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|
diagonalizing the dynamical matrix ...
q = 0.0000 0.0000 0.0000
**************************************************************************
freq ( 1) = -0.000000 [THz] = -0.000008 [cm-1]
( -0.006688 0.000000 0.097489 -0.000000 -0.700322 -0.000000 )
( -0.006688 -0.000000 0.097489 0.000000 -0.700322 0.000000 )
freq ( 2) = -0.000000 [THz] = -0.000006 [cm-1]
( 0.145426 -0.000000 -0.685191 0.000000 -0.096772 -0.000000 )
( 0.145426 0.000000 -0.685191 0.000000 -0.096772 0.000000 )
freq ( 3) = 0.000000 [THz] = 0.000002 [cm-1]
( 0.691958 0.000000 0.144946 0.000000 0.013569 0.000000 )
( 0.691958 0.000000 0.144946 0.000000 0.013569 -0.000000 )
freq ( 4) = 11.257887 [THz] = 375.522687 [cm-1]
( 0.384102 0.000000 -0.384102 -0.000000 -0.768205 -0.000000 )
( -0.138318 -0.000000 0.138318 0.000000 0.276637 0.000000 )
freq ( 5) = 11.257887 [THz] = 375.522687 [cm-1]
( -0.665285 -0.000000 -0.665285 -0.000000 0.000000 0.000000 )
( 0.239574 -0.000000 0.239574 0.000000 0.000000 0.000000 )
freq ( 6) = 12.308255 [THz] = 410.559189 [cm-1]
( -0.543203 -0.000000 0.543203 0.000000 -0.543203 -0.000000 )
( 0.195612 0.000000 -0.195612 -0.000000 0.195612 0.000000 )
**************************************************************************
diagonalizing the dynamical matrix ...
q = -0.1667 0.1667 -0.1667
**************************************************************************
freq ( 1) = 1.293813 [THz] = 43.156948 [cm-1]
( 0.413475 0.080886 -0.130703 0.047990 -0.544178 -0.032896 )
( 0.422557 0.056451 -0.129083 0.056451 -0.551640 0.000000 )
freq ( 2) = 1.293813 [THz] = 43.156948 [cm-1]
( 0.340073 0.190389 0.519161 0.201215 0.179088 0.010826 )
( 0.355106 0.171533 0.536649 0.171533 0.181543 0.000000 )
freq ( 3) = 3.225593 [THz] = 107.594216 [cm-1]
( -0.317316 -0.219756 0.317316 0.219756 -0.317316 -0.219756 )
( -0.429361 -0.000000 0.429361 0.000000 -0.429361 0.000000 )
freq ( 4) = 11.117761 [THz] = 370.848602 [cm-1]
( -0.055797 -0.003033 0.635297 0.038744 0.691095 0.041777 )
( 0.019886 -0.000121 -0.226513 -0.000121 -0.246399 0.000000 )
freq ( 5) = 11.117761 [THz] = 370.848602 [cm-1]
( -0.765762 -0.046993 -0.431164 -0.026766 0.334598 0.020227 )
( 0.273036 0.000249 0.153740 0.000249 -0.119296 0.000000 )
freq ( 6) = 12.263879 [THz] = 409.078983 [cm-1]
( -0.451567 -0.312732 0.451567 0.312732 -0.451567 -0.312732 )
( 0.177818 0.000000 -0.177818 -0.000000 0.177818 0.000000 )
**************************************************************************
diagonalizing the dynamical matrix ...
