NIST 08031215063D 1 1.00000 -1908.70543 Copyright by the U.S. Sec. Commerce on behalf of U.S.A. All rights reserved. 12 12 0 0 0 0 0 0 0 0999 V2000 6.3370 1.8652 -0.6721 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3904 3.1938 -1.0245 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.8579 0.6136 -0.3379 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9507 2.0251 -0.7169 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1778 0.4470 -0.2916 F 0 0 0 0 0 0 0 0 0 0 0 0 6.0209 -0.4666 -0.0514 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4402 3.2129 -1.0341 F 0 0 0 0 0 0 0 0 0 0 0 0 4.0894 0.9628 -0.4352 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6852 -2.0117 0.3615 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.6386 -0.2774 -0.1039 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3723 1.1796 -0.4955 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.8288 -1.2987 0.1670 F 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 3 5 1 0 4 7 1 0 6 9 1 0 8 11 1 0 10 12 1 0 1 3 1 0 3 6 2 0 6 10 1 0 10 8 2 0 8 4 1 0 1 4 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. > 2012-08-03 > 319-88-0 > B3LYP/6-31G* > 0.0003 debye > -1908.70543281 hartree > "Frequency (cm-1)" "Intensity (km/mol)" 103.7095 0.0000 103.9675 0.0000 118.8885 0.0718 185.5490 0.0065 185.5765 0.0066 213.0750 1.6383 248.0181 0.0000 303.3258 0.7034 303.7092 0.7018 354.8289 0.0000 355.1277 0.0000 383.1203 0.0000 402.5879 0.0282 402.7424 0.0291 587.4423 0.0000 640.4554 0.0001 640.8634 0.0001 694.9409 10.0132 726.9162 0.0001 792.7751 102.8448 792.8718 102.8540 1113.5283 21.4935 1113.7386 21.5663 1175.7261 0.0000 1316.7372 0.0002 1452.6353 0.0007 1485.4322 209.5736 1485.5844 209.5336 1633.1700 27.5900 1633.2409 27.5861 > 0.63422 GHz 0.63416 GHz 0.31710 GHz > Gaussian 09, Revision C.01 > Alexander Yang $$$$