IBS-ZINC02216126 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 0 0 0 0 0999 V2000 0.0330 1.3310 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0220 1.9030 -0.7140 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2150 1.2560 -0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2830 1.7590 -1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4950 1.1060 -1.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6500 -0.0650 -0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5740 -0.5680 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 0.0890 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9480 -0.7680 -0.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8830 -0.3290 -1.3120 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0960 -1.8970 0.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3520 -2.5030 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4520 -3.8860 0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6910 -4.4900 0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8390 -3.7220 0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7500 -2.3320 0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4980 -1.7230 0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9770 -1.5080 0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1950 -1.9780 0.3600 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.0670 -0.9370 0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4600 -0.8460 0.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0660 0.3940 0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2970 1.5490 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9220 1.4680 0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2980 0.2320 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0050 -0.1650 0.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 -16.4210 0.4880 0.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 -16.9850 1.8000 0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 1.9450 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 1.2890 1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2430 0.3240 -0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1620 2.6640 -2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3240 1.4980 -2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6900 -1.4720 0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5310 -0.3010 0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3310 -2.2900 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5580 -4.4920 0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7620 -5.5650 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8050 -4.1980 0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4230 -0.6480 0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0590 -1.7400 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.7800 2.5140 0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3320 2.3690 0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.0710 1.7320 0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.6120 2.3900 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.7010 2.2790 -0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 M END