PUBCHEM-ZINC04879994 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 0 0 1 0 0 0 0 0999 V2000 -0.0150 1.2830 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3940 -0.4680 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2010 0.8160 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 1.8030 0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 3.2340 0.0420 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1960 3.7150 -0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 3.9000 1.3100 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8850 3.1640 2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 4.9430 1.7070 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6620 5.9490 1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1790 4.7840 0.6310 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0290 5.5040 -0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0180 3.4370 0.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5650 4.9630 1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5570 4.9290 0.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6040 4.6560 3.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 4.5400 1.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7920 0.9680 0.0450 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.6880 -1.2470 -1.1930 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.9180 -1.2220 -2.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7030 -1.9180 -1.2520 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8780 1.8900 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7510 4.1590 1.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6100 5.9220 1.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4620 5.0360 0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2790 5.2800 3.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 4.9740 1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5950 -1.0570 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 19 2 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 18 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 15 25 1 0 0 0 0 16 26 1 0 0 0 0 17 27 1 0 0 0 0 18 28 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END