PUBCHEM-ZINC00480478 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7120 1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0990 1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7270 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0270 -1.2120 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.7030 -1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 0.1820 -2.7240 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -1.1640 -3.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -2.4380 -3.5420 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -3.1760 -4.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 -2.3430 -5.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 -1.0610 -5.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 0.1790 -5.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -2.8960 2.3830 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0680 -2.3350 3.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -4.1130 2.3280 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1960 2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -3.8060 -0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -4.2550 -4.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -2.6250 -6.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 0.5030 -6.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6270 0.0040 -6.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 0.9510 -5.4270 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 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 15 1 0 0 0 0 5 6 2 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 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 14 27 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END