File: diam.modes_fine

package info (click to toggle)
espresso 6.7-4
links: PTS, VCS
area: main
in suites: forky, sid
size: 311,068 kB
sloc: f90: 447,429; ansic: 52,566; sh: 40,631; xml: 37,561; tcl: 20,077; lisp: 5,923; makefile: 4,503; python: 4,379; perl: 1,219; cpp: 761; fortran: 618; java: 568; awk: 128
file content (1472 lines) | stat: -rw-r--r-- 98,624 bytes
parent folder | download | duplicates (3)
     diagonalizing the dynamical matrix ...

 q =       0.0000      0.0000      0.0000
 **************************************************************************
     freq (    1) =       0.000001 [THz] =       0.000023 [cm-1]
 (  0.009974   0.000000    -0.005759   0.000000     0.707013   0.000000   )
 (  0.009974   0.000000    -0.005759   0.000000     0.707013   0.000000   )
     freq (    2) =       0.000001 [THz] =       0.000027 [cm-1]
 (  0.703445   0.000000     0.071260   0.000000    -0.009343   0.000000   )
 (  0.703445   0.000000     0.071260   0.000000    -0.009343   0.000000   )
     freq (    3) =       0.000001 [THz] =       0.000031 [cm-1]
 ( -0.071175   0.000000     0.703483   0.000000     0.006734   0.000000   )
 ( -0.071175   0.000000     0.703483   0.000000     0.006734   0.000000   )
     freq (    4) =      40.109182 [THz] =    1337.898299 [cm-1]
 ( -0.500455   0.000000     0.499544   0.000000     0.000000   0.000000   )
 (  0.500455   0.000000    -0.499544   0.000000     0.000000   0.000000   )
     freq (    5) =      40.109182 [THz] =    1337.898299 [cm-1]
 ( -0.287773   0.000000    -0.288298   0.000000     0.577989   0.000000   )
 (  0.287773   0.000000     0.288298   0.000000    -0.577989   0.000000   )
     freq (    6) =      40.109182 [THz] =    1337.898299 [cm-1]
 (  0.408327   0.000000     0.409072   0.000000     0.407344   0.000000   )
 ( -0.408327   0.000000    -0.409072   0.000000    -0.407344   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =      -0.2500      0.2500     -0.2500
 **************************************************************************
     freq (    1) =      12.190474 [THz] =     406.630448 [cm-1]
 (  0.283159   0.056162     0.566318   0.112325     0.283159   0.056162   )
 (  0.288675  -0.000000     0.577350  -0.000000     0.288675   0.000000   )
     freq (    2) =      12.190474 [THz] =     406.630450 [cm-1]
 ( -0.490446  -0.097276    -0.000000   0.000000     0.490446   0.097276   )
 ( -0.500000   0.000000    -0.000000   0.000000     0.500000   0.000000   )
     freq (    3) =      21.517617 [THz] =     717.750447 [cm-1]
 ( -0.353688  -0.203890     0.353688   0.203890    -0.353688  -0.203890   )
 ( -0.408248  -0.000000     0.408248  -0.000000    -0.408248   0.000000   )
     freq (    4) =      38.639132 [THz] =    1288.862717 [cm-1]
 (  0.490446   0.097276     0.000000   0.000000    -0.490446  -0.097276   )
 ( -0.500000  -0.000000    -0.000000  -0.000000     0.500000   0.000000   )
     freq (    5) =      38.639132 [THz] =    1288.862718 [cm-1]
 (  0.283159   0.056162     0.566318   0.112325     0.283159   0.056162   )
 ( -0.288675  -0.000000    -0.577350  -0.000000    -0.288675   0.000000   )
     freq (    6) =      40.229138 [THz] =    1341.899601 [cm-1]
 ( -0.353688  -0.203890     0.353688   0.203890    -0.353688  -0.203890   )
 (  0.408248   0.000000    -0.408248   0.000000     0.408248   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.5000     -0.5000      0.5000
 **************************************************************************
     freq (    1) =      17.028048 [THz] =     567.994538 [cm-1]
 ( -0.500000   0.000000    -0.000000   0.000000     0.500000  -0.000000   )
 ( -0.500000  -0.000000    -0.000000  -0.000000     0.500000   0.000000   )
     freq (    2) =      17.028048 [THz] =     567.994541 [cm-1]
 (  0.288675  -0.000000     0.577350  -0.000000     0.288675  -0.000000   )
 (  0.288675   0.000000     0.577350   0.000000     0.288675   0.000000   )
     freq (    3) =      31.900796 [THz] =    1064.096013 [cm-1]
 (  0.408248  -0.000000    -0.408248   0.000000     0.408248  -0.000000   )
 (  0.408248  -0.000000    -0.408248   0.000000     0.408248   0.000000   )
     freq (    4) =      37.001544 [THz] =    1234.238663 [cm-1]
 ( -0.288675   0.000000    -0.577350   0.000000    -0.288675   0.000000   )
 (  0.288675   0.000000     0.577350  -0.000000     0.288675   0.000000   )
     freq (    5) =      37.001544 [THz] =    1234.238664 [cm-1]
 ( -0.500000   0.000000    -0.000000   0.000000     0.500000  -0.000000   )
 (  0.500000   0.000000     0.000000   0.000000    -0.500000   0.000000   )
     freq (    6) =      38.855614 [THz] =    1296.083761 [cm-1]
 ( -0.408248   0.000000     0.408248  -0.000000    -0.408248   0.000000   )
 (  0.408248  -0.000000    -0.408248   0.000000     0.408248   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.2500     -0.2500      0.2500
 **************************************************************************
     freq (    1) =      12.190474 [THz] =     406.630448 [cm-1]
 (  0.283159  -0.056162     0.566318  -0.112325     0.283159  -0.056162   )
 (  0.288675   0.000000     0.577350   0.000000     0.288675   0.000000   )
     freq (    2) =      12.190474 [THz] =     406.630450 [cm-1]
 ( -0.490446   0.097276    -0.000000  -0.000000     0.490446  -0.097276   )
 ( -0.500000  -0.000000    -0.000000  -0.000000     0.500000   0.000000   )
     freq (    3) =      21.517617 [THz] =     717.750447 [cm-1]
 ( -0.353688   0.203890     0.353688  -0.203890    -0.353688   0.203890   )
 ( -0.408248   0.000000     0.408248   0.000000    -0.408248   0.000000   )
     freq (    4) =      38.639132 [THz] =    1288.862717 [cm-1]
 (  0.490446  -0.097276     0.000000  -0.000000    -0.490446   0.097276   )
 ( -0.500000   0.000000    -0.000000   0.000000     0.500000   0.000000   )
     freq (    5) =      38.639132 [THz] =    1288.862718 [cm-1]
 (  0.283159  -0.056162     0.566318  -0.112325     0.283159  -0.056162   )
 ( -0.288675   0.000000    -0.577350   0.000000    -0.288675   0.000000   )
     freq (    6) =      40.229138 [THz] =    1341.899601 [cm-1]
 ( -0.353688   0.203890     0.353688  -0.203890    -0.353688   0.203890   )
 (  0.408248  -0.000000    -0.408248  -0.000000     0.408248   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.2500      0.2500      0.2500
 **************************************************************************
     freq (    1) =      12.190474 [THz] =     406.630452 [cm-1]
 ( -0.220838  -0.498153     0.274355   0.228330    -0.053517   0.269823   )
 (  0.445670  -0.313535    -0.170591   0.313535    -0.275079   0.000000   )
     freq (    2) =      12.190474 [THz] =     406.630452 [cm-1]
 (  0.183554  -0.052108    -0.084798  -0.445800    -0.098756   0.497908   )
 (  0.086823   0.169909     0.420784  -0.169909    -0.507607   0.000000   )