q = -0.3333 0.3333 -0.3333
**************************************************************************
freq ( 1) = 1.988456 [THz] = 66.327752 [cm-1]
( 0.549854 0.113030 0.332503 0.103029 -0.217351 -0.010001 )
( 0.572929 0.090554 0.348104 0.090554 -0.224825 0.000000 )
freq ( 2) = 1.988456 [THz] = 66.327752 [cm-1]
( -0.078939 0.032762 0.444986 0.056870 0.523925 0.024108 )
( -0.079925 0.037566 0.462016 0.037566 0.541941 0.000000 )
freq ( 3) = 5.552763 [THz] = 185.220245 [cm-1]
( 0.061103 0.295218 -0.061103 -0.295218 0.061103 0.295218 )
( 0.492388 0.000000 -0.492388 -0.000000 0.492388 0.000000 )
freq ( 4) = 10.937263 [THz] = 364.827816 [cm-1]
( 0.456685 -0.379443 0.613222 -0.372240 0.156537 0.007203 )
( -0.152910 0.139414 -0.207522 0.139414 -0.054612 0.000000 )
freq ( 5) = 10.937263 [THz] = 364.827816 [cm-1]
( 0.488106 -0.060665 -0.266020 -0.095366 -0.754126 -0.034701 )
( -0.168956 0.028939 0.094139 0.028939 0.263094 0.000000 )
freq ( 6) = 11.909497 [THz] = 397.258075 [cm-1]
( -0.114272 -0.552107 0.114272 0.552107 -0.114272 -0.552107 )
( 0.124311 0.000000 -0.124311 -0.000000 0.124311 0.000000 )
**************************************************************************
diagonalizing the dynamical matrix ...
q = 0.5000 -0.5000 0.5000
**************************************************************************
freq ( 1) = 2.009586 [THz] = 67.032590 [cm-1]
( -0.460077 0.000000 0.055753 0.000000 0.515831 -0.000000 )
( -0.478039 0.000000 0.057930 0.000000 0.535969 0.000000 )
freq ( 2) = 2.009586 [THz] = 67.032590 [cm-1]
( 0.330004 -0.000000 0.563441 -0.000000 0.233437 -0.000000 )
( 0.342887 -0.000000 0.585437 -0.000000 0.242550 -0.000000 )
freq ( 3) = 6.491898 [THz] = 216.546408 [cm-1]
( -0.141623 -0.000000 0.141623 0.000000 -0.141623 -0.000000 )
( 0.559711 0.000000 -0.559711 -0.000000 0.559711 0.000000 )
freq ( 4) = 10.939941 [THz] = 364.917158 [cm-1]
( 0.223756 0.000000 -0.527522 0.000000 -0.751278 0.000000 )
( -0.077549 -0.000000 0.182827 -0.000000 0.260376 0.000000 )
freq ( 5) = 10.939941 [THz] = 364.917158 [cm-1]
( -0.738315 0.000000 -0.562936 0.000000 0.175379 -0.000000 )
( 0.255884 -0.000000 0.195101 -0.000000 -0.060782 0.000000 )
freq ( 6) = 11.550995 [THz] = 385.299734 [cm-1]
( -0.574968 -0.000000 0.574968 0.000000 -0.574968 -0.000000 )
( -0.052390 0.000000 0.052390 -0.000000 -0.052390 0.000000 )
**************************************************************************
diagonalizing the dynamical matrix ...
q = 0.0000 0.3333 0.0000
**************************************************************************
freq ( 1) = 1.788488 [THz] = 59.657551 [cm-1]
( -0.191971 -0.314296 0.000000 -0.000000 0.518513 -0.303812 )
( -0.009949 -0.576953 0.000000 -0.000000 0.412593 0.000000 )
freq ( 2) = 1.788488 [THz] = 59.657551 [cm-1]
( 0.306102 0.517165 -0.000000 0.000000 0.320314 -0.181753 )
( 0.007114 0.412532 -0.000000 0.000000 0.577039 -0.000000 )
freq ( 3) = 3.291146 [THz] = 109.780828 [cm-1]
( 0.000000 0.000000 0.541467 -0.377074 -0.000000 0.000000 )
( -0.000000 0.000000 0.748724 -0.063571 0.000000 0.000000 )
freq ( 4) = 10.964986 [THz] = 365.752578 [cm-1]
( -0.657402 0.347412 0.000000 0.000000 -0.576828 -0.030041 )
( 0.288686 -0.058392 0.000000 -0.000000 0.163540 0.000000 )
freq ( 5) = 10.964986 [THz] = 365.752578 [cm-1]
( 0.155175 -0.556375 -0.000000 0.000000 -0.538640 0.512582 )
( -0.160294 0.032422 -0.000000 0.000000 0.294532 0.000000 )
freq ( 6) = 12.382587 [THz] = 413.038648 [cm-1]
( -0.000000 -0.000000 0.184195 -0.935505 -0.000000 0.000000 )
( 0.000000 0.000000 -0.198351 0.227065 0.000000 0.000000 )
**************************************************************************
diagonalizing the dynamical matrix ...
