PUBCHEM-ZINC06843728 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 27 0 0 1 0 0 0 0 0999 V2000 0.0370 1.4570 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 0.1020 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 -0.6330 -1.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 -1.8700 -1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6740 -2.3610 -0.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 -2.4640 -2.3510 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 -3.8020 -2.8000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0690 -4.4550 -1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3520 -3.7870 -3.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5400 -3.4770 -2.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1070 -3.6460 -3.5660 S 0 0 0 0 0 0 0 0 0 0 0 0 6.2490 -3.2510 -2.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -4.3860 -3.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 -3.5140 -4.3720 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 2.0010 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 1.3430 -0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 2.0580 0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 0.2320 0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -0.4390 0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -1.9690 -2.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 -4.7670 -4.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 -3.0500 -4.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4830 -2.4500 -2.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5570 -4.1660 -1.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2760 -3.3010 -2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0650 -2.2400 -1.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1410 -3.9710 -1.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -5.6430 -3.9280 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 13 14 2 0 0 0 0 13 28 1 0 0 0 0 M CHG 1 28 -1 M END