PUBCHEM-ZINC06068387 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 1 0 0 0 0 0999 V2000 -0.0230 1.8190 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 P 0 0 3 0 0 0 0 0 0 0 0 0 0.7180 -0.4940 1.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 -0.5890 -1.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 -0.8010 -1.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8640 -1.2470 -2.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1450 -1.4810 -3.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 -1.2700 -3.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -0.8280 -2.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5080 -0.5610 0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1980 -0.2660 1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9320 0.9080 1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6320 1.2050 2.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6020 0.3340 3.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8710 -0.8380 3.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 -1.1420 2.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3520 0.6550 4.6880 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.9960 1.6860 4.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3260 -0.1120 5.6340 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0000 2.1960 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1800 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1700 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7790 -0.6180 -0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9310 -1.4120 -2.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6510 -1.8290 -4.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -1.4520 -4.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 -0.6670 -2.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9550 1.5900 0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2040 2.1190 2.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -1.5170 4.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 -2.0590 2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 2 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 27 1 0 0 0 0 10 11 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 28 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END