q = -0.1667 0.5000 -0.1667
**************************************************************************
freq ( 1) = 2.309909 [THz] = 77.050286 [cm-1]
( 0.295612 -0.399166 -0.000000 0.000000 -0.295612 0.399166 )
( 0.503270 0.000000 -0.000000 0.000000 -0.503270 0.000000 )
freq ( 2) = 2.838146 [THz] = 94.670366 [cm-1]
( 0.409842 0.068141 0.351942 -0.086662 0.409842 0.068141 )
( 0.426273 0.000000 0.362163 0.169767 0.426273 0.000000 )
freq ( 3) = 4.918071 [THz] = 164.049198 [cm-1]
( -0.134849 -0.208071 0.426655 0.161663 -0.134849 -0.208071 )
( -0.318261 0.000000 0.594188 0.336504 -0.318261 0.000000 )
freq ( 4) = 10.713567 [THz] = 357.366132 [cm-1]
( -0.396529 0.535433 0.000000 -0.000000 0.396529 -0.535433 )
( 0.236804 0.000000 -0.000000 0.000000 -0.236804 0.000000 )
freq ( 5) = 10.869444 [THz] = 362.565631 [cm-1]
( -0.602027 -0.208454 -0.259688 0.122738 -0.602027 -0.208454 )
( 0.212009 0.000000 0.073410 0.102155 0.212009 0.000000 )
freq ( 6) = 11.987264 [THz] = 399.852074 [cm-1]
( -0.066684 -0.201727 0.763406 0.516429 -0.066684 -0.201727 )
( 0.044466 -0.000000 -0.166365 -0.169112 0.044466 -0.000000 )
**************************************************************************
diagonalizing the dynamical matrix ...
q = 0.6667 -0.3333 0.6667
**************************************************************************
freq ( 1) = 2.343341 [THz] = 78.165446 [cm-1]
( 0.277300 -0.405855 0.000000 0.000000 -0.277300 0.405855 )
( 0.508317 0.000000 0.000000 0.000000 -0.508317 0.000000 )
freq ( 2) = 3.280899 [THz] = 109.439010 [cm-1]
( -0.323140 -0.065324 -0.477351 0.151100 -0.323140 -0.065324 )
( -0.336233 -0.000000 -0.506214 -0.222654 -0.336233 0.000000 )
freq ( 3) = 6.093192 [THz] = 203.247004 [cm-1]
( 0.087184 -0.224511 -0.007593 0.128594 0.087184 -0.224511 )
( -0.499116 0.000000 0.527964 0.300690 -0.499116 0.000000 )
freq ( 4) = 10.726834 [THz] = 357.808675 [cm-1]
( -0.376722 0.551369 0.000000 -0.000000 0.376722 -0.551369 )
( 0.232536 0.000000 -0.000000 0.000000 -0.232536 0.000000 )
freq ( 5) = 10.836321 [THz] = 361.460757 [cm-1]
( -0.452244 -0.460805 -0.270453 0.060801 -0.452244 -0.460805 )
( 0.145996 0.000000 0.064330 0.206542 0.145996 0.000000 )
freq ( 6) = 11.308748 [THz] = 377.219246 [cm-1]
( 0.251988 0.036822 -0.689794 0.603907 0.251988 0.036822 )
( 0.076215 -0.000000 0.111745 -0.075286 0.076215 -0.000000 )
**************************************************************************
diagonalizing the dynamical matrix ...
