PUBCHEM-ZINC05426136 MOE2007 3D CORINA 3.40 0006 02.08.2006 24 24 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5230 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 0.5470 -0.5650 -1.2950 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0550 -0.2020 -2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 -0.1410 -1.4800 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 1.0910 -2.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3990 2.0840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7220 1.1770 -3.3010 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9630 2.4320 -3.8760 N 0 3 0 0 0 0 0 0 0 0 0 0 2.6910 3.4470 -3.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 2.5080 -4.9920 O 0 5 0 0 0 0 0 0 0 0 0 0 0.4860 -2.0710 -1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -2.7080 -0.9940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 1.8790 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 1.8700 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 -0.3530 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 -0.3720 0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6780 -0.7150 -1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 3.0770 0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 1.4270 0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 0.3690 -3.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8900 2.1730 -1.3880 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 -2.7020 -1.5040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 -3.6690 -1.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 12 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 6 8 1 0 0 0 0 6 22 2 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 12 13 2 0 0 0 0 12 23 1 0 0 0 0 23 24 1 0 0 0 0 M CHG 1 9 1 M CHG 1 11 -1 M END