IBS-ZINC02241974 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 0 0 0 0 0 0999 V2000 -2.3860 2.8890 -0.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6330 1.5590 -0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 1.5900 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5740 0.4170 -0.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8700 -0.9010 -0.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 -0.9320 -1.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4630 -2.0460 -0.4060 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7260 -3.3110 -0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 -3.5370 0.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9460 -3.7050 1.9080 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 -3.9240 3.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8440 -2.0260 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7700 -2.4850 -1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5940 -3.5420 -0.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4820 -3.9620 -1.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3530 -5.0450 -1.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1690 -5.4120 -2.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1410 -4.7210 -3.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2900 -3.6510 -4.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4500 -3.2590 -3.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5890 -2.1920 -3.2600 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5690 -1.7080 -4.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7820 -1.8090 -2.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0370 -0.8590 -2.4210 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7160 3.7030 -1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2330 2.8670 -1.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7460 3.0440 0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2730 1.4040 -2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 1.7450 0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 0.6430 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 2.4040 -0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8630 0.5240 0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4640 0.4500 -1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4240 -4.1300 -0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0020 -3.2720 -1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 -4.4320 0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 -2.6760 1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 -3.0710 3.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1510 -4.0420 3.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 -4.8260 3.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9370 -2.6930 0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1090 -1.0120 0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5950 -4.0610 0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3810 -5.5880 -0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8420 -6.2480 -2.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7920 -5.0240 -4.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2740 -3.1200 -5.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 7 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 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 2 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 M END