IBS-ZINC05246389 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 63 0 0 0 0 0 0 0 0999 V2000 -1.3510 1.2790 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 -0.1340 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 -0.8750 1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 -2.1290 0.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -3.2610 1.5190 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 -4.3140 0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 -4.3530 -0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -3.2230 -1.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 -2.0860 -0.5590 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 -0.8590 -1.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -3.1490 -2.7500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -1.9450 -3.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6050 -2.3040 -4.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -4.6200 -4.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 -4.2330 -3.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 -3.7140 -6.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 -4.1340 -7.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -3.3180 -7.7750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 -3.4840 -8.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 -5.5680 1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 -5.4790 2.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8170 -6.6380 3.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 -7.8850 2.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -7.9750 1.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3030 -6.8190 1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 -0.5110 2.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9190 0.0990 3.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0110 0.4630 4.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9430 0.2220 5.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -0.3850 4.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 -0.7490 3.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 1.9100 0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 1.6820 -1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4320 1.3570 0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -5.2490 -1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3190 -1.4660 -3.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 -1.2150 -2.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 -1.4310 -5.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5210 -2.6780 -4.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 -5.0300 -4.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -5.3480 -5.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 -5.1230 -3.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2990 -3.8890 -4.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7850 -4.4720 -6.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 -2.7840 -6.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7760 -3.9850 -8.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 -5.1810 -7.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7750 -4.5110 3.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 -6.5690 4.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6920 -8.7860 3.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 -8.9480 1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 -6.9160 0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7700 0.2830 2.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9180 0.9300 4.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0170 0.5020 6.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0490 -0.5760 5.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -1.2210 3.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 -3.3970 -5.4440 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2780 -3.0390 -5.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 10 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 58 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 14 58 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 16 58 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 19 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 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 29 30 2 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 31 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END