IBS-ZINC06758185 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3800 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 0.0350 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4330 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0950 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6920 -0.6800 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8480 0.0140 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1280 -0.6980 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1480 -1.9140 -0.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2840 -0.0040 -0.0660 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5830 -0.6930 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3000 -0.3770 -1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2320 1.1220 -1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3290 1.9250 -1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5650 3.5750 -1.6210 S 0 0 0 0 0 0 0 0 0 0 0 0 9.8970 3.0310 -2.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0480 1.7520 -2.4860 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7110 3.8940 -3.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4500 5.2630 -3.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2140 6.0620 -4.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2360 5.5100 -5.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4990 4.1540 -5.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7470 3.3440 -4.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2880 1.4680 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5550 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -1.7610 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 1.9930 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 3.1750 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7100 -1.7600 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8300 1.0930 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1880 -0.3480 0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4260 -1.7690 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3430 -0.6870 -1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8160 -0.9110 -2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6520 5.6950 -3.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0130 7.1220 -4.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8300 6.1400 -5.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2980 3.7280 -5.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9570 2.2860 -4.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3070 1.8420 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5420 1.8370 0.9290 H 0 0 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 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 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 M END