NIST 07021513133D 1 1.00000 -1554.42500 Copyright by the U.S. Sec. Commerce on behalf of U.S.A. All rights reserved. 56 55 0 0 0 0 0 0 0 0999 V2000 3.4507 1.2101 -0.3832 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7243 0.1909 0.5034 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8032 -1.2439 -0.0353 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1089 -2.2634 0.8815 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1528 -3.6590 0.3871 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3703 2.6340 0.1581 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0848 3.5069 -0.7075 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2326 5.1629 -0.4878 Si 0 0 0 0 0 0 0 0 0 0 0 0 5.3331 5.7415 -1.8984 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5382 5.9956 -0.5814 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0367 5.5408 1.1808 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6972 -4.2968 -0.3825 Si 0 0 0 0 0 0 0 0 0 0 0 0 -0.3034 -2.9000 -1.1849 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1346 -5.5179 -1.7645 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4258 -5.1653 0.8751 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6219 -4.5998 0.6754 Si 0 0 0 0 0 0 0 0 0 0 0 0 4.6591 -3.7725 2.0297 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2058 -6.3441 1.2937 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6954 -4.7502 -0.8799 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5097 0.9375 -0.4814 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0299 1.1988 -1.3973 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6679 0.4813 0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1491 0.2215 1.5182 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8570 -1.5294 -0.1617 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3521 -1.2930 -1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0653 -1.9527 1.0197 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5610 -2.2052 1.8799 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3162 2.9455 0.2344 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7951 2.6707 1.1739 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4927 6.8261 -1.8606 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3150 5.2567 -1.8559 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8863 5.5024 -2.8702 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6294 7.0832 -0.4668 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8592 5.6421 0.2039 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0577 5.8028 -1.5478 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0208 5.0640 1.2614 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1800 6.6213 1.3082 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4283 5.1922 2.0241 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1661 -3.3338 -1.7065 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6965 -2.1751 -0.4631 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2854 -2.3494 -1.9274 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2108 -5.8946 -2.2221 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7032 -6.3894 -1.4238 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7165 -5.0268 -2.5532 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7039 -4.4861 1.6904 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3538 -5.5181 0.4069 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0706 -6.0325 1.3256 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5512 -4.3841 2.2149 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0057 -2.7689 1.7591 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1137 -3.6963 2.9778 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1319 -6.8990 1.4916 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6227 -6.9354 0.5797 