2310 -4.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 -0.5120 -4.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 -0.5220 -2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 1.0980 -2.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 -3.3710 -5.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 -3.9370 -6.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 -4.9100 -4.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 -5.6940 -5.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 -6.8130 -5.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -6.0100 -7.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 -4.8220 -5.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2230 -5.8470 -6.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9920 -4.0330 -8.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6530 -2.3130 -4.7920 N 0 3 0 0 0 0 0 0 0 0 0 0 2.3360 -1.5870 -5.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 -3.1330 -4.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 9 42 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 M CHG 1 42 1 M END