NIST 06191410213D 1 1.00000 -1019.08482 Copyright by the U.S. Sec. Commerce on behalf of U.S.A. All rights reserved. 2 1 0 0 0 0 0 0 0 0999 V2000 0.0222 0.0000 0.0000 V 0 0 0 0 0 0 0 0 0 0 0 0 1.5774 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 M END > Collection (C) 2016 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. > 2014-06-19 > 12035-98-2 > B3LYP/6-31G* > 1.6218 debye > -1019.08482066 hartree > "Frequency (cm-1)" "Intensity (km/mol)" 1116.8231 225.1962 > 0.0000000 GHz 17.1668285 GHz 17.1668285 GHz > Gaussian 09, Revision D.01 > Ethan Ho $$$$