IFLAB-ZINC04247392 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.0760 1.4260 -0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5360 1.0920 -1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7470 0.4310 -1.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 0.0940 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7440 0.4300 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 1.1010 1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 0.0790 2.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4770 -0.4540 2.4070 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5800 -0.5730 -0.0970 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 -1.9560 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4430 -2.6800 0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4870 -4.0450 0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7030 -4.6940 0.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8830 -3.9810 0.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8490 -2.6110 0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0420 -1.8870 0.1100 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2620 -2.5300 0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9350 -2.4450 1.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1460 -3.0840 1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7010 -3.8150 0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0500 -3.9110 -0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8180 -3.2740 -0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1130 -3.3790 -2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0950 -2.7420 -2.2510 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0210 1.9480 -0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 1.3520 -2.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 0.1740 -2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 1.3640 2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4020 -0.0800 -0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 -2.1760 0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 -4.6080 0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.7610 0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8310 -4.4900 0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0180 -0.9370 -0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5090 -1.8770 2.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6650 -3.0140 2.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6500 -4.3120 0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4870 -4.4820 -1.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7590 0.3480 3.5640 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5960 -4.1800 -3.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0980 -4.2160 -3.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 0.0990 4.3770 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 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 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 39 42 1 0 0 0 0 40 41 1 0 0 0 0 M END