IFLAB-ZINC02458164 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 1 0 0 0 0 0999 V2000 0.1280 1.3050 0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -0.1960 0.2450 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7430 -0.7070 1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 -0.4220 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 0.1010 -2.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -0.1270 -3.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9650 -0.8900 -3.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 -1.3920 -2.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9680 -1.1670 -1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6210 -1.1160 -4.8140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 -1.5180 -5.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 -0.8580 -7.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 -1.2470 -8.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 -2.3050 -8.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 -2.9780 -6.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 -2.5910 -5.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -2.2760 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7390 -2.7820 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6650 -2.2970 0.9650 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3750 -1.0570 1.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9080 -0.6160 1.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8940 -2.9480 1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8410 -2.5130 2.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0700 -3.1610 2.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3910 -4.2720 1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4990 -4.7300 0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2760 -4.0720 0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6730 -4.9500 1.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9950 -5.9320 1.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 1.7670 0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6380 1.8330 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 1.4920 1.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6970 0.7040 -2.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 0.3040 -4.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4850 -1.9600 -2.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4510 -1.5750 -0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7830 -0.0410 -7.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5140 -0.7330 -9.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 -2.6110 -9.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 -3.8100 -6.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 -3.1350 -4.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 -2.7910 0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 -2.4530 -0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1360 -2.4880 -1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6660 -3.8750 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9790 -0.2510 1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6560 -1.1510 2.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8650 0.4400 1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3200 -1.1970 2.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6600 -1.6430 2.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7560 -2.7790 3.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7440 -5.5950 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6370 -4.4740 -0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3390 -4.5380 2.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2640 -0.7900 0.3570 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8540 -0.3140 -0.3370 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 4 1 0 0 0 0 2 55 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 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 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 17 55 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 21 55 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 53 1 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 55 1 M END