PUBCHEM-ZINC05962390 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 28 0 0 1 0 0 0 0 0999 V2000 0.0900 1.6400 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 0.1060 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 -0.5190 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 -0.4580 0.1280 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3900 -1.5540 0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2480 0.0610 1.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2230 0.7320 0.8210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 -0.3550 -1.5930 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5730 -0.0010 -1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3100 -0.1410 -2.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 2.0420 0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 2.1260 -0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3390 1.9650 1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -0.2960 2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -1.6090 1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9390 -0.1230 1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7070 1.0130 -0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9930 -0.7140 -0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2480 -1.1560 -3.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9550 0.5770 -3.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9140 -0.2320 2.4800 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.1710 -0.0540 -1.1200 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.6450 -0.8410 -1.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6470 0.5130 -1.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 0.5360 -0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7610 0.1440 -2.5030 N 0 3 0 0 0 0 0 0 0 0 0 0 5.2880 0.0480 -3.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1810 -0.5030 -1.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9110 1.1020 -2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 3 14 1 0 0 0 0 3 15 1 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 22 1 0 0 0 0 6 7 2 0 0 0 0 6 21 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 9 18 1 0 0 0 0 10 19 1 0 0 0 0 10 20 1 0 0 0 0 10 26 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 M CHG 1 21 -1 M CHG 1 22 1 M CHG 1 26 1 M END