     freq (    3) =      21.517617 [THz] =     717.750450 [cm-1]
 (  0.203890  -0.353688     0.203890  -0.353688     0.203890  -0.353688   )
 (  0.408248   0.000000     0.408248   0.000000     0.408248   0.000000   )
     freq (    4) =      38.639132 [THz] =    1288.862717 [cm-1]
 (  0.307880  -0.350992    -0.321076   0.417522     0.013196  -0.066530   )
 ( -0.404184  -0.233711     0.472010   0.233711    -0.067826   0.000000   )
     freq (    5) =      38.639132 [THz] =    1288.862717 [cm-1]
 (  0.092975  -0.326655     0.018572  -0.235742    -0.111547   0.562397   )
 ( -0.338502  -0.027647    -0.234851   0.027647     0.573352   0.000000   )
     freq (    6) =      40.229138 [THz] =    1341.899599 [cm-1]
 (  0.203890  -0.353688     0.203890  -0.353688     0.203890  -0.353688   )
 ( -0.408248  -0.000000    -0.408248   0.000000    -0.408248   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.0000      0.5000      0.0000
 **************************************************************************
     freq (    1) =      16.034554 [THz] =     534.855142 [cm-1]
 ( -0.237826   0.439817    -0.000000  -0.000000     0.237826  -0.439817   )
 ( -0.500000   0.000000     0.000000  -0.000000     0.500000   0.000000   )
     freq (    2) =      16.034554 [THz] =     534.855147 [cm-1]
 (  0.439817  -0.237826     0.000000  -0.000000     0.439817  -0.237826   )
 (  0.500000  -0.000000     0.000000  -0.000000     0.500000   0.000000   )
     freq (    3) =      23.072896 [THz] =     769.628960 [cm-1]
 (  0.000000  -0.000000    -0.432195   0.559650     0.000000  -0.000000   )
 (  0.000000  -0.000000    -0.701340   0.090124     0.000000   0.000000   )
     freq (    4) =      37.402124 [THz] =    1247.600550 [cm-1]
 (  0.439817  -0.237826    -0.000000   0.000000     0.439817  -0.237826   )
 ( -0.500000   0.000000     0.000000   0.000000    -0.500000   0.000000   )
     freq (    5) =      37.402124 [THz] =    1247.600552 [cm-1]
 ( -0.237826   0.439817    -0.000000   0.000000     0.237826  -0.439817   )
 (  0.500000  -0.000000     0.000000   0.000000    -0.500000   0.000000   )
     freq (    6) =      40.733389 [THz] =    1358.719598 [cm-1]
 ( -0.000000   0.000000    -0.627668   0.325627    -0.000000   0.000000   )
 (  0.000000  -0.000000     0.674081   0.213575     0.000000   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.7500     -0.2500      0.7500
 **************************************************************************
     freq (    1) =      20.904021 [THz] =     697.283088 [cm-1]
 (  0.182967  -0.465321     0.000000   0.000000    -0.182967   0.465321   )
 (  0.500000  -0.000000    -0.000000   0.000000    -0.500000   0.000000   )
     freq (    2) =      24.542229 [THz] =     818.640646 [cm-1]
 ( -0.372901   0.187892    -0.339797   0.189265    -0.372901   0.187892   )
 ( -0.417562   0.000000    -0.388617  -0.016122    -0.417562   0.000000   )
     freq (    3) =      30.345099 [THz] =    1012.203553 [cm-1]
 (  0.192757   0.254060    -0.543101   0.040473     0.192757   0.254060   )
 (  0.318907  -0.000000    -0.296024  -0.457129     0.318907   0.000000   )
     freq (    4) =      34.976150 [THz] =    1166.678795 [cm-1]
 ( -0.182967   0.465321    -0.000000  -0.000000     0.182967  -0.465321   )
 (  0.500000  -0.000000     0.000000  -0.000000    -0.500000   0.000000   )
     freq (    5) =      35.641257 [THz] =    1188.864371 [cm-1]
 (  0.465228  -0.010315    -0.192245  -0.173076     0.465228  -0.010315   )
 ( -0.465342   0.000000     0.188361  -0.177295    -0.465342   0.000000   )
     freq (    6) =      38.358011 [THz] =    1279.485524 [cm-1]
 (  0.008032   0.085629     0.676096   0.167631     0.008032   0.085629   )
 ( -0.086005  -0.000000    -0.230039  -0.657487    -0.086005   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.5000      0.0000      0.5000
 **************************************************************************
     freq (    1) =      18.354960 [THz] =     612.255560 [cm-1]
 ( -0.000000  -0.500000     0.000000  -0.000000     0.000000   0.500000   )
 (  0.500000   0.000000     0.000000   0.000000    -0.500000   0.000000   )
     freq (    2) =      23.228240 [THz] =     774.810683 [cm-1]
 (  0.000000  -0.033575    -0.705511  -0.000000     0.000000  -0.033575   )
 ( -0.033575   0.000000     0.000000  -0.705511    -0.033575   0.000000   )
     freq (    3) =      27.180543 [THz] =     906.645326 [cm-1]
 ( -0.000000   0.472984    -0.229288   0.000000    -0.000000   0.472984   )
 ( -0.472984  -0.000000    -0.000000   0.229288    -0.472984   0.000000   )
     freq (    4) =      36.319299 [THz] =    1211.481427 [cm-1]
 (  0.000000   0.500000    -0.000000  -0.000000    -0.000000  -0.500000   )
 (  0.500000   0.000000    -0.000000   0.000000    -0.500000   0.000000   )
     freq (    5) =      37.536757 [THz] =    1252.091450 [cm-1]
 (  0.000000  -0.498871     0.047482  -0.000000     0.000000  -0.498871   )
 ( -0.498871  -0.000000    -0.000000   0.047482    -0.498871   0.000000   )
     freq (    6) =      38.233790 [THz] =    1275.341968 [cm-1]
 ( -0.000000   0.162131     0.668900   0.000000    -0.000000   0.162131   )
 ( -0.162131  -0.000000     0.000000  -0.668900    -0.162131   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =      -0.5000     -0.5000     -0.5000
 **************************************************************************
     freq (    1) =      17.028048 [THz] =     567.994536 [cm-1]
 ( -0.500000   0.000000     0.500000  -0.000000    -0.000000   0.000000   )
 (  0.500000  -0.000000    -0.500000   0.000000     0.000000   0.000000   )
     freq (    2) =      17.028048 [THz] =     567.994536 [cm-1]
 ( -0.288675   0.000000    -0.288675   0.000000     0.577350  -0.000000   )
 (  0.288675   0.000000     0.288675  -0.000000    -0.577350   0.000000   )
     freq (    3) =      31.900796 [THz] =    1064.096023 [cm-1]
 (  0.408248  -0.000000     0.408248  -0.000000     0.408248  -0.000000   )
 ( -0.408248   0.000000    -0.408248  -0.000000    -0.408248   0.000000   )
     freq (    4) =      37.001544 [THz] =    1234.238665 [cm-1]
 (  0.216223   0.000000    -0.571723  -0.000000     0.355500  -0.000000   )
 (  0.216223   0.000000    -0.571723  -0.000000     0.355500   0.000000   )
     freq (    5) =      37.001544 [THz] =    1234.238665 [cm-1]
 (  0.535332   0.000000    -0.080411  -0.000000    -0.454921   0.000000   )
 (  0.535332   0.000000    -0.080411  -0.000000    -0.454921   0.000000   )
     freq (    6) =      38.855613 [THz] =    1296.083753 [cm-1]
 (  0.408248  -0.000000     0.408248  -0.000000     0.408248  -0.000000   )
 (  0.408248   0.000000     0.408248  -0.000000     0.408248   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =      -0.7500     -0.2500     -0.7500
 **************************************************************************
     freq (    1) =      20.904021 [THz] =     697.283088 [cm-1]
