PUBCHEM-ZINC06293459 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3060 0.0090 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 -1.2930 -0.7750 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 -1.7000 -1.1260 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3860 -2.4980 -1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7130 -2.4320 -0.2430 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 -3.3480 -2.3670 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3220 -3.4030 -3.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 -4.2220 -4.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 -4.2790 -5.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 -5.1620 -6.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 -5.2140 -7.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9410 -4.3860 -6.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9650 -3.5030 -5.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 -3.4460 -4.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0850 -4.4430 -7.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0640 -5.2100 -8.8000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 1.8580 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8330 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -0.5310 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -1.3390 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 -0.0810 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 -1.7370 -1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1770 -3.9230 -2.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 -4.8620 -4.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0820 -5.8020 -6.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 -5.8960 -7.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8210 -2.8640 -5.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 -2.7620 -4.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1530 -3.6450 -7.6620 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8780 -3.7180 -8.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 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 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 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 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 25 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 26 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 30 31 1 0 0 0 0 M END