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6385 -6.3020 2.2311 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9790 -3.7619 -1.2613 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6201 -5.3035 -0.6698 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1727 -5.2756 -1.6872 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 1 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 8 11 1 0 5 12 1 0 12 13 1 0 12 14 1 0 12 15 1 0 5 16 1 0 16 17 1 0 16 18 1 0 16 19 1 0 1 20 1 0 1 21 1 0 2 22 1 0 2 23 1 0 3 24 1 0 3 25 1 0 4 26 1 0 4 27 1 0 6 28 1 0 6 29 1 0 9 30 1 0 9 31 1 0 9 32 1 0 10 33 1 0 10 34 1 0 10 35 1 0 11 36 1 0 11 37 1 0 11 38 1 0 13 39 1 0 13 40 1 0 13 41 1 0 14 42 1 0 14 43 1 0 14 44 1 0 15 45 1 0 15 46 1 0 15 47 1 0 17 48 1 0 17 49 1 0 17 50 1 0 18 51 1 0 18 52 1 0 18 53 1 0 19 54 1 0 19 55 1 0 19 56 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. > 2015-07-02 > R65146 > B3LYP/6-31G* > 1.1426 debye > -1554.42499956 hartree > "Frequency (cm-1)" "Intensity (km/mol)" 13.7402 0.0112 21.2799 0.0315 26.8650 0.0914 33.8305 0.1376 38.3373 0.1330 55.7908 0.0839 62.2237 0.5047 71.8062 0.1261 78.7739 0.7658 111.3064 0.0197 117.1778 0.1330 126.0134 0.1013 129.2015 0.0255 140.1575 0.1027 142.4268 0.1466 149.1951 0.1068 151.2555 0.0419 152.3560 0.0793 155.8200 0.0682 162.1433 0.0649 167.1423 0.0353 170.8076 0.0140 174.4689 0.0775 182.2623 0.1692 188.6530 0.2842 193.2999 0.2276 193.8218 0.0141 196.1657 1.3547 202.3202 0.3012 213.5435 3.0879 231.1529 4.1209 233.7381 0.3495 240.1065 0.0797 255.6435 0.1768 259.7808 2.3038 285.1407 14.2038 303.2785 11.4526 329.0150 3.4860 337.2321 4.4170 367.3330 5.0385 415.6547 2.5860 458.7560 4.9394 568.1184 2.6049 601.0181 2.3563 601.7170 2.8617 662.3525 6.3655 676.0492 4.8077 676.8984 10.6152 679.1691 8.9295 679.7920 14.4453 686.2140 9.6402 694.1421 0.0873 695.4705 6.8523 698.8449 0.0370 702.0863 0.1008 737.7100 7.0768 761.6249 0.5531 771.1024 2.4327 777.1145 17.7187 777.6237 3.1506 778.0991 20.2555 785.1814 37.5026 790.5877 17.0472 794.2749 27.3313 836.0630 13.4330 866.0728 78.1332 873.4701 24.7728 875.9194 6.9151 883.4832 152.7502 885.1184 108.4156 886.5832 105.2524 888.1341 98.0172 914.3256 322.2091 917.2798 437.9793 918.5333 91.5281 994.4722 36.3330 1009.2388 12.0826 1031.8702 7.1346 1066.3720 0.2708 1103.6113 352.1446 1108.8107 17.1221 1125.4694 330.2314 1193.6538 15.8057 1230.2077 5.5856 1260.9243 0.3909 1297.1770 4.2318 1323.0270 10.7036 1325.0879 25.5686 1325.6166 45.2761 1327.6408 30.8849 1329.1715 36.6988 1330.4525 41.4803 1332.7499 47.0230 1336.9442 3.5690 1338.4485 41.6739 1338.5603 2.4909 1341.3117 2.1040 1344.4494 0.3324 1355.1867 4.1014 1408.1640 19.2139 1422.9776 15.3799 1447.4749 29.0070 1483.4735 0.3177 1486.3477 0.2432 1487.2384 0.2282 1491.0273 0.3860 1491.4704 0.1659 1491.7919 0.0448 1491.8603 1.4036 1492.1508 0.0972 1492.6826 0.3108 1497.3702 4.4973 1498.8060 1.4667 1499.7872 0.9556 1499.9323 3.2662 1501.7318 0.6438 1504.4520 6.8202 1509.5425 9.5899 1509.8086 0.8627 1511.5759 8.1520 1515.6158 1.9932 1518.2899 0.8636 1530.6678 1.6500 1543.6005 4.4788 1550.6351 4.1601 2986.7080 32.6016 3010.9821 19.7493 3017.7446 28.9936 3029.4384 0.4897 3036.9411 10.9559 3037.7366 7.1393 3039.4484 3.7142 3039.6691 7.1449 3039.8112 24.4864 3041.2895 2.9856 3041.4633 2.1013 3042.4321 13.4973 3043.7295 7.8872 3045.0962 74.3134 3045.5901 7.6716 3046.6888 4.1916 3057.6080 3.5829 3080.1351 14.6726 3090.7966 115.7046 3105.4772 8.5726 3107.5955 7.0828 3108.2180 0.3815 3108.3604 9.6155 3108.8496 6.4950 3110.9887 35.9280 3112.0545 53.2534 3112.3853 46.2656 3116.3469 11.5838 3117.0272 8.5187 3119.0472 31.2963 3119.6896 11.3815 3121.3306 11.0071 3122.1380 15.8169 3123.3849 12.1994 3123.7769 33.1315 3125.3788 15.1417 3132.4559 12.0820 > 0.51715 GHz 0.07800 GHz 0.07323 GHz > Gaussian 09, Revision D.01 > Daniel Graham $$$$