NIST 07071509103D 1 1.00000 -2556.60008 Copyright by the U.S. Sec. Commerce on behalf of U.S.A. All rights reserved. 13 12 0 0 0 0 0 0 0 0999 V2000 0.2779 0.0155 0.3309 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2872 0.7201 -0.1871 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8597 -0.2276 -0.7994 Se 0 0 0 0 0 0 0 0 0 0 0 0 1.2458 2.2047 -0.4255 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2115 0.6281 0.3564 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6611 0.4978 0.5997 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3466 -1.0552 0.4942 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3024 2.6367 -0.0722 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0641 2.7184 0.0946 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3588 2.4292 -1.4928 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1525 0.1123 0.1532 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3217 1.6863 0.1156 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9356 0.4897 1.4024 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 5 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 5 13 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. > 2015-07-07 > 114659-08-4 > B3LYP/6-31G* > 1.5144 debye > -2556.60007663 hartree > "Frequency (cm-1)" "Intensity (km/mol)" 38.7805 1.3559 133.3294 0.2461 172.4897 0.1788 190.0820 0.3465 299.3223 0.1586 339.2009 0.6908 448.3855 7.5182 541.6074 2.8953 566.3832 0.1746 717.2932 0.8179 903.1619 4.4764 935.9709 12.3067 943.5974 5.8335 949.6313 35.5877 1026.9517 3.2239 1077.0958 0.2149 1209.2767 29.9553 1332.6336 9.4380 1433.0192 3.1687 1459.5648 0.2432 1498.8945 9.0314 1505.5885 3.7034 1512.4644 12.4291 1521.2967 5.2702 1704.1418 12.0226 3040.6779 21.3263 3080.0802 18.4961 3097.5420 20.4499 3115.6272 19.7105 3150.7952 15.9035 3173.2761 7.3644 3183.1413 7.5181 3244.7366 7.4010 > 4.87811 GHz 2.27765 GHz 1.87864 GHz > Gaussian 09, Revision D.01 > Avi Newman $$$$