NIST 07081513473D 1 1.00000 -5143.39911 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 -0.0209 0.0000 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.3009 0.0000 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 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. > 2015-07-08 > 7726-95-6 > B3LYP/6-31G* > 0.0000 debye > -5143.39911208 hartree > "Frequency (cm-1)" "Intensity (km/mol)" 327.1539 0.0000 > 0.0000000 GHz 2.3758535 GHz 2.3758535 GHz > Gaussian 09, Revision D.01 > Ashley Zhang $$$$