IBS-ZINC02100549 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.3740 1.5000 1.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3950 0.0520 1.5340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 -0.6120 1.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5440 -0.0040 0.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -2.1170 1.0770 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3180 -2.5090 1.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 -2.6710 -0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -4.1130 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9960 -5.1290 -0.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 -5.1090 -2.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 -6.2840 -3.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6400 -7.4410 -2.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6250 -7.4880 -0.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 -6.3100 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1910 -6.0100 1.0800 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 -6.6330 1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 -4.6960 1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6060 -3.9670 2.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 -2.5300 2.2310 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1460 -1.6170 2.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 -0.4340 2.7880 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0780 -2.0660 4.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7390 -1.2810 5.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7060 -0.2110 5.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0480 1.0280 6.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2830 1.7790 5.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8040 1.3490 5.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6310 -0.1780 5.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3450 1.7880 0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 1.9110 1.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 1.8880 1.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 -2.6040 -1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 -2.0940 -0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 -4.2130 -2.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3730 -6.3070 -4.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8900 -8.3360 -2.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8560 -8.3960 -0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -4.3120 2.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4430 -4.1460 3.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5260 -2.6680 4.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8830 -2.6630 3.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2570 -2.1430 5.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3060 -1.5640 6.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4980 -0.5750 6.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1410 0.0760 4.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3650 0.7100 7.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8190 1.6740 6.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3250 2.8440 5.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7600 1.6100 4.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 1.8270 6.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 1.6830 4.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6880 -0.4660 6.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6520 -0.4530 5.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6460 -0.8910 4.7570 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 19 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 17 2 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 54 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 M END