73948 -OEChem-03282415583D 12 11 0 0 0 0 0 0 0999 V2000 0.0001 -1.3480 0.0001 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1467 0.6707 0.0002 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1467 0.6708 0.0002 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3843 0.0616 -0.0005 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3843 0.0616 -0.0005 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.1166 0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1033 1.6843 0.0004 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1032 1.6843 0.0004 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8866 0.4132 -0.8146 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8873 0.4125 0.8134 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8873 0.4126 0.8133 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8866 0.4131 -0.8146 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 2 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 2 7 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 3 8 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 M END > 73948 > 0.4 > 1 > 12 1 -0.57 10 0.36 11 0.36 12 0.36 2 -0.42 3 -0.42 4 -0.73 5 -0.73 6 0.69 7 0.37 8 0.37 9 0.36 > 2 > 5 1 1 acceptor 1 2 donor 1 3 donor 1 4 donor 1 5 donor > 6 > 0 > 0 > 0 > 0 > 0 > 1 > 2 > 000120DC00000001 > 6.7989 > 28.454 > 16714656 1 18335423486490306156 20096714 4 18410011061089315320 21015797 1 8789724092535291449 21040471 1 18410574002447371362 5460574 1 9223234043950898816 5943 1 17177932411447795427 > 97.68 2.77 0.95 0.53 0 0.28 0 -0.38 0 0 0 0 0 0 > 175.292 > 63 > 2 5 10 $$$$