PUBCHEM-ZINC05836914 MOE2007 3D CORINA 3.40 0006 02.08.2006 24 25 0 0 1 0 0 0 0 0999 V2000 -0.0090 1.0120 0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -0.2830 0.0660 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 -0.4970 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9420 -0.9880 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 0.8920 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 1.7740 0.0570 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 1.1270 -0.4550 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8160 0.2540 -1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1310 -0.8210 -1.8140 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 -1.2140 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 -2.2730 -1.6790 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 -3.1310 -2.8320 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5740 -3.5420 -2.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3480 -2.3830 -4.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -1.5630 -4.0920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -1.3100 -3.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 -4.3160 -2.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 -4.2130 -1.8630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 1.5020 0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8570 0.3770 -1.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4280 -2.5770 -1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1920 -1.7130 -4.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 -3.0540 -5.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 -5.2410 -3.6150 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 10 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 20 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 24 1 0 0 0 0 M CHG 1 24 -1 M END