9864 -OEChem-09292113133D 5 4 0 0 0 0 0 0 0999 V2000 1.2806 0.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2203 0.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0603 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8253 0.3659 -0.7914 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8254 -0.6399 0.5921 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 1 5 1 0 0 0 0 2 3 3 0 0 0 0 M END > 9864 > 0.4 > 1 > 5 1 -0.97 2 -0.56 3 0.68 4 0.42 5 0.42 > 0 > 4 1 1 cation 1 1 donor 1 2 acceptor 3 1 2 3 cation > 3 > 0 > 0 > 0 > 0 > 0 > 1 > 1 > 0000268800000001 > -0.0163 > 22.266 > 139733 1 18410856551055214181 21015797 1 18122344854571903783 > 51.78 1.5 0.55 0.55 0.09 0 0 0 0 0 0 0 0 0 > 84.895 > 33.9 > 2 5 10 $$$$