IBS-ZINC04029454 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 0.2740 1.5640 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 0.0350 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7310 -0.3410 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 -0.4930 1.2530 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9940 -0.0560 1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -0.1240 2.4920 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7090 -0.4470 3.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 -0.7900 2.4280 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 -1.9650 1.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3720 -2.4860 1.7900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 -2.5880 1.1790 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 -2.0190 1.1460 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6800 -2.4030 1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 -2.3640 -0.1050 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -1.5730 -1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2770 -1.9130 -2.2020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 -0.4230 -1.1880 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 0.3920 -2.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5710 -3.5990 -0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 -3.8650 0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2830 -0.1620 3.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 1.3690 2.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1420 1.9320 1.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3300 3.3010 1.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3950 4.1120 2.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 3.5450 3.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 2.1720 3.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 4.3370 3.8120 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7860 3.6860 4.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 5.4590 2.6520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 1.9510 -0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 1.9210 -0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 1.9120 1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 1.0980 -2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 -0.2540 -3.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 0.9400 -2.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9310 -4.4170 -0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3880 -3.4690 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9790 -3.8300 0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5600 -4.1370 0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 -3.7710 -0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -4.6380 0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 0.4900 2.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9770 -0.9340 3.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9540 0.4250 3.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8720 1.3010 1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2060 3.7390 1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7840 1.7290 3.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4400 4.4310 4.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 2.9840 5.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3320 3.1470 3.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 5.7680 3.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 17 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 12 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 22 1 0 0 0 0 8 9 1 0 0 0 0 8 21 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 20 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 M END