PUBCHEM-ZINC05998245 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 1 0 0 0 0 0999 V2000 -0.0950 0.0210 1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 0.2810 -0.2510 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -0.4550 -1.0380 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7730 -2.0110 -0.8680 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6720 -2.2230 0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 -2.3990 -1.2080 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5370 -3.3430 -0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0360 -1.2200 -0.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 -0.0660 -0.6540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 -2.5540 -2.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 -2.7860 -2.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -2.6110 -1.7350 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6260 0.0860 -2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 1.5290 -2.4590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2410 1.7280 -1.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5920 -0.9260 1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 0.0250 1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 0.8130 1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3930 -1.3970 0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8910 -0.9920 -1.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4260 -0.2080 -3.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 -0.2180 -2.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 12 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 10 11 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 M CHG 1 12 -1 M END