NIST 08041407153D 1 1.00000 -952.28595 Copyright by the U.S. Sec. Commerce on behalf of U.S.A. All rights reserved. 44 43 0 0 0 0 0 0 0 0999 V2000 16.7521 35.0642 0.3472 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0952 34.3989 0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2128 33.2100 -0.4431 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2573 38.2083 1.0825 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3147 37.1998 -0.1745 Si 0 0 0 0 0 0 0 0 0 0 0 0 22.2632 38.0043 -1.8783 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3069 35.1412 0.6825 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6710 36.3798 -0.1511 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7689 37.0653 0.4353 O 0 0 0 0 0 0 0 0 0 0 0 0 26.1828 29.3592 -2.8035 C 0 0 0 0 0 0 0 0 0 0 0 0 25.0511 30.3776 -2.9734 C 0 0 0 0 0 0 0 0 0 0 0 0 25.1239 31.5347 -1.9685 C 0 0 0 0 0 0 0 0 0 0 0 0 23.9940 32.5601 -2.1275 C 0 0 0 0 0 0 0 0 0 0 0 0 22.9512 34.7254 -1.2622 C 0 0 0 0 0 0 0 0 0 0 0 0 23.0922 35.7287 -0.2635 O 0 0 0 0 0 0 0 0 0 0 0 0 24.0768 33.7073 -1.1124 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9380 34.4465 -0.0441 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5567 35.2535 1.4116 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7050 36.0394 -0.1551 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1782 32.7245 -0.5661 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3483 32.6742 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 23.3029 37.6795 2.0406 H 0 0 0 0 0 0 0 0 0 0 0 0 24.2851 38.3919 0.7502 H 0 0 0 0 0 0 0 0 0 0 0 0 22.7749 39.1767 1.2547 H 0 0 0 0 0 0 0 0 0 0 0 0 21.6470 37.4485 -2.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 23.2696 38.0884 -2.3057 H 0 0 0 0 0 0 0 0 0 0 0 0 21.8457 39.0155 -1.8069 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1322 35.4779 1.7138 H 0 0 0 0 0 0 0 0 0 0 0 0 20.1778 34.4761 0.7071 H 0 0 0 0 0 0 0 0 0 0 0 0 19.8856 36.0746 -1.1861 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8255 37.0778 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 26.1037 28.5469 -3.5351 H 0 0 0 0 0 0 0 0 0 0 0 0 27.1642 29.8315 -2.9348 H 0 0 0 0 0 0 0 0 0 0 0 0 26.1644 28.9096 -1.8031 H 0 0 0 0 0 0 0 0 0 0 0 0 24.0821 29.8686 -2.8699 H 0 0 0 0 0 0 0 0 0 0 0 0 25.0734 30.7828 -3.9952 H 0 0 0 0 0 0 0 0 0 0 0 0 26.0932 32.0446 -2.0719 H 0 0 0 0 0 0 0 0 0 0 0 0 25.1029 31.1289 -0.9462 H 0 0 0 0 0 0 0 0 0 0 0 0 23.0253 32.0483 -2.0264 H 0 0 0 0 0 0 0 0 0 0 0 0 24.0169 32.9682 -3.1491 H 0 0 0 0 0 0 0 0 0 0 0 0 21.9775 34.2227 -1.1554 H 0 0 0 0 0 0 0 0 0 0 0 0 22.9794 35.1731 -2.2674 H 0 0 0 0 0 0 0 0 0 0 0 0 25.0356 34.2330 -1.2136 H 0 0 0 0 0 0 0 0 0 0 0 0 24.0461 33.3092 -0.0897 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 7 1 0 4 5 1 0 