q = 0.5000 -0.1667 0.5000
**************************************************************************
freq ( 1) = 2.387457 [THz] = 79.636982 [cm-1]
( -0.255596 0.415157 -0.000000 0.000000 0.255596 -0.415157 )
( -0.512167 0.000000 -0.000000 -0.000000 0.512167 0.000000 )
freq ( 2) = 3.287392 [THz] = 109.655587 [cm-1]
( 0.254515 0.079225 0.552509 -0.181209 0.254515 0.079225 )
( 0.273821 -0.000000 0.535602 0.288032 0.273821 0.000000 )
freq ( 3) = 5.803105 [THz] = 193.570757 [cm-1]
( 0.141368 0.180301 -0.245911 -0.176055 0.141368 0.180301 )
( -0.533397 -0.000000 0.404515 0.266251 -0.533397 0.000000 )
freq ( 4) = 10.791621 [THz] = 359.969734 [cm-1]
( -0.350683 0.569603 0.000000 -0.000000 0.350683 -0.569603 )
( 0.229289 0.000000 -0.000000 0.000000 -0.229289 0.000000 )
freq ( 5) = 10.806343 [THz] = 360.460816 [cm-1]
( -0.564218 -0.230745 -0.379428 0.168575 -0.564218 -0.230745 )
( 0.064403 0.000000 0.242002 0.132611 0.064403 0.000000 )
freq ( 6) = 11.341782 [THz] = 378.321134 [cm-1]
( 0.193552 0.302181 -0.816138 -0.163519 0.193552 0.302181 )
( 0.148568 -0.000000 -0.006748 0.073748 0.148568 -0.000000 )
**************************************************************************
diagonalizing the dynamical matrix ...
q = 0.3333 0.0000 0.3333
**************************************************************************
freq ( 1) = 1.871430 [THz] = 62.424180 [cm-1]
( 0.246295 -0.426596 0.000000 0.000000 -0.246295 0.426596 )
( 0.507302 -0.000000 0.000000 0.000000 -0.507302 0.000000 )
freq ( 2) = 2.893042 [THz] = 96.501497 [cm-1]
( -0.062128 0.107608 0.581623 0.335800 -0.062128 0.107608 )
( 0.136618 -0.000000 0.000000 0.693358 0.136618 0.000000 )
freq ( 3) = 4.313553 [THz] = 143.884640 [cm-1]
( 0.204222 -0.353722 0.189206 0.109238 0.204222 -0.353722 )
( 0.531227 0.000000 -0.000000 -0.232833 0.531227 0.000000 )
freq ( 4) = 10.966173 [THz] = 365.792141 [cm-1]
( 0.333739 -0.578053 0.000000 0.000000 -0.333739 0.578053 )
( -0.233394 -0.000000 0.000000 -0.000000 0.233394 0.000000 )
freq ( 5) = 11.041660 [THz] = 368.310142 [cm-1]
( -0.125988 0.218218 0.758450 0.437891 -0.125988 0.218218 )
( -0.063660 -0.000000 0.000000 -0.312915 -0.063660 0.000000 )
freq ( 6) = 11.863612 [THz] = 395.727495 [cm-1]
( 0.319076 -0.552656 0.287259 0.165849 0.319076 -0.552656 )
( -0.191977 -0.000000 -0.000000 0.042320 -0.191977 0.000000 )
**************************************************************************
diagonalizing the dynamical matrix ...
