PUBCHEM-ZINC05527652 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 1 0 0 0 0 0999 V2000 -0.5910 1.8450 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 0.0620 0.1220 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0740 -0.4690 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1690 -1.9910 0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6080 -2.5090 -0.0030 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0610 -2.1200 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4780 -4.0570 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7370 -4.6700 0.9790 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4600 -2.1360 1.1320 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1910 -0.9770 1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1950 -0.1160 0.3690 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9570 -0.8350 2.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7750 0.2280 2.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3810 0.0650 4.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0070 -1.1170 4.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9360 -2.0190 3.7200 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 2.3530 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0890 2.0750 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 2.2170 0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5880 0.0000 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5200 -0.1160 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5370 -2.4360 -0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7630 -2.3280 1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4990 -2.8500 1.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9280 1.0850 2.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0540 0.7780 4.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3110 -1.4990 5.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1490 -4.5070 -1.2340 O 0 5 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 3 4 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 14 15 2 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 M CHG 1 28 -1 M END