PUBCHEM-ZINC02513456 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 26 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 0.0200 -0.6130 1.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.7500 -1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -2.5320 -0.9860 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -3.1410 -2.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -2.4020 -3.6970 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -3.0170 -4.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -2.4410 -6.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -3.2370 -7.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -4.6190 -7.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -5.2040 -5.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -4.4110 -4.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -4.8420 -3.0830 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -5.4660 -8.3980 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0200 -4.9490 -9.5010 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -6.6790 -8.2940 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 -0.8990 -0.4960 -1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 -0.4720 -1.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -1.3660 -6.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -2.7840 -8.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -6.2800 -5.8460 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 13 14 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