 (  0.465321   0.182967    -0.000000  -0.000000    -0.465321  -0.182967   )
 ( -0.500000  -0.000000     0.000000   0.000000     0.500000   0.000000   )
     freq (    2) =      24.542229 [THz] =     818.640643 [cm-1]
 ( -0.187892  -0.372901     0.189265   0.339797    -0.187892  -0.372901   )
 (  0.417562  -0.000000    -0.388617  -0.016122     0.417562   0.000000   )
     freq (    3) =      30.345099 [THz] =    1012.203556 [cm-1]
 ( -0.254060   0.192757     0.040473   0.543101    -0.254060   0.192757   )
 ( -0.318907  -0.000000    -0.296024  -0.457129    -0.318907   0.000000   )
     freq (    4) =      34.976150 [THz] =    1166.678795 [cm-1]
 (  0.465321   0.182967    -0.000000  -0.000000    -0.465321  -0.182967   )
 (  0.500000   0.000000     0.000000  -0.000000    -0.500000   0.000000   )
     freq (    5) =      35.641257 [THz] =    1188.864372 [cm-1]
 (  0.010315   0.465228    -0.173076   0.192245     0.010315   0.465228   )
 (  0.465342   0.000000     0.188361  -0.177295     0.465342   0.000000   )
     freq (    6) =      38.358011 [THz] =    1279.485524 [cm-1]
 ( -0.085629   0.008032     0.167630  -0.676096    -0.085629   0.008032   )
 (  0.086005  -0.000000    -0.230039  -0.657486     0.086005   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.0000     -1.0000      0.0000
 **************************************************************************
     freq (    1) =      24.442448 [THz] =     815.312306 [cm-1]
 (  0.500000  -0.000000     0.000000  -0.000000    -0.500000   0.000000   )
 ( -0.500000  -0.000000    -0.000000  -0.000000     0.500000   0.000000   )
     freq (    2) =      24.442448 [THz] =     815.312307 [cm-1]
 (  0.500000   0.000000     0.000000  -0.000000     0.500000   0.000000   )
 (  0.500000   0.000000     0.000000   0.000000     0.500000   0.000000   )
     freq (    3) =      32.545918 [THz] =    1085.614961 [cm-1]
 (  0.500000   0.000000    -0.000000   0.000000     0.500000   0.000000   )
 ( -0.500000   0.000000     0.000000   0.000000    -0.500000   0.000000   )
     freq (    4) =      32.545918 [THz] =    1085.614962 [cm-1]
 (  0.500000  -0.000000     0.000000  -0.000000    -0.500000   0.000000   )
 (  0.500000  -0.000000    -0.000000   0.000000    -0.500000   0.000000   )
     freq (    5) =      36.813053 [THz] =    1227.951271 [cm-1]
 (  0.000000   0.000000     0.707107  -0.000000     0.000000   0.000000   )
 ( -0.000000   0.000000    -0.707107  -0.000000    -0.000000   0.000000   )
     freq (    6) =      36.813053 [THz] =    1227.951276 [cm-1]
 ( -0.000000  -0.000000     0.707107   0.000000    -0.000000  -0.000000   )
 ( -0.000000  -0.000000     0.707107   0.000000    -0.000000   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =      -0.2500     -0.7500     -0.2500
 **************************************************************************
     freq (    1) =      20.904021 [THz] =     697.283088 [cm-1]
 (  0.465321  -0.182967     0.000000  -0.000000    -0.465321   0.182967   )
 ( -0.500000   0.000000    -0.000000   0.000000     0.500000   0.000000   )
     freq (    2) =      24.542229 [THz] =     818.640643 [cm-1]
 ( -0.187892   0.372901     0.189265  -0.339797    -0.187892   0.372901   )
 (  0.417562  -0.000000    -0.388617   0.016122     0.417562   0.000000   )
     freq (    3) =      30.345099 [THz] =    1012.203556 [cm-1]
 ( -0.254060  -0.192757     0.040473  -0.543101    -0.254060  -0.192757   )
 ( -0.318907   0.000000    -0.296024   0.457129    -0.318907   0.000000   )
     freq (    4) =      34.976150 [THz] =    1166.678795 [cm-1]
 (  0.465321  -0.182967     0.000000   0.000000    -0.465321   0.182967   )
 (  0.500000  -0.000000     0.000000   0.000000    -0.500000   0.000000   )
     freq (    5) =      35.641257 [THz] =    1188.864372 [cm-1]
 (  0.010315  -0.465228    -0.173076  -0.192245     0.010315  -0.465228   )
 (  0.465342  -0.000000     0.188361   0.177295     0.465342   0.000000   )
     freq (    6) =      38.358011 [THz] =    1279.485524 [cm-1]
 ( -0.085629  -0.008032     0.167630   0.676096    -0.085629  -0.008032   )
 (  0.086005  -0.000000    -0.230039   0.657486     0.086005   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =      -0.2500     -0.2500     -0.2500
 **************************************************************************
     freq (    1) =      12.190474 [THz] =     406.630452 [cm-1]
 ( -0.220838   0.498153     0.274355  -0.228330    -0.053517  -0.269823   )
 (  0.445670   0.313535    -0.170591  -0.313535    -0.275079   0.000000   )
     freq (    2) =      12.190474 [THz] =     406.630452 [cm-1]
 (  0.183554   0.052108    -0.084798   0.445800    -0.098756  -0.497908   )
 (  0.086823  -0.169909     0.420784   0.169909    -0.507607   0.000000   )
     freq (    3) =      21.517617 [THz] =     717.750450 [cm-1]
 (  0.203890   0.353688     0.203890   0.353688     0.203890   0.353688   )
 (  0.408248  -0.000000     0.408248  -0.000000     0.408248   0.000000   )
     freq (    4) =      38.639132 [THz] =    1288.862717 [cm-1]
 (  0.307880   0.350992    -0.321076  -0.417522     0.013196   0.066530   )
 ( -0.404184   0.233711     0.472010  -0.233711    -0.067826   0.000000   )
     freq (    5) =      38.639132 [THz] =    1288.862717 [cm-1]
 (  0.092975   0.326655     0.018572   0.235742    -0.111547  -0.562397   )
 ( -0.338502   0.027647    -0.234851  -0.027647     0.573352   0.000000   )
     freq (    6) =      40.229138 [THz] =    1341.899599 [cm-1]
 (  0.203890   0.353688     0.203890   0.353688     0.203890   0.353688   )
 ( -0.408248   0.000000    -0.408248  -0.000000    -0.408248   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =      -0.5000      0.0000     -0.5000
 **************************************************************************
     freq (    1) =      18.354960 [THz] =     612.255560 [cm-1]
 ( -0.000000   0.500000     0.000000   0.000000     0.000000  -0.500000   )
 (  0.500000  -0.000000     0.000000   0.000000    -0.500000   0.000000   )
     freq (    2) =      23.228240 [THz] =     774.810683 [cm-1]
 (  0.000000   0.033575    -0.705511   0.000000     0.000000   0.033575   )
 ( -0.033575  -0.000000     0.000000   0.705511    -0.033575   0.000000   )
     freq (    3) =      27.180543 [THz] =     906.645326 [cm-1]
 ( -0.000000  -0.472984    -0.229288  -0.000000    -0.000000  -0.472984   )
 ( -0.472984   0.000000    -0.000000  -0.229288    -0.472984   0.000000   )
     freq (    4) =      36.319299 [THz] =    1211.481427 [cm-1]
 (  0.000000  -0.500000    -0.000000   0.000000    -0.000000   0.500000   )
 (  0.500000  -0.000000    -0.000000  -0.000000    -0.500000   0.000000   )
     freq (    5) =      37.536757 [THz] =    1252.091450 [cm-1]
 (  0.000000   0.498871     0.047482   0.000000     0.000000   0.498871   )
