NIST 07061510123D 1 1.00000 -3143.43714 Copyright by the U.S. Sec. Commerce on behalf of U.S.A. All rights reserved. 18 19 0 0 0 0 0 0 0 0999 V2000 6.8416 1.1934 1.5229 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9057 1.8284 0.2497 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8017 1.7676 -0.5851 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7096 0.5290 1.9272 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6075 1.0851 -0.1971 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4700 1.0123 -1.0359 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 0.3480 -0.6317 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2739 -0.2870 0.6415 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3780 -0.2263 1.4763 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5721 0.4562 1.0883 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3198 -0.9982 3.0409 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.8295 -1.1186 1.1226 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.9713 0.2959 -1.7137 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.3502 2.6599 -0.2314 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.8598 2.5395 -2.1497 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.2083 1.2455 2.6049 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.6941 0.0576 2.9005 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4855 1.4838 -2.0092 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 2 1 0 0 0 0 2 14 1 0 0 0 0 2 3 2 0 0 0 0 3 15 1 0 0 0 0 3 5 1 0 0 0 0 4 1 2 0 0 0 0 4 17 1 0 0 0 0 5 6 2 0 0 0 0 6 18 1 0 0 0 0 7 13 1 0 0 0 0 7 8 2 0 0 0 0 7 6 1 0 0 0 0 8 12 1 0 0 0 0 8 9 1 0 0 0 0 9 11 1 0 0 0 0 9 10 2 0 0 0 0 10 4 1 0 0 0 0 10 5 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. > 2015-07-06 > R128451 > B3LYP/6-31G* > 0.0001 debye > -3143.43713880 hartree > "Frequency (cm-1)" "Intensity (km/mol)" 41.6806 0.0054 58.4969 0.1400 75.1394 0.0000 111.6604 0.3963 143.0574 0.1217 188.4354 0.0000 191.3501 0.0000 219.4034 0.3602 227.2653 0.0000 235.7586 0.0362 248.6880 0.0000 266.7823 0.0000 294.2146 0.0000 332.0771 1.1990 353.9056 0.9038 356.9369 0.0000 382.0270 0.0130 476.2454 9.0571 506.5654 0.0000 518.0440 0.0000 558.3245 61.3795 571.9106 2.0780 618.5978 0.0000 636.3873 12.4527 677.1360 0.1401 708.4370 0.0000 747.3514 0.0000 784.3100 0.0000 800.9871 108.4073 890.5298 0.0068 897.8380 30.7368 909.8297 0.0000 970.3465 53.6097 1049.0105 0.0000 1192.9765 194.1018 1193.9037 0.3198 1250.2986 6.4337 1280.4322 58.0819 1373.6436 112.2934 1383.6809 0.0044 1400.7204 0.0001 1424.5658 0.0004 1481.0120 106.9170 1573.4685 0.0006 1603.6277 81.1142 1639.6822 0.0004 3259.7137 1.3137 3260.2309 4.5782 > 0.44200 GHz 0.18756 GHz 0.13168 GHz > Gaussian 09, Revision D.01 > Avi Newman $$$$