q = 0.0000 0.6667 0.0000
**************************************************************************
freq ( 1) = 2.752970 [THz] = 91.829203 [cm-1]
( -0.323269 -0.109561 -0.000000 0.000000 0.221971 -0.575916 )
( -0.117297 -0.695143 -0.000000 -0.000000 0.074574 0.000000 )
freq ( 2) = 2.752970 [THz] = 91.829203 [cm-1]
( 0.538017 0.302470 -0.000000 0.000000 0.179360 -0.290408 )
( 0.012408 0.073535 -0.000000 0.000000 0.704970 0.000000 )
freq ( 3) = 5.631726 [THz] = 187.854160 [cm-1]
( 0.000000 -0.000000 -0.251031 0.407204 0.000000 0.000000 )
( 0.000000 0.000000 -0.877797 -0.025328 -0.000000 0.000000 )
freq ( 4) = 10.461195 [THz] = 348.947904 [cm-1]
( 0.472820 -0.238432 0.000000 -0.000000 0.775005 -0.072086 )
( -0.277419 0.072743 0.000000 0.000000 -0.177508 0.000000 )
freq ( 5) = 10.461195 [THz] = 348.947904 [cm-1]
( 0.493822 0.601639 0.000000 -0.000000 -0.163040 -0.503812 )
( 0.171703 -0.045023 -0.000000 0.000000 -0.286798 0.000000 )
freq ( 6) = 12.306991 [THz] = 410.517039 [cm-1]
( -0.000000 0.000000 0.001548 -0.981297 -0.000000 0.000000 )
( 0.000000 -0.000000 -0.166856 0.095984 0.000000 0.000000 )
**************************************************************************
diagonalizing the dynamical matrix ...
q = 0.8333 -0.1667 0.8333
**************************************************************************
freq ( 1) = 2.792366 [THz] = 93.143305 [cm-1]
( -0.228788 -0.439243 0.000000 0.000000 0.228788 0.439243 )
( 0.504700 0.000000 -0.000000 0.000000 -0.504700 0.000000 )
freq ( 2) = 3.582113 [THz] = 119.486423 [cm-1]
( 0.431773 0.200788 0.139393 -0.132173 0.431773 0.200788 )
( 0.484716 0.000000 0.078707 0.183077 0.484716 0.000000 )
freq ( 3) = 6.123623 [THz] = 204.262078 [cm-1]
( 0.096982 -0.070176 0.221158 0.109305 0.096982 -0.070176 )
( -0.211827 0.000000 0.264207 0.866565 -0.211827 0.000000 )
freq ( 4) = 10.451037 [THz] = 348.609064 [cm-1]
( -0.580586 -0.328445 0.060911 0.022247 -0.580586 -0.328445 )
( 0.210286 -0.000000 -0.021319 0.130339 0.210286 -0.000000 )
freq ( 5) = 10.470893 [THz] = 349.271403 [cm-1]
( -0.307990 -0.591302 -0.000000 -0.000000 0.307990 0.591302 )
( -0.235593 0.000000 0.000000 -0.000000 0.235593 0.000000 )
freq ( 6) = 11.790226 [THz] = 393.279603 [cm-1]
( 0.016008 0.028530 -0.587071 0.798045 0.016008 0.028530 )
( 0.049679 0.000000 0.106280 0.009962 0.049679 0.000000 )
**************************************************************************
diagonalizing the dynamical matrix ...