 ( -0.498871   0.000000    -0.000000  -0.047482    -0.498871   0.000000   )
     freq (    6) =      38.233790 [THz] =    1275.341968 [cm-1]
 ( -0.000000  -0.162131     0.668900  -0.000000    -0.000000  -0.162131   )
 ( -0.162131   0.000000     0.000000   0.668900    -0.162131   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.2500     -0.7500      0.2500
 **************************************************************************
     freq (    1) =      20.904021 [THz] =     697.283088 [cm-1]
 (  0.182967   0.465321    -0.000000  -0.000000    -0.182967  -0.465321   )
 (  0.500000   0.000000    -0.000000  -0.000000    -0.500000   0.000000   )
     freq (    2) =      24.542229 [THz] =     818.640646 [cm-1]
 ( -0.372901  -0.187892    -0.339797  -0.189265    -0.372901  -0.187892   )
 ( -0.417562   0.000000    -0.388617   0.016122    -0.417562   0.000000   )
     freq (    3) =      30.345099 [THz] =    1012.203553 [cm-1]
 (  0.192757  -0.254060    -0.543101  -0.040473     0.192757  -0.254060   )
 (  0.318907   0.000000    -0.296024   0.457129     0.318907   0.000000   )
     freq (    4) =      34.976150 [THz] =    1166.678795 [cm-1]
 ( -0.182967  -0.465321    -0.000000   0.000000     0.182967   0.465321   )
 (  0.500000  -0.000000     0.000000   0.000000    -0.500000   0.000000   )
     freq (    5) =      35.641257 [THz] =    1188.864371 [cm-1]
 (  0.465228   0.010315    -0.192245   0.173076     0.465228   0.010315   )
 ( -0.465342   0.000000     0.188361   0.177295    -0.465342   0.000000   )
     freq (    6) =      38.358011 [THz] =    1279.485524 [cm-1]
 (  0.008032  -0.085629     0.676096  -0.167631     0.008032  -0.085629   )
 ( -0.086005  -0.000000    -0.230039   0.657487    -0.086005   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.0000     -0.5000      0.0000
 **************************************************************************
     freq (    1) =      16.034554 [THz] =     534.855142 [cm-1]
 ( -0.237826  -0.439817    -0.000000   0.000000     0.237826   0.439817   )
 ( -0.500000  -0.000000     0.000000   0.000000     0.500000   0.000000   )
     freq (    2) =      16.034554 [THz] =     534.855147 [cm-1]
 (  0.439817   0.237826     0.000000   0.000000     0.439817   0.237826   )
 (  0.500000   0.000000     0.000000   0.000000     0.500000   0.000000   )
     freq (    3) =      23.072896 [THz] =     769.628960 [cm-1]
 (  0.000000   0.000000    -0.432195  -0.559650     0.000000   0.000000   )
 (  0.000000   0.000000    -0.701340  -0.090124     0.000000   0.000000   )
     freq (    4) =      37.402124 [THz] =    1247.600550 [cm-1]
 (  0.439817   0.237826    -0.000000  -0.000000     0.439817   0.237826   )
 ( -0.500000  -0.000000     0.000000  -0.000000    -0.500000   0.000000   )
     freq (    5) =      37.402124 [THz] =    1247.600552 [cm-1]
 ( -0.237826  -0.439817    -0.000000  -0.000000     0.237826   0.439817   )
 (  0.500000   0.000000     0.000000  -0.000000    -0.500000   0.000000   )
     freq (    6) =      40.733389 [THz] =    1358.719598 [cm-1]
 ( -0.000000  -0.000000    -0.627668  -0.325627    -0.000000  -0.000000   )
 (  0.000000   0.000000     0.674081  -0.213575     0.000000   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =      -0.2500     -0.2500      0.2500
 **************************************************************************
     freq (    1) =      12.190474 [THz] =     406.630448 [cm-1]
 (  0.283159   0.056162     0.283159   0.056162     0.566318   0.112325   )
 (  0.288675   0.000000     0.288675  -0.000000     0.577350   0.000000   )
     freq (    2) =      12.190474 [THz] =     406.630450 [cm-1]
 ( -0.414909  -0.279017     0.414909   0.279017     0.000000   0.000000   )
 ( -0.461265  -0.192964     0.461265   0.192964     0.000000   0.000000   )
     freq (    3) =      21.517617 [THz] =     717.750447 [cm-1]
 ( -0.353688  -0.203890    -0.353688  -0.203890     0.353688   0.203890   )
 ( -0.408248  -0.000000    -0.408248  -0.000000     0.408248   0.000000   )
     freq (    4) =      38.639132 [THz] =    1288.862717 [cm-1]
 (  0.492903   0.083946    -0.492903  -0.083946     0.000000   0.000000   )
 ( -0.499816   0.013554     0.499816  -0.013554    -0.000000   0.000000   )
     freq (    5) =      38.639132 [THz] =    1288.862718 [cm-1]
 ( -0.283159  -0.056162    -0.283159  -0.056162    -0.566318  -0.112325   )
 (  0.288675   0.000000     0.288675  -0.000000     0.577350   0.000000   )
     freq (    6) =      40.229138 [THz] =    1341.899601 [cm-1]
 (  0.353688   0.203890     0.353688   0.203890    -0.353688  -0.203890   )
 ( -0.408248  -0.000000    -0.408248  -0.000000     0.408248   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =      -0.5000      0.0000      0.0000
 **************************************************************************
     freq (    1) =      16.034554 [THz] =     534.855142 [cm-1]
 ( -0.000000   0.000000    -0.237826  -0.439817     0.237826   0.439817   )
 ( -0.000000   0.000000    -0.500000   0.000000     0.500000   0.000000   )
     freq (    2) =      16.034554 [THz] =     534.855147 [cm-1]
 ( -0.000000  -0.000000    -0.439817  -0.237826    -0.439817  -0.237826   )
 ( -0.000000  -0.000000    -0.500000   0.000000    -0.500000   0.000000   )
     freq (    3) =      23.072896 [THz] =     769.628960 [cm-1]
 ( -0.432195  -0.559650     0.000000   0.000000     0.000000   0.000000   )
 ( -0.701340  -0.090124     0.000000   0.000000     0.000000   0.000000   )
     freq (    4) =      37.402124 [THz] =    1247.600550 [cm-1]
 (  0.000000   0.000000    -0.439817  -0.237826    -0.439817  -0.237826   )
 ( -0.000000   0.000000     0.500000  -0.000000     0.500000   0.000000   )
     freq (    5) =      37.402124 [THz] =    1247.600552 [cm-1]
 ( -0.000000  -0.000000    -0.237826  -0.439817     0.237826   0.439817   )
 (  0.000000   0.000000     0.500000  -0.000000    -0.500000   0.000000   )
     freq (    6) =      40.733389 [THz] =    1358.719598 [cm-1]
 ( -0.627668  -0.325627    -0.000000  -0.000000    -0.000000  -0.000000   )
 (  0.674081  -0.213575     0.000000   0.000000     0.000000   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.2500     -0.7500      0.7500
 **************************************************************************
     freq (    1) =      20.904021 [THz] =     697.283094 [cm-1]
 ( -0.000000  -0.000000     0.465321   0.182967     0.465321   0.182967   )
 ( -0.000000   0.000000     0.500000  -0.000000     0.500000   0.000000   )
     freq (    2) =      24.542229 [THz] =     818.640639 [cm-1]
 ( -0.189265  -0.339797    -0.187892  -0.372901     0.187892   0.372901   )
 ( -0.388617  -0.016122    -0.417562  -0.000000     0.417562   0.000000   )
     freq (    3) =      30.345099 [THz] =    1012.203560 [cm-1]
 ( -0.040473  -0.543101    -0.254060   0.192757     0.254060  -0.192757   )
 ( -0.296024  -0.457129     0.318907  -0.000000    -0.318907   0.000000   )
