IBS-ZINC02083257 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 0 0 0 0 0 0999 V2000 -0.4360 1.1500 0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -0.0360 1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -0.6070 0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 0.0110 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7010 1.1950 -0.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 1.7630 -0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3810 -0.6210 -0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5420 0.0490 -0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8220 -0.5930 -0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0470 -0.0530 -0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1630 -1.0030 -0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1950 -1.5890 -1.7150 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0370 -1.2110 0.4070 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1020 -2.1970 0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6630 -3.4670 1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7780 -4.4980 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8640 -4.2350 0.6180 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2680 1.2250 0.1810 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4710 1.9070 0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5620 1.4880 -0.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4060 3.2760 0.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4610 3.7070 1.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4380 4.9890 2.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3690 5.8430 1.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3250 5.4210 1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3410 4.1380 0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 1.5930 0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 -0.5170 1.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 -1.5320 1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 1.6800 -1.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 2.6820 -0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3600 -1.6890 -0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5300 1.1070 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7550 -1.6250 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9420 -0.6420 1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3810 -2.3970 -0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9630 -1.7460 0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2990 -3.2300 2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8260 -3.9260 0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4550 1.7080 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3010 3.0470 1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2560 5.3220 2.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3530 6.8420 2.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5020 6.0970 0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5360 3.8480 -0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4670 -5.5080 1.8970 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 46 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 M CHG 1 46 -1 M END