NIST 08061409233D 1 1.00000 -987.95901 Copyright by the U.S. Sec. Commerce on behalf of U.S.A. All rights reserved. 41 41 0 0 0 0 0 0 0 0999 V2000 3.1993 -2.6651 0.3475 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8615 -2.8309 1.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7402 2.4926 -0.6476 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2646 1.3735 -1.0569 Si 0 0 0 0 0 0 0 0 0 0 0 0 2.9279 1.6989 -0.0711 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1795 3.3639 -1.8404 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2021 2.3843 -1.6858 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6833 0.0181 -2.2999 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0164 -2.9431 2.5772 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8985 -0.4073 0.6951 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2667 -1.6590 0.8905 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2819 -0.3033 0.8299 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 0.6976 0.4425 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0497 -2.7717 1.2143 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0893 -1.6673 0.7133 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0579 -1.4214 1.1489 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4381 -2.6520 1.3403 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0553 -2.5995 -0.7355 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7001 -1.7517 0.6856 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8516 -3.5189 0.5603 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3601 -3.7244 0.6639 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3735 3.1658 0.1435 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7249 2.3748 0.2677 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6224 1.0774 0.7766 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3657 1.0356 -0.8283 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0032 4.0320 -1.5551 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3646 3.9928 -2.2183 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5403 2.7502 -2.6764 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0924 1.7553 -1.8053 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4561 3.1927 -0.9899 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9881 2.8374 -2.6615 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1713 -0.6521 -2.4505 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5242 -0.5906 -1.9538 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9432 0.4457 -3.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0452 -3.0065 3.0767 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5945 -3.8371 2.8371 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5431 -2.0643 2.9649 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7363 0.6740 0.6958 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5874 -3.7393 1.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1345 -1.3221 1.2528 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0250 -3.5305 1.5939 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 9 1 0 2 15 1 0 3 4 1 0 3 5 1 0 3 6 1 0 4 7 1 0 4 8 1 0 4 13 1 0 10 13 1 0 11 15 1 0 10 11 1 0 11 14 2 0 14 17 1 0 17 16 2 0 16 12 1 0 10 12 2 0 1 18 1 0 1 19 1 0 1 20 1 0 2 21 1 0 3 22 1 0 5 23 1 0 5 24 1 0 5 25 1 0 6 26 1 0 6 27 1 0 6 28 1 0 7 29 1 0 7 30 1 0 7 31 1 0 8 32 1 0 8 33 1 0 8 34 1 0 9 35 1 0 9 36 1 0 9 37 1 0 12 38 1 0 14 39 1 0 16 40 1 0 17 41 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. > 2014-08-06 > U292674 > B3LYP/6-31G* > 1.5177 debye > -987.959009319 hartree > "Frequency (cm-1)" "Intensity (km/mol)" 25.4555 0.0303 33.8500 0.1156 42.8501 0.3227 46.3359 1.0399 61.5114 0.2361 79.0224 0.0891 121.1210 0.8304 128.4887 0.4512 138.6122 0.2318 146.9503 0.0329 170.5868 0.1976 177.0091 0.0902 192.8387 1.0257 208.6536 0.2460 215.2983 0.2381 222.1806 2.8954 240.6894 0.2354 254.8848 1.0441 258.3277 0.3167 275.2754 1.7630 293.9984 2.5156 326.8454 6.1475 344.9159 6.9426 355.7185 1.0697 407.1615 2.8092 413.4980 2.7598 454.6294 9.1153 476.0473 1.5243 518.5989 4.8278 537.9271 0.3310 570.3748 1.3811 579.3313 2.3131 612.3448 1.4842 673.3320 12.6595 691.9736 7.9806 709.6738 11.9637 733.9565 4.8757 759.9370 60.8560 763.1877 1.8678 792.9311 7.7042 801.5685 75.1559 844.4389 51.6266 850.4111 8.4136 870.1846 52.6988 883.6668 58.5285 906.4525 65.3991 919.4027 24.7993 930.9763 231.4435 941.0531 23.3624 946.9307 1.6788 955.1562 2.6399 960.2159 0.8352 984.6984 54.8064 992.3972 0.3030 1037.4043 23.9747 1076.5941 15.8922 1102.1162 7.8183 1137.7297 17.7783 1162.0396 92.1300 1169.1284 36.9682 1193.2023 10.4547 1202.0266 0.3161 1214.1195 21.0649 1249.3833 173.6523 1291.8351 1.9488 1307.4109 263.6134 1312.7460 100.3614 1327.0771 36.6606 1333.5301 45.4051 1339.7437 2.6168 1353.7962 32.6895 1386.0727 17.7460 1405.0052 6.0489 1429.7468 0.8265 1431.4830 13.4943 1445.8944 17.1330 1450.9853 1.8527 1487.0206 1.0261 1493.8998 0.5574 1496.3628 17.9157 1498.4363 6.5042 1503.6765 11.6159 1510.4947 3.8100 1517.1774 3.7128 1521.5131 1.9272 1524.4551 3.2394 1529.9629 2.5520 1537.5712 14.6736 1541.2753 11.7932 1542.1868 12.7936 1549.7547 228.1602 1639.8104 8.2217 1648.6870 38.9217 3004.1164 14.0409 3027.8881 27.9762 3031.3836 53.8825 3034.5374 25.1098 3042.8655 3.5452 3048.8141 4.5007 3055.9913 14.2772 3061.1503 17.0245 3082.7111 1.0337 3086.1627 83.8830 3101.7538 34.9488 3113.7730 0.7170 3116.4360 33.5683 3118.5505 13.1204 3124.2933 5.3483 3125.3308 24.1878 3133.3496 45.7809 3135.8041 26.4772 3139.5978 22.5866 3141.0893 9.4143 3186.7135 0.6739 3199.6730 24.5017 3211.9528 23.2609 3225.1491 12.4406 > 0.53250 GHz 0.32217 GHz 0.22592 GHz > Gaussian 09, Revision D.01 > Emily Jin $$$$