IBS-ZINC04937825 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 3.1180 1.9210 3.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2810 0.6100 2.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 0.7550 1.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 0.2750 1.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 -1.4060 1.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 -2.3280 2.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8020 -3.6810 2.4340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0320 -4.2140 1.8360 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3030 -3.6320 0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7270 -5.6400 1.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4400 -5.8750 1.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 -4.6560 2.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -4.5510 2.8380 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7780 -7.0400 1.6120 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6460 -6.5880 0.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9850 -7.5960 1.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1610 -6.3170 -0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1220 -7.1580 -1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5980 -6.9000 -2.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1260 -5.8110 -3.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1730 -4.9740 -2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6840 -5.2240 -1.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1540 -4.1800 2.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3980 -3.7010 2.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4260 -3.6710 3.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2110 -4.1200 4.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9660 -4.6000 5.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9370 -4.6240 4.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5030 -4.0830 5.8480 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.7070 1.7130 4.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0890 2.4050 3.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4400 2.5800 2.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6920 0.8190 1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 -0.0490 3.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 0.6380 0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 1.8060 1.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 0.9330 1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 -0.7420 1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 0.2900 2.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8340 -1.4070 1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 -1.7620 1.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5680 -1.9550 3.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8860 -2.3520 3.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8630 -7.0260 1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4920 -8.0070 -0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3410 -7.5490 -2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5020 -5.6130 -4.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8090 -4.1260 -3.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9370 -4.5730 -0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5650 -3.3510 1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3980 -3.2970 3.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7980 -4.9500 6.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9640 -4.9940 4.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 -0.0410 2.3740 N 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 33 1 0 0 0 0 2 34 1 0 0 0 0 2 54 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 54 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 5 54 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 2 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 17 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 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 M END