IBS-ZINC05163813 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 1 0 0 0 0 0999 V2000 -0.3490 1.4390 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 -0.0880 0.1280 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0330 -0.5060 -0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4060 -0.5990 1.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 -0.0950 2.5620 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5700 -0.5300 2.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 -0.0190 1.5090 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3830 1.0710 1.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 -0.4940 0.2970 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8170 -0.5340 1.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -0.4930 3.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 0.4540 4.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9410 0.0080 5.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 -1.3010 5.7730 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4610 -2.1730 4.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -1.7850 3.9340 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 -3.5260 5.2280 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 -3.9760 6.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 0.9150 6.4010 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 1.9010 4.1990 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1200 2.5230 4.6920 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8440 2.4700 3.4790 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6890 1.7470 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 1.8020 -0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 1.8550 1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -1.6890 1.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4320 -0.2450 1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6110 -1.6180 2.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -0.1240 3.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2680 -0.1750 2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3940 -0.1710 0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8140 -1.6240 1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 -4.1760 4.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 -5.0660 6.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4190 -3.6220 6.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9650 -3.5770 7.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4790 1.8670 6.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0860 0.5970 7.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 2 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 17 33 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 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END