PUBCHEM-ZINC05515775 MOE2007 3D CORINA 3.40 0006 02.08.2006 24 24 0 0 1 0 0 0 0 0999 V2000 0.0740 1.6570 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 0.1340 -0.0990 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0400 -0.1430 -0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -0.5540 1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0260 -0.7760 0.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8460 -1.1710 1.6130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3170 -0.4760 -0.6680 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7750 0.5180 -0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8840 -0.4710 -1.2070 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5520 -1.4990 -1.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 0.2790 -2.5020 N 0 3 0 0 0 0 0 0 0 0 0 0 1.4660 1.2570 -2.7070 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 -0.1300 -3.2730 O 0 5 0 0 0 0 0 0 0 0 0 0 3.1780 -1.5490 -1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6790 -1.4200 -1.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1010 -0.2560 -0.8120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 2.0200 0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 2.1580 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 1.9760 0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 0.0510 2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -1.5330 1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8490 -2.5470 -1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0650 -1.5040 -2.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3180 -2.5070 -1.1430 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 20 1 0 0 0 0 4 21 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 14 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 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 2 0 0 0 0 15 24 1 0 0 0 0 M CHG 1 11 1 M CHG 1 13 -1 M CHG 1 24 -1 M END