q = 0.6667 0.0000 0.6667
**************************************************************************
freq ( 1) = 2.801250 [THz] = 93.439643 [cm-1]
( 0.243398 0.421578 -0.000000 -0.000000 -0.243398 -0.421578 )
( -0.512863 -0.000000 0.000000 0.000000 0.512863 0.000000 )
freq ( 2) = 4.187839 [THz] = 139.691281 [cm-1]
( -0.196096 -0.339648 -0.383001 0.221126 -0.196096 -0.339648 )
( -0.375080 -0.000000 0.000000 -0.464127 -0.375080 0.000000 )
freq ( 3) = 5.979253 [THz] = 199.446406 [cm-1]
( -0.057369 -0.099367 0.106199 -0.061314 -0.057369 -0.099367 )
( 0.465539 -0.000000 -0.000000 -0.724693 0.465539 0.000000 )
freq ( 4) = 10.314325 [THz] = 344.048846 [cm-1]
( 0.338652 0.586562 -0.125035 0.072189 0.338652 0.586562 )
( -0.095354 -0.000000 0.000000 -0.208540 -0.095354 0.000000 )
freq ( 5) = 10.557616 [THz] = 352.164147 [cm-1]
( 0.334550 0.579458 -0.000000 0.000000 -0.334550 -0.579458 )
( 0.228702 0.000000 -0.000000 -0.000000 -0.228702 0.000000 )
freq ( 6) = 11.260693 [THz] = 375.616291 [cm-1]
( 0.000676 0.001171 0.843961 -0.487261 0.000676 0.001171 )
( -0.135965 -0.000000 0.000000 -0.115458 -0.135965 0.000000 )
**************************************************************************
diagonalizing the dynamical matrix ...
q = 0.0000 -1.0000 0.0000
**************************************************************************
freq ( 1) = 2.840016 [THz] = 94.732751 [cm-1]
( -0.325439 -0.000000 -0.000000 -0.000000 -0.628404 -0.000000 )
( -0.627397 -0.000000 -0.000000 0.000000 -0.324917 0.000000 )
freq ( 2) = 2.840016 [THz] = 94.732751 [cm-1]
( 0.628404 -0.000000 -0.000000 -0.000000 -0.325439 -0.000000 )
( -0.324917 -0.000000 -0.000000 0.000000 0.627397 0.000000 )
freq ( 3) = 6.562489 [THz] = 218.901059 [cm-1]
( 0.000000 0.000000 0.000000 -0.000000 0.000000 0.000000 )
( -0.000000 0.000000 -1.000000 0.000000 -0.000000 0.000000 )
freq ( 4) = 10.441942 [THz] = 348.305692 [cm-1]
( -0.800043 0.000000 -0.000000 0.000000 -0.494786 -0.000000 )
( 0.178462 0.000000 -0.000000 0.000000 0.288564 0.000000 )
freq ( 5) = 10.441942 [THz] = 348.305692 [cm-1]
( -0.494786 0.000000 0.000000 -0.000000 0.800043 0.000000 )
( -0.288564 -0.000000 0.000000 -0.000000 0.178462 0.000000 )
freq ( 6) = 12.209979 [THz] = 407.281053 [cm-1]
( 0.000000 -0.000000 1.000000 -0.000000 -0.000000 -0.000000 )
( 0.000000 0.000000 0.000000 0.000000 -0.000000 0.000000 )
**************************************************************************
diagonalizing the dynamical matrix ...
q = 0.6667 -0.3333 1.0000
**************************************************************************
freq ( 1) = 3.039087 [THz] = 101.373030 [cm-1]
( 0.314584 0.544876 0.137843 0.238752 -0.086808 0.050118 )
( -0.000000 0.546184 -0.000000 0.352419 0.309159 0.000000 )
freq ( 2) = 3.541649 [THz] = 118.136697 [cm-1]
( 0.131331 0.227473 -0.092205 -0.159704 0.533914 -0.308255 )
( 0.000000 -0.418222 0.000000 0.087091 0.578291 0.000000 )
freq ( 3) = 5.566404 [THz] = 185.675247 [cm-1]
( -0.048052 -0.083228 0.176256 0.305284 0.224108 -0.129389 )
( -0.000000 -0.290312 -0.000000 0.761564 -0.367794 0.000000 )
freq ( 4) = 10.472048 [THz] = 349.309925 [cm-1]
( 0.471785 0.817155 -0.035770 -0.061956 -0.046444 0.026814 )
( 0.000000 -0.166329 -0.000000 -0.119967 -0.244183 0.000000 )
freq ( 5) = 10.811891 [THz] = 360.645854 [cm-1]
( 0.000131 0.000227 0.135559 0.234795 -0.785942 0.453764 )
( 0.000000 -0.253665 0.000000 0.059521 0.187082 0.000000 )
freq ( 6) = 11.432032 [THz] = 381.331534 [cm-1]
( 0.003445 0.005967 0.470157 0.814337 0.237650 -0.137207 )
( -0.000000 -0.032212 -0.000000 -0.198379 0.008083 -0.000000 )
**************************************************************************
diagonalizing the dynamical matrix ...
