NIST 07181505113D 1 1.00000 -1172.88681 Copyright by the U.S. Sec. Commerce on behalf of U.S.A. All rights reserved. 70 69 0 0 0 0 0 0 0 0999 V2000 3.6401 0.8617 0.4543 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3999 0.0598 0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5100 -1.4401 0.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2764 -2.2411 1.0149 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 -3.6694 0.7407 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5205 2.3656 0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7640 3.1658 0.3236 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4719 -4.5761 -0.4527 Si 0 0 0 0 0 0 0 0 0 0 0 0 1.1183 -6.3498 -0.3493 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3839 -4.5308 -0.0791 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7279 -3.9030 -2.2071 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6370 4.6726 0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8828 5.4719 0.1789 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7491 6.9808 0.4221 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9962 7.7801 0.0219 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8566 9.2905 0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1042 10.0903 -0.1454 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9593 11.6017 0.0748 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2068 12.4025 -0.3204 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0579 13.9144 -0.1067 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3053 14.7164 -0.4997 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1549 16.2285 -0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4060 17.0214 -0.6809 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5220 0.4638 0.9781 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8292 0.7057 -0.6181 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5158 0.4690 0.3592 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2199 0.2042 1.9469 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3998 -1.8508 1.0702 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6647 -1.5973 -0.5072 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3881 -1.8444 0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1056 -2.0644 2.0897 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1375 -4.1243 1.2044 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6421 2.7631 0.2028 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3240 2.5227 1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6402 2.7768 0.8633 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9678 2.9981 -0.7445 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6037 -6.9944 -1.0721 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1910 -6.4017 -0.5721 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9599 -6.7804 0.6466 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9592 -5.0723 -0.8407 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7679 -3.5033 -0.0527 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5987 -4.9864 0.8945 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4417 -2.8460 -2.2783 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7783 -3.9801 -2.5124 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1237 -4.4525 -2.9404 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7637 5.0613 0.0381 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4275 4.8416 1.6498 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7542 5.0906 0.7318 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0985 5.2942 -0.8852 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8799 7.3616 -0.1347 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5291 7.1596 1.4851 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8640 7.4055 0.5852 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2213 7.5942 -1.0389 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9903 9.6643 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6283 9.4770 1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9693 9.7214 0.4255 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3363 9.8986 -1.2036 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0951 11.9699 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7248 11.7937 1.1325 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0703 12.0377 0.2557 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4440 12.2071 -1.3769 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1953 14.2789 -0.6843 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8190 14.1099 0.9494 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1681 14.3545 0.0795 