     freq (    4) =      34.976150 [THz] =    1166.678792 [cm-1]
 ( -0.000000  -0.000000    -0.465321  -0.182967    -0.465321  -0.182967   )
 (  0.000000  -0.000000     0.500000   0.000000     0.500000   0.000000   )
     freq (    5) =      35.641257 [THz] =    1188.864371 [cm-1]
 (  0.173076  -0.192245     0.010315   0.465228    -0.010315  -0.465228   )
 (  0.188361  -0.177295    -0.465342  -0.000000     0.465342   0.000000   )
     freq (    6) =      38.358011 [THz] =    1279.485524 [cm-1]
 ( -0.167630   0.676096    -0.085629   0.008032     0.085629  -0.008032   )
 ( -0.230039  -0.657486    -0.086005   0.000000     0.086005   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.0000     -0.5000      0.5000
 **************************************************************************
     freq (    1) =      18.354960 [THz] =     612.255561 [cm-1]
 (  0.000000   0.000000     0.500000   0.000000     0.500000   0.000000   )
 (  0.000000   0.000000     0.500000   0.000000     0.500000   0.000000   )
     freq (    2) =      23.228240 [THz] =     774.810684 [cm-1]
 ( -0.000000  -0.705511     0.033575   0.000000    -0.033575   0.000000   )
 ( -0.000000  -0.705511    -0.033575   0.000000     0.033575   0.000000   )
     freq (    3) =      27.180543 [THz] =     906.645317 [cm-1]
 (  0.000000  -0.229288    -0.472984  -0.000000     0.472984   0.000000   )
 ( -0.000000   0.229288    -0.472984  -0.000000     0.472984   0.000000   )
     freq (    4) =      36.319299 [THz] =    1211.481427 [cm-1]
 ( -0.000000  -0.000000     0.500000   0.000000     0.500000   0.000000   )
 (  0.000000  -0.000000    -0.500000  -0.000000    -0.500000   0.000000   )
     freq (    5) =      37.536758 [THz] =    1252.091456 [cm-1]
 (  0.000000  -0.047482    -0.498871  -0.000000     0.498871   0.000000   )
 (  0.000000  -0.047482     0.498871   0.000000    -0.498871   0.000000   )
     freq (    6) =      38.233790 [THz] =    1275.341968 [cm-1]
 (  0.000000  -0.668900     0.162131   0.000000    -0.162131  -0.000000   )
 ( -0.000000   0.668900     0.162131   0.000000    -0.162131   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.0000      0.0000      0.5000
 **************************************************************************
     freq (    1) =      16.034554 [THz] =     534.855142 [cm-1]
 ( -0.499987   0.003604     0.499987  -0.003604     0.000000  -0.000000   )
 ( -0.240989  -0.438091     0.240989   0.438091     0.000000   0.000000   )
     freq (    2) =      16.034554 [THz] =     534.855147 [cm-1]
 (  0.445913  -0.226188     0.445913  -0.226188     0.000000  -0.000000   )
 (  0.499827   0.013136     0.499827   0.013136     0.000000   0.000000   )
     freq (    3) =      23.072896 [THz] =     769.628960 [cm-1]
 (  0.000000  -0.000000     0.000000  -0.000000    -0.500000   0.500000   )
 (  0.000000   0.000000     0.000000   0.000000    -0.707107   0.000000   )
     freq (    4) =      37.402124 [THz] =    1247.600550 [cm-1]
 (  0.311178  -0.391367     0.311178  -0.391367    -0.000000   0.000000   )
 ( -0.459877   0.196248    -0.459877   0.196248     0.000000   0.000000   )
     freq (    5) =      37.402124 [THz] =    1247.600552 [cm-1]
 ( -0.498975  -0.031993     0.498975   0.031993    -0.000000   0.000000   )
 (  0.209196   0.454133    -0.209196  -0.454133     0.000000   0.000000   )
     freq (    6) =      40.733389 [THz] =    1358.719598 [cm-1]
 ( -0.000000   0.000000    -0.000000   0.000000    -0.500000   0.500000   )
 (  0.000000  -0.000000     0.000000  -0.000000     0.707107   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =      -0.2500      0.2500      0.2500
 **************************************************************************
     freq (    1) =      12.190474 [THz] =     406.630448 [cm-1]
 (  0.566318  -0.112325     0.283159  -0.056162     0.283159  -0.056162   )
 (  0.577350  -0.000000     0.288675  -0.000000     0.288675   0.000000   )
     freq (    2) =      12.190474 [THz] =     406.630450 [cm-1]
 (  0.000000   0.000000    -0.490446   0.097276     0.490446  -0.097276   )
 (  0.000000   0.000000    -0.500000   0.000000     0.500000   0.000000   )
     freq (    3) =      21.517617 [THz] =     717.750447 [cm-1]
 (  0.353688  -0.203890    -0.353688   0.203890    -0.353688   0.203890   )
 (  0.408248   0.000000    -0.408248  -0.000000    -0.408248   0.000000   )
     freq (    4) =      38.639132 [THz] =    1288.862717 [cm-1]
 (  0.000000   0.000000     0.490446  -0.097276    -0.490446   0.097276   )
 ( -0.000000  -0.000000    -0.500000  -0.000000     0.500000   0.000000   )
     freq (    5) =      38.639132 [THz] =    1288.862718 [cm-1]
 (  0.566318  -0.112325     0.283159  -0.056162     0.283159  -0.056162   )
 ( -0.577350  -0.000000    -0.288675  -0.000000    -0.288675   0.000000   )
     freq (    6) =      40.229138 [THz] =    1341.899601 [cm-1]
 (  0.353688  -0.203890    -0.353688   0.203890    -0.353688   0.203890   )
 ( -0.408248  -0.000000     0.408248  -0.000000     0.408248   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.5000     -0.5000      1.0000
 **************************************************************************
     freq (    1) =      18.354960 [THz] =     612.255561 [cm-1]
 (  0.500000  -0.000000     0.500000  -0.000000     0.000000   0.000000   )
 (  0.500000  -0.000000     0.500000  -0.000000     0.000000   0.000000   )
     freq (    2) =      23.228240 [THz] =     774.810684 [cm-1]
 (  0.000000  -0.033575     0.000000   0.033575    -0.705511  -0.000000   )
 (  0.000000   0.033575     0.000000  -0.033575    -0.705511   0.000000   )
     freq (    3) =      27.180543 [THz] =     906.645317 [cm-1]
 ( -0.000000  -0.472984    -0.000000   0.472984     0.229288   0.000000   )
 (  0.000000  -0.472984     0.000000   0.472984    -0.229288   0.000000   )
     freq (    4) =      36.319299 [THz] =    1211.481427 [cm-1]
 (  0.500000  -0.000000     0.500000  -0.000000    -0.000000  -0.000000   )
 ( -0.500000   0.000000    -0.500000   0.000000     0.000000   0.000000   )
     freq (    5) =      37.536758 [THz] =    1252.091456 [cm-1]
 ( -0.000000  -0.498871    -0.000000   0.498871     0.047482   0.000000   )
 ( -0.000000   0.498871    -0.000000  -0.498871     0.047482   0.000000   )
     freq (    6) =      38.233790 [THz] =    1275.341968 [cm-1]
 (  0.000000   0.162131     0.000000  -0.162131     0.668900   0.000000   )
 ( -0.000000   0.162131    -0.000000  -0.162131    -0.668900   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.2500     -0.2500      0.7500
 **************************************************************************
     freq (    1) =      20.904021 [THz] =     697.283094 [cm-1]
 (  0.398328  -0.302216     0.398328  -0.302216    -0.000000   0.000000   )
 (  0.481292  -0.135494     0.481291  -0.135494    -0.000000   0.000000   )
