PUBCHEM-ZINC05996393 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 1 0 0 0 0 0999 V2000 -0.4510 2.3640 0.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9530 0.6430 1.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0220 1.4230 2.4180 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9580 2.4940 2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4170 0.9460 2.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8690 -0.3360 2.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1440 -0.7710 2.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9840 0.0680 1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5460 1.3390 0.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2750 1.7850 1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4040 2.1330 0.2480 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8590 1.1960 3.8150 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 2.2540 4.6880 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0550 1.7280 6.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 2.1690 4.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 2.0900 -0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 2.7320 0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1130 3.1870 1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8710 -0.3710 2.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 0.5260 0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2260 -0.9980 2.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4820 -1.7630 2.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9780 -0.2640 1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9420 2.7810 1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9840 2.9980 0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 1.2130 1.6490 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 1.5390 2.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6550 3.5310 4.4870 O 0 5 0 0 0 0 0 0 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 1 26 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 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 12 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 8 9 2 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 24 1 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 28 1 0 0 0 0 26 27 1 0 0 0 0 M CHG 1 28 -1 M END