PUBCHEM-ZINC05139934 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 25 0 0 0 0 0 0 0 0999 V2000 -0.6500 1.1160 0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 -0.3780 0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6080 -0.8720 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -0.1270 -2.0710 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9510 -0.2440 -0.5110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -2.3540 -1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 -2.9810 -1.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 -4.3500 -2.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 -5.0960 -1.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7180 -4.4640 -0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 -3.0940 -0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7440 -5.2550 0.1190 N 0 3 0 0 0 0 0 0 0 0 0 0 2.4650 -6.3560 0.5590 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -4.8060 0.2680 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8750 -6.4810 -1.6190 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 1.5370 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 1.6220 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 1.2550 1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -0.8830 1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 -0.7980 0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9460 -2.4000 -2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8470 -4.8390 -2.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3650 -2.6000 0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -6.9380 -2.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6180 -6.9860 -1.2520 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 2 19 1 0 0 0 0 2 20 1 0 0 0 0 3 4 2 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 23 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 24 1 0 0 0 0 15 25 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M END