     freq (    2) =      24.542229 [THz] =     818.640639 [cm-1]
 (  0.203187  -0.364792    -0.203187   0.364792    -0.203186   0.331660   )
 (  0.417204   0.017307    -0.417204  -0.017307    -0.388951   0.000000   )
     freq (    3) =      30.345099 [THz] =    1012.203560 [cm-1]
 (  0.023700  -0.318025    -0.023700   0.318025     0.477864  -0.261233   )
 (  0.173343   0.267682    -0.173343  -0.267682     0.544607   0.000000   )
     freq (    4) =      34.976150 [THz] =    1166.678792 [cm-1]
 ( -0.251528   0.432127    -0.251528   0.432127     0.000000   0.000000   )
 (  0.392212  -0.310112     0.392212  -0.310112     0.000000   0.000000   )
     freq (    5) =      35.641257 [THz] =    1188.864371 [cm-1]
 ( -0.311353  -0.345836     0.311353   0.345836    -0.257793  -0.021362   )
 ( -0.338850   0.318942     0.338850  -0.318942    -0.258676   0.000000   )
     freq (    6) =      38.358011 [THz] =    1279.485524 [cm-1]
 ( -0.020697  -0.083477     0.020697   0.083477    -0.582805   0.381504   )
 ( -0.028403  -0.081179     0.028403   0.081179     0.696568   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =      -0.7500     -0.7500     -0.2500
 **************************************************************************
     freq (    1) =      20.904021 [THz] =     697.283088 [cm-1]
 ( -0.381064  -0.323714     0.381064   0.323714    -0.000000  -0.000000   )
 (  0.473091   0.161817    -0.473091  -0.161817     0.000000   0.000000   )
     freq (    2) =      24.542229 [THz] =     818.640643 [cm-1]
 ( -0.203187  -0.364792    -0.203187  -0.364792     0.203186   0.331660   )
 (  0.417204  -0.017308     0.417204  -0.017308    -0.388951   0.000000   )
     freq (    3) =      30.345099 [THz] =    1012.203556 [cm-1]
 ( -0.023700  -0.318025    -0.023700  -0.318025    -0.477864  -0.261233   )
 (  0.173343  -0.267682     0.173343  -0.267682     0.544607   0.000000   )
     freq (    4) =      34.976150 [THz] =    1166.678795 [cm-1]
 ( -0.491929   0.089476     0.491929  -0.089476     0.000000  -0.000000   )
 ( -0.425067   0.263283     0.425067  -0.263283    -0.000000   0.000000   )
     freq (    5) =      35.641257 [THz] =    1188.864372 [cm-1]
 ( -0.311353   0.345836    -0.311353   0.345836    -0.257793   0.021362   )
 (  0.338850   0.318942     0.338850   0.318942     0.258676   0.000000   )
     freq (    6) =      38.358011 [THz] =    1279.485524 [cm-1]
 ( -0.020697   0.083477    -0.020697   0.083477    -0.582805  -0.381504   )
 (  0.028403  -0.081179     0.028403  -0.081179    -0.696568   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =      -1.0000     -0.5000     -0.5000
 **************************************************************************
     freq (    1) =      18.354960 [THz] =     612.255560 [cm-1]
 ( -0.000000   0.000000     0.000000   0.500000    -0.000000  -0.500000   )
 ( -0.000000   0.000000    -0.500000   0.000000     0.500000   0.000000   )
     freq (    2) =      23.228240 [THz] =     774.810683 [cm-1]
 (  0.705511   0.000000    -0.000000   0.033575    -0.000000   0.033575   )
 ( -0.000000   0.705511     0.033575  -0.000000     0.033575   0.000000   )
     freq (    3) =      27.180543 [THz] =     906.645326 [cm-1]
 (  0.229288  -0.000000     0.000000  -0.472984     0.000000  -0.472984   )
 (  0.000000  -0.229288     0.472984   0.000000     0.472984   0.000000   )
     freq (    4) =      36.319299 [THz] =    1211.481427 [cm-1]
 (  0.000000  -0.000000     0.000000   0.500000    -0.000000  -0.500000   )
 ( -0.000000  -0.000000     0.500000   0.000000    -0.500000   0.000000   )
     freq (    5) =      37.536757 [THz] =    1252.091450 [cm-1]
 ( -0.047482   0.000000    -0.000000   0.498871    -0.000000   0.498871   )
 (  0.000000  -0.047482     0.498871  -0.000000     0.498871   0.000000   )
     freq (    6) =      38.233790 [THz] =    1275.341968 [cm-1]
 ( -0.668900  -0.000000     0.000000  -0.162131     0.000000  -0.162131   )
 ( -0.000000   0.668900     0.162131   0.000000     0.162131   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =      -0.2500     -1.2500      0.2500
 **************************************************************************
     freq (    1) =      20.904021 [THz] =     697.283094 [cm-1]
 (  0.465321  -0.182967    -0.000000   0.000000     0.465321  -0.182967   )
 (  0.500000   0.000000    -0.000000  -0.000000     0.500000   0.000000   )
     freq (    2) =      24.542229 [THz] =     818.640639 [cm-1]
 ( -0.187892   0.372901    -0.189265   0.339797     0.187892  -0.372901   )
 ( -0.417562   0.000000    -0.388617   0.016122     0.417562   0.000000   )
     freq (    3) =      30.345099 [THz] =    1012.203560 [cm-1]
 ( -0.254060  -0.192757    -0.040473   0.543101     0.254060   0.192757   )
 (  0.318907   0.000000    -0.296024   0.457129    -0.318907   0.000000   )
     freq (    4) =      34.976150 [THz] =    1166.678792 [cm-1]
 ( -0.465321   0.182967    -0.000000   0.000000    -0.465321   0.182967   )
 (  0.500000  -0.000000     0.000000   0.000000     0.500000   0.000000   )
     freq (    5) =      35.641257 [THz] =    1188.864371 [cm-1]
 (  0.010315  -0.465228     0.173076   0.192245    -0.010315   0.465228   )
 ( -0.465342   0.000000     0.188361   0.177295     0.465342   0.000000   )
     freq (    6) =      38.358011 [THz] =    1279.485524 [cm-1]
 ( -0.085629  -0.008032    -0.167630  -0.676096     0.085629   0.008032   )
 ( -0.086005  -0.000000    -0.230039   0.657486     0.086005   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =      -0.5000     -1.0000      0.0000
 **************************************************************************
     freq (    1) =      27.315740 [THz] =     911.155005 [cm-1]
 ( -0.459186  -0.459186    -0.197859   0.000000    -0.000000  -0.197859   )
 ( -0.459186  -0.459186    -0.000000  -0.197859    -0.197859   0.000000   )
     freq (    2) =      27.315740 [THz] =     911.155005 [cm-1]
 (  0.459186   0.459186    -0.197859   0.000000    -0.000000  -0.197859   )
 ( -0.459187  -0.459186     0.000000   0.197859     0.197859   0.000000   )
     freq (    3) =      31.225732 [THz] =    1041.578317 [cm-1]
 ( -0.000000   0.000000    -0.500000   0.000000     0.000000   0.500000   )
 (  0.000000  -0.000000     0.000000  -0.500000     0.500000   0.000000   )
     freq (    4) =      31.225733 [THz] =    1041.578325 [cm-1]
 (  0.000000  -0.000000     0.500000  -0.000000    -0.000000  -0.500000   )
 (  0.000000  -0.000000    -0.000000  -0.500000     0.500000   0.000000   )
     freq (    5) =      35.941029 [THz] =    1198.863691 [cm-1]
 ( -0.197859  -0.197859    -0.459186   0.000000    -0.000000  -0.459186   )
 (  0.197859   0.197859    -0.000000   0.459186     0.459186   0.000000   )
     freq (    6) =      35.941029 [THz] =    1198.863691 [cm-1]
 ( -0.197859  -0.197859     0.459186  -0.000000     0.000000   0.459186   )
