NIST 08031215063D 1 1.00000 -1418.62347 Copyright by the U.S. Sec. Commerce on behalf of U.S.A. All rights reserved. 4 3 0 0 0 0 0 0 0 0999 V2000 1.0723 0.1024 -0.1796 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7807 -0.0348 0.0633 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.3728 1.6670 0.0633 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.3725 -0.8880 -1.4134 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 1 3 1 0 1 4 1 0 M RAD 1 1 2 M END > Collection (C) 2016 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. > 2012-08-03 > 3170-80-7 > B3LYP/6-31G* > 0.2116 debye > -1418.62346853 hartree > "Frequency (cm-1)" "Intensity (km/mol)" 274.6834 0.0725 275.1825 0.0786 332.2706 0.1532 481.5367 0.0120 873.2287 217.5816 875.5731 218.2140 > 3.30270 GHz 3.29550 GHz 1.66052 GHz > Gaussian 09, Revision C.01 > Alexander Yang $$$$