PUBCHEM-ZINC05975489 MOE2007 3D CORINA 3.40 0006 02.08.2006 21 20 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 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 -1.7000 -0.6320 0.0150 S 0 3 0 0 0 0 0 0 0 0 0 0 -2.1270 -0.3730 -1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4710 -2.4310 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8370 -3.1190 0.0120 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4190 -2.7610 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6490 -4.6100 0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7220 -5.3060 -0.8590 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3980 -5.1650 1.3230 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5500 -2.8100 -1.2340 N 0 5 0 0 0 0 0 0 0 0 0 0 -3.0310 -3.1330 -2.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 2.0340 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 1.3730 3.0430 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -2.7220 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 -2.7320 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2840 -6.1250 1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 M CHG 1 3 1 M CHG 1 11 -1 M CHG 1 13 -1 M END