 ( -0.197859  -0.197859     0.000000   0.459186     0.459186   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =      -0.5000     -0.5000      0.0000
 **************************************************************************
     freq (    1) =      18.354960 [THz] =     612.255560 [cm-1]
 ( -0.210107  -0.453713     0.210107   0.453713     0.000000  -0.000000   )
 ( -0.453713   0.210107     0.453713  -0.210107    -0.000000   0.000000   )
     freq (    2) =      23.228240 [THz] =     774.810683 [cm-1]
 (  0.033575  -0.000000     0.033575  -0.000000    -0.000000   0.705511   )
 ( -0.000000   0.033575    -0.000000   0.033575     0.705511   0.000000   )
     freq (    3) =      27.180543 [THz] =     906.645326 [cm-1]
 (  0.472984   0.000000     0.472984   0.000000     0.000000  -0.229288   )
 (  0.000000  -0.472984     0.000000  -0.472984     0.229288   0.000000   )
     freq (    4) =      36.319299 [THz] =    1211.481427 [cm-1]
 ( -0.078235   0.493841     0.078235  -0.493841     0.000000  -0.000000   )
 ( -0.493841  -0.078235     0.493841   0.078235     0.000000   0.000000   )
     freq (    5) =      37.536757 [THz] =    1252.091450 [cm-1]
 ( -0.498871  -0.000000    -0.498871  -0.000000    -0.000000   0.047482   )
 (  0.000000  -0.498871     0.000000  -0.498871     0.047482   0.000000   )
     freq (    6) =      38.233790 [THz] =    1275.341968 [cm-1]
 ( -0.162131   0.000000    -0.162131   0.000000     0.000000  -0.668900   )
 ( -0.000000   0.162131    -0.000000   0.162131     0.668900   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =      -0.7500     -0.2500     -0.2500
 **************************************************************************
     freq (    1) =      20.904021 [THz] =     697.283088 [cm-1]
 (  0.000000   0.000000    -0.465321   0.182967     0.465321  -0.182967   )
 (  0.000000   0.000000     0.500000   0.000000    -0.500000   0.000000   )
     freq (    2) =      24.542229 [THz] =     818.640643 [cm-1]
 ( -0.189265   0.339797     0.187892  -0.372901     0.187892  -0.372901   )
 (  0.388617  -0.016122    -0.417562  -0.000000    -0.417562   0.000000   )
     freq (    3) =      30.345099 [THz] =    1012.203556 [cm-1]
 ( -0.040473   0.543101     0.254060   0.192757     0.254060   0.192757   )
 (  0.296024  -0.457129     0.318907   0.000000     0.318907   0.000000   )
     freq (    4) =      34.976150 [THz] =    1166.678795 [cm-1]
 (  0.000000  -0.000000    -0.465321   0.182967     0.465321  -0.182967   )
 ( -0.000000   0.000000    -0.500000   0.000000     0.500000   0.000000   )
     freq (    5) =      35.641257 [THz] =    1188.864372 [cm-1]
 (  0.173076   0.192245    -0.010315   0.465228    -0.010315   0.465228   )
 ( -0.188361  -0.177295    -0.465342   0.000000    -0.465342   0.000000   )
     freq (    6) =      38.358011 [THz] =    1279.485524 [cm-1]
 ( -0.167630  -0.676096     0.085629   0.008032     0.085629   0.008032   )
 (  0.230039  -0.657486    -0.086005  -0.000000    -0.086005   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.0000     -1.0000      0.5000
 **************************************************************************
     freq (    1) =      27.315740 [THz] =     911.155005 [cm-1]
 ( -0.139907   0.139907    -0.139907  -0.139907    -0.649387  -0.000000   )
 ( -0.139907  -0.139907    -0.139907   0.139907    -0.649387   0.000000   )
     freq (    2) =      27.315740 [THz] =     911.155005 [cm-1]
 ( -0.139907   0.139907    -0.139907  -0.139907     0.649387   0.000000   )
 (  0.139907   0.139907     0.139907  -0.139907    -0.649387   0.000000   )
     freq (    3) =      31.225732 [THz] =    1041.578317 [cm-1]
 ( -0.353553  -0.353553    -0.353553   0.353553    -0.000000  -0.000000   )
 (  0.353553  -0.353553     0.353553   0.353553     0.000000   0.000000   )
     freq (    4) =      31.225733 [THz] =    1041.578325 [cm-1]
 (  0.353553   0.353554     0.353554  -0.353553     0.000000   0.000000   )
 (  0.353554  -0.353553     0.353553   0.353554     0.000000   0.000000   )
     freq (    5) =      35.941029 [THz] =    1198.863691 [cm-1]
 ( -0.324694   0.324694    -0.324694  -0.324694    -0.279815   0.000000   )
 (  0.324694   0.324693     0.324693  -0.324694     0.279815   0.000000   )
     freq (    6) =      35.941029 [THz] =    1198.863691 [cm-1]
 (  0.324693  -0.324693     0.324693   0.324693    -0.279815   0.000000   )
 (  0.324694   0.324694     0.324694  -0.324694    -0.279815   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =      -0.2500     -0.7500      0.2500
 **************************************************************************
     freq (    1) =      20.904021 [THz] =     697.283094 [cm-1]
 (  0.465321   0.182967    -0.000000  -0.000000     0.465321   0.182967   )
 (  0.500000   0.000000    -0.000000   0.000000     0.500000   0.000000   )
     freq (    2) =      24.542229 [THz] =     818.640639 [cm-1]
 ( -0.187892  -0.372901     0.189265   0.339797     0.187892   0.372901   )
 ( -0.417562   0.000000     0.388617   0.016122     0.417562   0.000000   )
     freq (    3) =      30.345099 [THz] =    1012.203560 [cm-1]
 ( -0.254060   0.192757     0.040473   0.543101     0.254060  -0.192757   )
 (  0.318907   0.000000     0.296024   0.457129    -0.318907   0.000000   )
     freq (    4) =      34.976150 [THz] =    1166.678792 [cm-1]
 ( -0.465321  -0.182967    -0.000000  -0.000000    -0.465321  -0.182967   )
 (  0.500000  -0.000000     0.000000  -0.000000     0.500000   0.000000   )
     freq (    5) =      35.641257 [THz] =    1188.864371 [cm-1]
 (  0.010315   0.465228    -0.173076   0.192245    -0.010315  -0.465228   )
 ( -0.465342   0.000000    -0.188361   0.177295     0.465342   0.000000   )
     freq (    6) =      38.358011 [THz] =    1279.485524 [cm-1]
 ( -0.085629   0.008032     0.167630  -0.676096     0.085629  -0.008032   )
 ( -0.086005  -0.000000     0.230039   0.657486     0.086005   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.5000      0.5000     -0.5000
 **************************************************************************
     freq (    1) =      17.028048 [THz] =     567.994538 [cm-1]
 (  0.500000   0.000000    -0.500000  -0.000000    -0.000000   0.000000   )
 (  0.500000   0.000000    -0.500000  -0.000000    -0.000000   0.000000   )
     freq (    2) =      17.028048 [THz] =     567.994541 [cm-1]
 (  0.288675  -0.000000     0.288675  -0.000000     0.577350  -0.000000   )
 (  0.288675   0.000000     0.288675  -0.000000     0.577350   0.000000   )
     freq (    3) =      31.900796 [THz] =    1064.096013 [cm-1]
 (  0.408248  -0.000000     0.408248  -0.000000    -0.408248   0.000000   )
 (  0.408248   0.000000     0.408248   0.000000    -0.408248   0.000000   )
     freq (    4) =      37.001544 [THz] =    1234.238663 [cm-1]
 ( -0.288675   0.000000    -0.288675   0.000000    -0.577350   0.000000   )
