NIST 06191410453D 1 1.00000 -960.48240 Copyright by the U.S. Sec. Commerce on behalf of U.S.A. All rights reserved. 3 2 0 0 0 0 0 0 0 0999 V2000 1.5618 0.2079 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.0266 -0.6429 0.0000 Sc 0 0 0 0 0 0 0 0 0 0 0 0 0.0599 -2.4427 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 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 > 14017-34-6 > B3LYP/6-31G* > 2.3061 debye > -960.482396711 hartree > "Frequency (cm-1)" "Intensity (km/mol)" 168.9367 8.8571 722.7147 127.5231 763.3409 144.8329 > 26.48823 GHz 5.73242 GHz 4.71256 GHz > Gaussian 09, Revision D.01 > Ethan Ho $$$$