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5463 14.5202 -1.5553 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2947 16.5908 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9124 16.4245 0.7653 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2671 18.0965 -0.5188 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2760 16.7054 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6534 16.8734 -1.7394 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 8 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 12 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 14 50 1 0 0 0 0 14 51 1 0 0 0 0 15 16 1 0 0 0 0 15 52 1 0 0 0 0 15 53 1 0 0 0 0 16 17 1 0 0 0 0 16 54 1 0 0 0 0 16 55 1 0 0 0 0 17 18 1 0 0 0 0 17 56 1 0 0 0 0 17 57 1 0 0 0 0 18 19 1 0 0 0 0 18 58 1 0 0 0 0 18 59 1 0 0 0 0 19 20 1 0 0 0 0 19 60 1 0 0 0 0 19 61 1 0 0 0 0 20 21 1 0 0 0 0 20 62 1 0 0 0 0 20 63 1 0 0 0 0 21 22 1 0 0 0 0 21 64 1 0 0 0 0 21 65 1 0 0 0 0 22 23 1 0 0 0 0 22 66 1 0 0 0 0 22 67 1 0 0 0 0 23 68 1 0 0 0 0 23 69 1 0 0 0 0 23 70 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. > 2015-07-18 > R65061 > B3LYP/6-31G* > 0.5500 debye > -1172.88680789 hartree > "Frequency (cm-1)" "Intensity (km/mol)" 6.8918 0.0532 11.7251 0.1406 16.2936 0.0978 21.7344 0.0322 26.8194 0.0369 31.3759 0.2850 40.3732 0.1241 45.1910 0.1063 53.8027 0.2524 67.4926 0.4103 76.8504 0.0107 80.9631 0.2227 95.0336 0.6138 102.7535 0.0814 110.5567 0.0681 116.2007 1.0237 123.3397 0.0449 128.1413 0.0193 136.5979 0.0535 140.7794 1.4990 150.5814 0.6157 153.7673 0.6791 160.0201 0.8800 164.4890 0.3934 167.2025 0.1405 172.6980 0.0721 176.3869 0.0355 177.8204 0.0157 183.6556 0.2663 193.6175 1.0753 213.2186 2.1782 232.4298 6.0817 241.8421 2.3127 249.8185 0.0838 256.0631 24.5910 304.5640 41.7835 307.2705 1.3555 315.1508 4.0615 368.0997 0.8192 372.2099 5.1196 429.1566 0.5582 431.9758 3.2762 482.7665 0.9929 486.4346 1.7233 520.6577 0.3167 522.2613 0.5393 593.4285 1.6933 678.1969 16.2163 690.3748 7.5972 695.9078 0.2362 737.6016 9.8597 738.2346 0.2727 738.5059 2.8935 738.7578 9.6337 740.4919 3.2437 744.7034 2.6486 751.9715 1.9118 763.3084 2.4692 777.5723 16.5572 779.6908 4.4759 796.8426 12.0671 813.0231 4.4030 839.8670 0.5168 872.4736 9.8955 879.1889 102.4006 880.9861 78.3479 904.6622 0.8392 908.2641 81.8093 918.2736 136.4568 950.8512 3.4853 982.2633 1.4312 986.5847 0.7257 988.1816 1.5584 998.3540 2.7427 1012.8600 1.2450 1019.6731 2.1512 1023.4054 0.3731 1037.3198 1.8389 1050.4881 1.6861 1053.7552 0.4589 1055.0813 0.7898 1064.9196 0.1352 1071.2989 0.3566 1072.5910 0.0167 1073.9457 0.0074 1075.4750 0.0303 1075.9368 0.0441 1076.6301 0.1671 1091.4872 2.5005 1124.6560 20.0490 1141.9317 115.2292 1153.1462 11.6081 1160.7231 42.1733 1220.3507 0.2432 1227.4989 1.9129 1232.2654 2.1597 1246.4199 3.6910 1250.1717 0.3863 1266.8509 1.0073 1270.3784 1.5923 1287.1080 3.9544 1291.0459 0.0120 1306.2548 2.0332 1311.6517 0.5971 1322.9225 7.1196 1324.3882 29.5426 1326.1525 36.5667 1331.3385 4.0792 1334.7618 18.3206 1337.1145 0.2066 1337.6901 0.6712 1340.1755 0.0342 1342.9177 0.5822 1347.3706 0.5283 1348.6466 0.1155 1353.3315 0.0617 1354.2523 0.1733 1354.9978 2.2627 1357.8319 0.0984 1358.0680 0.1340 1373.5926 0.1048 1390.9398 1.4129 1404.7979 0.0577 1415.3033 1.3683 1422.1464 0.3434 1424.6178 0.6801 1425.9474 0.6619 1426.6314 0.5009 1428.4169 0.0541 1428.6985 0.0657 1441.2788 0.9985 1451.6356 87.5231 1487.6881 0.3712 1490.6651 0.0593 1493.1633 0.6985 1499.9806 2.1289 1501.7292 2.6244 1509.0799 4.5725 1511.9847 0.1185 1512.1207 0.0017 1513.1845 0.1473 1513.3801 0.0600 1514.7724 0.1177 1515.2303 0.0501 1516.4661 0.3150 1517.5339 0.0030 1518.3871 0.2315 1521.6375 0.1925 1525.3809 0.4308 1529.3391 0.1536 1529.8813 5.7707 1533.2317 0.7013 1536.8261 0.3692 1539.9670 0.6054 1542.5698 1.0519 1544.5660 0.2276 1545.9828 6.9258 2985.9618 57.8282 3008.7636 0.3753 3008.9650 0.0812 3009.4602 0.2962 3010.0627 0.0045 3010.5866 2.0324 3011.6371 0.8336 3012.2567 0.4578 3013.3065 1.0721 3014.4272 0.5278 3014.6753 0.4025 3016.8297 5.4482 3019.7470 1.2360 3022.9715 12.4398 3025.9662 6.6112 3028.2955 31.4765 3029.6865 424.1603 3030.4981 0.3257 3030.6290 1.3370 3030.8799 0.0756 3031.5372 1.9488 3032.8819 1.4654 3034.6010 7.1422 3035.1776 1.9990 3037.6232 5.5857 3038.5725 1.0226 3041.1460 45.2100 3042.5560 5.4198 3042.9369 1.8486 3047.6614 7.6724 3050.4867 14.5095 3054.6037 1.9283 3060.1376 0.7142 3065.4855 2.9938 3070.3686 5.8133 3074.6047 15.2016 3077.9389 65.3062 3080.0285 453.4455 3102.5219 1.6138 3105.7608 70.9991 3106.3672 43.1067 3110.2079 45.9128 3111.7379 5.3910 3114.1222 32.2698 3115.5808 6.3550 3118.0271 31.9938 3575.7748 5.1961 > 1.45665 GHz 0.02172 GHz 0.02168 GHz > Gaussian 09, Revision D.01 > Daniel Graham $$$$