PUBCHEM-ZINC05159986 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 0 0 0 0 0 0999 V2000 0.5330 1.4920 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 0.0210 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -0.7060 1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 -2.0560 1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 -2.6830 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 -1.9630 -1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -0.6050 -1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 0.1280 -2.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 -0.2620 -3.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 -0.0180 -3.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 -2.6470 -2.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 -2.8310 2.3700 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1090 -2.2800 3.4420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 -4.0210 2.3320 O 0 5 0 0 0 0 0 0 0 0 0 0 1.6140 1.6290 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 1.9940 -0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 1.9170 0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -0.2190 2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 -3.7380 -0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 -1.3010 -3.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 0.3760 -4.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1740 -0.1490 -2.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 0.3430 -2.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 0.5620 -4.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 -1.0690 -3.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5710 -2.7140 -2.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -2.0730 -3.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 -3.6490 -2.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 2 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 20 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M END