5 6 1 0 5 9 1 0 5 15 1 0 7 8 1 0 8 9 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 16 1 0 14 15 1 0 14 16 1 0 1 17 1 0 1 18 1 0 1 19 1 0 3 20 1 0 3 21 1 0 4 22 1 0 4 23 1 0 4 24 1 0 6 25 1 0 6 26 1 0 6 27 1 0 7 28 1 0 7 29 1 0 8 30 1 0 8 31 1 0 10 32 1 0 10 33 1 0 10 34 1 0 11 35 1 0 11 36 1 0 12 37 1 0 12 38 1 0 13 39 1 0 13 40 1 0 14 41 1 0 14 42 1 0 16 43 1 0 16 44 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. > 2014-08-04 > U348003 > B3LYP/6-31G* > 1.6049 debye > -952.285947259 hartree > "Frequency (cm-1)" "Intensity (km/mol)" 10.9440 0.0850 21.0520 0.7629 25.5390 0.1490 32.3244 0.1551 45.8704 0.2747 50.7706 0.0290 69.6119 0.1904 79.8044 0.1797 93.2328 0.4987 113.5105 0.4789 132.7417 0.2944 139.3891 1.9243 145.6518 0.5504 157.2323 0.4366 164.0960 0.6640 170.1356 0.3967 178.5452 0.1937 189.0900 1.6676 189.8858 0.8407 231.4697 1.1386 249.7549 0.0037 264.1008 1.0031 286.5985 3.1201 314.3461 8.3757 350.4349 18.5174 379.5634 17.6055 401.1349 0.8558 444.7965 0.9643 458.9581 3.2322 469.1513 9.7160 528.2457 9.7581 626.6481 2.6627 699.8789 4.4696 723.3525 4.1399 741.3516 3.6281 755.7686 22.4152 761.1427 0.1266 778.0960 11.4971 783.4009 2.1206 804.7225 2.9031 816.6444 13.0172 822.8306 97.5038 853.6957 5.0062 889.8257 151.3503 904.1636 88.2758 907.3271 146.1952 912.5900 2.9518 925.7048 42.4930 995.1771 0.8800 1011.0823 1.2227 1018.2090 8.7393 1020.9783 0.0339 1045.9231 2.6498 1049.5224 0.6244 1065.7163 3.7350 1078.1960 1.2501 1085.5207 31.8671 1107.6907 135.7524 1123.1815 209.6405 1140.6894 386.2480 1149.6206 4.5533 1204.7729 3.2730 1246.0903 0.5813 1251.8788 30.9276 1270.8062 2.1228 1302.8248 0.1800 1309.2848 0.8952 1331.8905 11.0334 1334.2874 32.4665 1338.1429 19.2213 1339.3102 13.8084 1341.3245 1.0582 1343.5412 19.2237 1347.1245 0.2528 1353.4645 0.6002 1401.4806 5.5710 1426.7762 0.1703 1432.4684 15.8519 1441.8096 2.3920 1442.4315 6.8006 1446.8303 26.3300 1471.4265 0.1859 1491.3945 1.4237 1492.2786 0.6227 1499.1876 1.1740 1504.9293 8.4009 1508.4909 2.0053 1515.3889 0.2122 1516.7299 0.6935 1518.1701 8.0227 1523.2307 1.4055 1528.8118 7.8883 1530.0212 5.7824 1533.1715 0.7240 1542.0976 4.6908 1550.2392 2.2035 1551.6794 1.0990 1734.2105 11.9802 2995.3578 27.1066 3012.5157 14.7132 3013.3338 21.6029 3017.4263 9.5024 3027.7982 54.6560 3028.0233 38.4620 3033.8519 19.7805 3035.0189 2.7879 3042.0007 25.0542 3042.2948 22.9045 3043.8501 62.0982 3044.8155 15.6606 3046.8625 0.9997 3055.3281 2.5492 3063.0136 34.2510 3067.8846 30.8877 3081.5815 24.4637 3089.4435 83.6160 3098.3535 54.1293 3107.1161 69.4280 3111.7112 43.4414 3114.9669 17.1737 3118.9976 12.2019 3126.9124 24.2108 3129.9779 16.6027 3134.2576 9.9785 3154.7418 9.8911 3230.6226 26.2071 > 0.44992 GHz 0.18374 GHz 0.13877 GHz > Gaussian 09, Revision D.01 > Sarah Pan $$$$