PUBCHEM-ZINC05847104 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 36 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5280 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -0.4910 0.1630 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8760 -1.3710 -0.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7560 -2.3210 -0.1970 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -1.3490 -1.9870 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1760 0.0410 1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 1.5720 1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 3.4580 1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 3.8820 2.7350 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1120 3.5060 2.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1050 5.4090 2.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7010 5.9130 4.4660 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0800 5.6030 4.6120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 5.5570 5.4700 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 3.3460 3.7410 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9060 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 1.8900 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 -0.3600 -0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 -0.3660 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0050 -2.3360 0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1270 -2.9760 -0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 -0.6790 -2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8940 -2.0040 -2.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2110 -0.2840 1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7710 -0.3170 2.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6110 1.9320 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6070 1.9810 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 3.9390 0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4440 3.7570 1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 5.7860 2.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 5.8190 2.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 3.6390 3.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 1.9990 1.2200 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6590 7.4340 4.4350 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9540 7.8530 5.2550 H 0 0 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 34 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 2 20 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 5 21 1 0 0 0 0 5 22 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 35 1 0 0 0 0 16 33 1 0 0 0 0 35 36 1 0 0 0 0 M CHG 1 3 1 M END