PUBCHEM-ZINC05211914 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 37 0 0 0 0 0 0 0 0999 V2000 -0.7960 1.4860 -0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 0.0510 -0.5490 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4350 -0.1320 0.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8390 -0.5740 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3960 0.1740 1.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2580 1.2370 0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7680 1.9220 1.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4180 1.5450 3.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5580 0.4810 3.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0500 -0.2070 2.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -0.5780 -1.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7890 -0.3090 -2.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5670 0.0060 -2.1790 P 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 -0.5970 -3.4530 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 -2.3890 -1.5900 P 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 -2.7500 -0.4570 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 1.9970 -0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3200 1.6290 -1.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3940 1.8960 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 0.1930 1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 -1.1850 0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 0.4610 0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5560 -0.5400 -0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6550 -1.6110 0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5310 1.5320 -0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4410 2.7540 1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8170 2.0810 4.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2840 0.1860 4.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 -1.0410 2.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5610 1.6100 -2.3170 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5700 -0.4270 -0.9950 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5940 -2.9100 -1.2950 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4510 -3.0760 -2.9380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -4.0410 -2.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2270 -2.7070 -1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4850 -0.1490 -1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 2.0780 -1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 11 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 2 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 15 1 0 0 0 0 13 14 2 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 30 37 1 0 0 0 0 31 36 1 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 M CHG 1 2 1 M END