PUBCHEM-ZINC00282288 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 0 0 0 0 0 0 0 0999 V2000 0.0800 1.6730 -0.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 0.1760 -0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 -0.5130 0.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 -1.8380 0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -1.9820 -0.7780 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -0.7030 -1.3420 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -3.4160 -1.6050 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -3.1150 -2.9090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 -4.3570 -0.7450 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6420 -3.9540 -1.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0590 -5.1340 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3660 -5.5560 -1.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2570 -4.7980 -2.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8400 -3.6170 -2.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5330 -3.1930 -2.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0880 -1.9270 -3.1520 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.8960 -1.2050 -3.7090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 -1.6060 -3.1070 O 0 5 0 0 0 0 0 0 0 0 0 0 1.1180 2.0000 -0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 1.9520 -1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 2.1490 0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 -0.0670 1.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2510 -2.6370 1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -5.7270 -0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6920 -6.4780 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2790 -5.1280 -2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5360 -3.0250 -3.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 6 2 0 0 0 0 3 4 2 0 0 0 0 3 22 1 0 0 0 0 4 5 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 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 13 14 2 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END