IBS-ZINC02108720 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 66 0 0 1 0 0 0 0 0999 V2000 -0.7040 1.5730 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 0.0730 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 -0.7280 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 -0.2080 2.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6300 -0.8000 2.9320 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7080 -0.6710 4.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7960 -2.2870 2.6520 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3850 -2.8730 3.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -2.7740 1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 -2.2670 1.0770 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7330 -2.7800 -0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 -1.8830 -1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 -0.4790 -1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -2.8710 2.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2120 -2.5020 2.6280 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8510 -1.3390 2.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0350 -1.2420 2.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9050 -0.1730 2.3530 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2700 0.5660 3.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8370 0.4240 0.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6880 2.1370 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2220 1.1410 -1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6600 0.9320 -1.5520 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2920 1.7780 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7110 0.7610 -3.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0550 1.8500 -3.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0820 1.7130 -5.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7640 0.4910 -5.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4150 -0.6010 -5.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3860 -0.4640 -3.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8050 0.4080 -7.1950 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6230 -0.5070 -7.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1900 -0.2150 -0.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 2.0570 -0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6370 1.8790 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 1.9680 1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 0.8810 2.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4720 -0.4570 3.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 -2.4870 0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -3.8730 1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 -3.8030 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8310 -2.8360 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -1.8550 -1.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6750 -2.2840 -2.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9390 -0.4730 -1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 0.1750 -1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2160 -2.4770 2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 -3.9610 2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 -2.6620 3.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5240 -0.3330 0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 1.2780 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8240 1.8660 2.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9530 2.9390 1.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6520 2.4380 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8190 2.1340 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5600 0.3830 -1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3070 2.8150 -3.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3530 2.5570 -5.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1620 -1.5590 -5.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1070 -1.3240 -3.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9870 -0.4990 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1910 0.9320 0.4730 N 0 3 0 0 0 0 0 0 0 0 0 0 4.8970 0.1680 0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 2 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 18 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 15 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 20 62 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 21 62 1 0 0 0 0 22 23 1 0 0 0 0 22 55 1 0 0 0 0 22 56 1 0 0 0 0 22 62 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 33 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 27 58 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 59 1 0 0 0 0 30 60 1 0 0 0 0 31 32 1 0 0 0 0 33 61 1 0 0 0 0 62 63 1 0 0 0 0 M CHG 1 62 1 M END