q = 0.5000 -0.1667 0.8333
**************************************************************************
freq ( 1) = 3.209792 [THz] = 107.067128 [cm-1]
( 0.013178 0.606546 -0.061955 0.232229 -0.071982 -0.229319 )
( -0.440379 0.267172 -0.163663 0.314249 0.354314 0.000000 )
freq ( 2) = 3.949862 [THz] = 131.753224 [cm-1]
( 0.241929 0.236794 0.141579 -0.401983 0.398853 -0.150171 )
( 0.110589 -0.431172 0.352801 0.193719 0.402486 0.000000 )
freq ( 3) = 5.954388 [THz] = 198.617017 [cm-1]
( -0.134367 0.060279 0.111481 -0.088389 -0.140146 0.024494 )
( 0.293103 0.211690 -0.199714 -0.603050 0.635259 0.000000 )
freq ( 4) = 10.435554 [THz] = 348.092612 [cm-1]
( -0.040179 -0.893278 0.167894 0.175851 0.151429 -0.190213 )
( -0.053149 0.033958 -0.083116 0.179474 0.197786 0.000000 )
freq ( 5) = 10.822469 [THz] = 360.998717 [cm-1]
( 0.041609 0.020841 0.263319 0.620789 -0.654848 0.160905 )
( -0.016363 -0.275818 0.077106 -0.009181 0.077651 0.000000 )
freq ( 6) = 10.898799 [THz] = 363.544789 [cm-1]
( -0.123476 -0.169949 -0.671471 -0.073036 -0.138029 0.661177 )
( -0.009402 0.021117 0.098025 0.108867 0.146495 0.000000 )
**************************************************************************
diagonalizing the dynamical matrix ...
q = -0.3333 -1.0000 0.0000
**************************************************************************
freq ( 1) = 3.478594 [THz] = 116.033402 [cm-1]
( 0.627738 0.362425 0.000000 -0.000000 0.000000 0.000000 )
( 0.000000 0.000000 -0.000000 0.258580 0.638537 0.000000 )
freq ( 2) = 3.713427 [THz] = 123.866587 [cm-1]
( 0.000000 0.000000 -0.242661 0.087590 -0.208877 -0.578675 )
( -0.569386 -0.480362 -0.000000 0.000000 0.000000 0.000000 )
freq ( 3) = 6.148235 [THz] = 205.083061 [cm-1]
( 0.119678 0.069096 -0.000000 0.000000 -0.000000 -0.000000 )
( 0.000000 -0.000000 -0.000000 0.897054 -0.419759 0.000000 )
freq ( 4) = 10.427654 [THz] = 347.829089 [cm-1]
( 0.000000 0.000000 -0.036668 0.084979 0.879138 0.379349 )
( -0.271369 0.031685 -0.000000 -0.000000 -0.000000 0.000000 )
freq ( 5) = 10.515436 [THz] = 350.757175 [cm-1]
( -0.808095 -0.466554 0.000000 0.000000 0.000000 0.000000 )
( -0.000000 0.000000 -0.000000 0.193572 0.303052 0.000000 )
freq ( 6) = 11.314469 [THz] = 377.410046 [cm-1]
( -0.000000 -0.000000 -0.659655 -0.741393 -0.001294 0.001151 )
( -0.038777 0.116985 0.000000 0.000000 0.000000 0.000000 )
**************************************************************************
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