IBS-ZINC04650173 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 40 0 0 0 0 0 0 0 0999 V2000 0.2820 -2.5580 1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -4.1350 0.2250 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6640 -4.8370 0.9140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 -4.7840 -0.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 -3.6740 -1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7510 -3.5160 -1.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3410 -3.1610 -2.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5650 -2.9490 -3.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 -3.1040 -3.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -3.4720 -2.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 -2.7440 -5.2160 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0630 -2.3910 -5.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2900 -2.0000 -7.2070 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5450 -1.7160 -7.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7960 -1.4790 -8.7700 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6160 -1.6980 -6.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7700 -0.9490 -6.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5800 -0.6590 -5.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8220 -0.0410 -5.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2630 0.0460 -4.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3120 -0.5050 -3.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2820 -0.9310 -4.3020 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4730 -1.3590 -3.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3770 -2.5320 -5.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3330 -3.1270 -4.7040 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0140 -2.6150 -5.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 -2.0080 1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3950 -1.9700 0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 -2.7510 2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -3.6740 -0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4130 -3.0430 -2.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -3.5960 -2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0480 -0.5870 -7.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3490 0.3060 -6.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1970 0.4750 -3.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3640 -0.5860 -2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2430 -3.1040 -5.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 21 2 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 25 37 1 0 0 0 0 M END