PUBCHEM-ZINC06174389 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 0.4320 1.4640 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 0.0280 0.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 -0.6830 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 -2.0400 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 -2.6570 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -3.8480 -0.0950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4090 -1.9090 -1.1640 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6060 -2.3260 -2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 -0.5920 -1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 0.0540 -2.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -2.5040 2.4890 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1700 -3.6240 3.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -3.3070 4.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -1.9540 4.5670 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 -1.4920 3.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 -0.3500 2.5230 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 0.5340 2.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -1.1640 5.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1800 -1.0590 5.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 -0.4680 7.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 1.0210 7.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -4.2320 5.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6790 -5.4300 5.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 -6.2890 6.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -5.9650 7.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -4.7790 7.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -3.9140 6.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5030 1.6180 -0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 1.9490 -0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 1.8920 1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 -4.6060 2.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 -0.1650 5.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 -1.6490 6.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6140 -2.0590 5.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5900 -0.4900 5.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5020 0.0020 6.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2230 -1.5150 7.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1430 0.0450 8.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 1.0560 6.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5530 1.5440 6.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3020 1.5020 8.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 -5.6840 4.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -7.2160 6.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -6.6410 8.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -4.5320 8.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -2.9900 6.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4990 -0.3780 7.1740 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 3 4 2 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 19 47 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 47 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 47 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 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 M CHG 1 11 1 M END