PUBCHEM-ZINC04671640 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 0 0 0 0 0 0999 V2000 4.8260 -0.1160 4.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3760 -1.3580 3.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1040 -1.5850 2.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2800 -0.5670 1.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7340 0.6920 2.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0050 0.9050 3.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9250 1.7790 1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6890 1.5890 -0.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 -0.8550 -0.0390 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5720 -2.5780 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 -3.0090 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9630 -4.3430 -0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9970 -5.2840 -0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3250 -4.8540 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6080 -3.5080 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0120 -3.0480 0.0510 N 0 3 0 0 0 0 0 0 0 0 0 0 6.9180 -3.8610 0.0920 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2620 -1.8560 0.0830 O 0 5 0 0 0 0 0 0 0 0 0 0 2.6880 -6.7240 -0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5870 -7.5400 -0.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0310 0.0520 5.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2390 -2.1520 4.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7550 -2.5550 2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3550 1.8700 3.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -2.2850 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -4.6730 -0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1270 -5.5770 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3620 2.9860 1.5290 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 -7.1360 -0.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 -8.0910 -0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4720 3.6680 0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 9 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 25 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 13 19 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 19 20 2 0 0 0 0 19 29 1 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END