PUBCHEM-ZINC01475625 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -0.6110 1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 0.0490 1.9050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -2.1150 1.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 -2.6260 2.5840 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5390 -4.3850 2.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 -5.0080 1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 -6.3860 1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 -7.1500 2.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1140 -6.5260 3.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 -5.1480 3.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8130 -4.4840 4.6140 N 0 3 0 0 0 0 0 0 0 0 0 0 3.3430 -5.1540 5.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8350 -3.2680 4.6840 O 0 5 0 0 0 0 0 0 0 0 0 0 1.4590 -8.9080 2.2220 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -9.2120 0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -2.5190 1.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -2.4930 0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -4.4140 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 -6.8700 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5790 -7.1200 4.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 -8.7790 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 -8.7550 -0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 -10.2860 0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 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 24 1 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 11 12 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 1 0 0 0 0 16 17 1 0 0 0 0 17 26 1 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M END