NIST 08031215073D 1 1.00000 -476.76049 Copyright by the U.S. Sec. Commerce on behalf of U.S.A. All rights reserved. 8 7 0 0 0 0 0 0 0 0999 V2000 10.0002 16.9625 -0.0164 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5228 17.0046 -0.0407 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9754 16.9942 1.2417 F 0 0 0 0 0 0 0 0 0 0 0 0 11.9756 15.8889 -0.6730 F 0 0 0 0 0 0 0 0 0 0 0 0 9.5474 18.0781 0.6159 F 0 0 0 0 0 0 0 0 0 0 0 0 9.5476 16.9729 -1.2988 F 0 0 0 0 0 0 0 0 0 0 0 0 9.6262 16.0716 0.4981 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8968 17.8955 -0.5552 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 1 5 1 0 1 6 1 0 2 3 1 0 2 4 1 0 1 7 1 0 2 8 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. > 2012-08-03 > 359-35-3 > B3LYP/6-31G* > 0.0000 debye > -476.760491397 hartree > "Frequency (cm-1)" "Intensity (km/mol)" 86.0571 1.9556 199.6270 2.0927 356.6553 0.0000 413.7686 44.7263 484.4958 0.0000 532.6207 8.7156 621.5747 0.0000 1125.5073 0.0000 1137.8028 0.0001 1146.7709 209.4439 1162.4919 0.0002 1169.8429 349.7963 1336.6807 35.1465 1391.2910 57.4099 1418.5810 0.0000 1487.1388 0.0000 3108.7496 0.0000 3119.6378 66.0802 > 5.05158 GHz 3.14854 GHz 2.05284 GHz > Gaussian 09, Revision C.01 > Alexander Yang $$$$