PUBCHEM-ZINC03040752 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 1 0 0 0 0 0999 V2000 -0.0140 1.3400 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -0.0540 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 -0.7250 -0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 -0.0140 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 1.3790 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 2.0730 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 3.5840 0.1820 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1310 3.9410 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9910 4.1720 -0.8030 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 4.1480 1.8570 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6910 5.9350 1.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9890 6.6790 2.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2610 -2.1870 -0.2410 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1750 -2.7790 -0.3020 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 -2.7420 -0.2690 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9770 1.8470 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 -0.5930 -0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4010 -0.5180 -0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3450 1.9260 0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9980 3.5770 -1.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4850 6.1320 0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 6.2750 1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 6.5550 3.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9480 6.3830 3.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 8.1400 2.5670 N 0 3 0 0 0 0 0 0 0 0 0 0 2.2920 8.6550 3.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 8.5220 2.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 8.3590 1.9010 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 16 1 0 0 0 0 2 3 2 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 2 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 11 22 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 12 25 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M CHG 1 25 1 M END