IBS-ZINC02414246 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -1.7720 0.7070 -0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 -0.3430 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 -0.9660 1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -1.9300 1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 -2.2740 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 -1.6540 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -0.6900 -1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 -0.0640 -2.5070 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 -0.6940 -3.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 0.2870 -4.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 -0.2330 -5.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 -1.5700 -6.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 -2.2810 -4.4600 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 -2.3310 -7.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 -1.7470 -8.2990 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 -3.6760 -7.2440 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1390 -4.3960 -8.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6290 -3.8620 -9.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -4.5750 -10.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3290 -5.8210 -10.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 -6.3550 -9.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7390 -5.6490 -8.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4210 -6.5160 -11.9600 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.6490 1.5400 -3.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 1.3130 -2.7140 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 2.8970 -4.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 1.6950 -0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 0.6420 -1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 0.5440 0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 -0.7000 1.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 -2.4160 2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0600 -3.0260 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5730 -1.9230 -2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 0.3980 -6.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -4.1450 -6.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 -2.8900 -9.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 -4.1600 -11.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3080 -7.3270 -9.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1320 -6.0680 -7.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9030 3.1710 -4.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 3.6360 -4.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 2.8660 -5.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 M END