 (  0.288675  -0.000000     0.288675   0.000000     0.577350   0.000000   )
     freq (    5) =      37.001544 [THz] =    1234.238664 [cm-1]
 ( -0.499574  -0.020635     0.499574   0.020635    -0.000000  -0.000000   )
 (  0.499574   0.020635    -0.499574  -0.020635     0.000000   0.000000   )
     freq (    6) =      38.855614 [THz] =    1296.083761 [cm-1]
 (  0.408248  -0.000000     0.408248  -0.000000    -0.408248   0.000000   )
 ( -0.408248  -0.000000    -0.408248  -0.000000     0.408248   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.2500      0.7500     -0.7500
 **************************************************************************
     freq (    1) =      20.904021 [THz] =     697.283094 [cm-1]
 (  0.000000   0.000000    -0.465321  -0.182967    -0.465321  -0.182967   )
 (  0.000000  -0.000000    -0.500000  -0.000000    -0.500000   0.000000   )
     freq (    2) =      24.542229 [THz] =     818.640639 [cm-1]
 ( -0.189265  -0.339797     0.187892   0.372901    -0.187892  -0.372901   )
 ( -0.388617  -0.016122     0.417562  -0.000000    -0.417562   0.000000   )
     freq (    3) =      30.345099 [THz] =    1012.203560 [cm-1]
 ( -0.040473  -0.543101     0.254060  -0.192757    -0.254060   0.192757   )
 ( -0.296024  -0.457129    -0.318907  -0.000000     0.318907   0.000000   )
     freq (    4) =      34.976150 [THz] =    1166.678792 [cm-1]
 (  0.000000   0.000000     0.465321   0.182967     0.465321   0.182967   )
 ( -0.000000   0.000000    -0.500000   0.000000    -0.500000   0.000000   )
     freq (    5) =      35.641257 [THz] =    1188.864371 [cm-1]
 (  0.173076  -0.192245    -0.010315  -0.465228     0.010315   0.465228   )
 (  0.188361  -0.177295     0.465342  -0.000000    -0.465342   0.000000   )
     freq (    6) =      38.358011 [THz] =    1279.485524 [cm-1]
 ( -0.167630   0.676096     0.085629  -0.008032    -0.085629   0.008032   )
 ( -0.230039  -0.657486     0.086005   0.000000    -0.086005   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       1.0000      0.0000      0.0000
 **************************************************************************
     freq (    1) =      24.442448 [THz] =     815.312306 [cm-1]
 ( -0.000000   0.000000    -0.500000  -0.000000     0.500000   0.000000   )
 ( -0.000000   0.000000     0.500000  -0.000000    -0.500000   0.000000   )
     freq (    2) =      24.442448 [THz] =     815.312307 [cm-1]
 (  0.000000   0.000000     0.500000  -0.000000     0.500000  -0.000000   )
 (  0.000000  -0.000000     0.500000  -0.000000     0.500000   0.000000   )
     freq (    3) =      32.545918 [THz] =    1085.614961 [cm-1]
 (  0.000000   0.000000    -0.500000   0.000000    -0.500000   0.000000   )
 ( -0.000000   0.000000     0.500000   0.000000     0.500000   0.000000   )
     freq (    4) =      32.545918 [THz] =    1085.614962 [cm-1]
 ( -0.000000  -0.000000    -0.500000  -0.000000     0.500000   0.000000   )
 (  0.000000   0.000000    -0.500000  -0.000000     0.500000   0.000000   )
     freq (    5) =      36.813053 [THz] =    1227.951271 [cm-1]
 ( -0.707107  -0.000000    -0.000000   0.000000    -0.000000   0.000000   )
 (  0.707107  -0.000000     0.000000  -0.000000     0.000000   0.000000   )
     freq (    6) =      36.813053 [THz] =    1227.951276 [cm-1]
 (  0.707107  -0.000000    -0.000000   0.000000    -0.000000   0.000000   )
 (  0.707107  -0.000000    -0.000000  -0.000000    -0.000000   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.7500      0.2500     -0.2500
 **************************************************************************
     freq (    1) =      20.904021 [THz] =     697.283094 [cm-1]
 (  0.000000  -0.000000    -0.465321   0.182967    -0.465321   0.182967   )
 (  0.000000   0.000000    -0.500000   0.000000    -0.500000   0.000000   )
     freq (    2) =      24.542229 [THz] =     818.640639 [cm-1]
 ( -0.189265   0.339797     0.187892  -0.372901    -0.187892   0.372901   )
 ( -0.388617   0.016122     0.417562   0.000000    -0.417562   0.000000   )
     freq (    3) =      30.345099 [THz] =    1012.203560 [cm-1]
 ( -0.040473   0.543101     0.254060   0.192757    -0.254060  -0.192757   )
 ( -0.296024   0.457129    -0.318907   0.000000     0.318907   0.000000   )
     freq (    4) =      34.976150 [THz] =    1166.678792 [cm-1]
 (  0.000000  -0.000000     0.465321  -0.182967     0.465321  -0.182967   )
 ( -0.000000  -0.000000    -0.500000  -0.000000    -0.500000   0.000000   )
     freq (    5) =      35.641257 [THz] =    1188.864371 [cm-1]
 (  0.173076   0.192245    -0.010315   0.465228     0.010315  -0.465228   )
 (  0.188361   0.177295     0.465342   0.000000    -0.465342   0.000000   )
     freq (    6) =      38.358011 [THz] =    1279.485524 [cm-1]
 ( -0.167630  -0.676096     0.085629   0.008032    -0.085629  -0.008032   )
 ( -0.230039   0.657486     0.086005  -0.000000    -0.086005   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.7500      0.7500     -0.2500
 **************************************************************************
     freq (    1) =      20.904021 [THz] =     697.283088 [cm-1]
 (  0.101084   0.489675    -0.101084  -0.489675    -0.000000   0.000000   )
 ( -0.418722   0.273262     0.418722  -0.273262    -0.000000   0.000000   )
     freq (    2) =      24.542229 [THz] =     818.640646 [cm-1]
 ( -0.364792   0.203187    -0.364792   0.203187    -0.331660   0.203186   )
 ( -0.417204   0.017308    -0.417204   0.017308    -0.388951   0.000000   )
     freq (    3) =      30.345099 [THz] =    1012.203553 [cm-1]
 (  0.318025  -0.023700     0.318025  -0.023700    -0.261233   0.477864   )
 (  0.173343  -0.267682     0.173343  -0.267682    -0.544607   0.000000   )
     freq (    4) =      34.976150 [THz] =    1166.678795 [cm-1]
 (  0.498681   0.036301    -0.498681  -0.036301     0.000000  -0.000000   )
 ( -0.148701  -0.477376     0.148701   0.477376     0.000000   0.000000   )
     freq (    5) =      35.641257 [THz] =    1188.864371 [cm-1]
 (  0.345836   0.311353     0.345836   0.311353    -0.021362  -0.257793   )
 ( -0.338850  -0.318942    -0.338850  -0.318942     0.258676   0.000000   )
     freq (    6) =      38.358011 [THz] =    1279.485524 [cm-1]
 (  0.083477   0.020697     0.083477   0.020697     0.381504  -0.582805   )
 ( -0.028403   0.081179    -0.028403   0.081179    -0.696568   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.5000      1.0000     -0.5000
 **************************************************************************
     freq (    1) =      18.354960 [THz] =     612.255561 [cm-1]
 (  0.500000   0.000000     0.000000  -0.000000     0.500000   0.000000   )
 (  0.500000   0.000000     0.000000  -0.000000     0.500000   0.000000   )
     freq (    2) =      23.228240 [THz] =     774.810684 [cm-1]
 (  0.033575   0.000000    -0.000000  -0.705511    -0.033575   0.000000   )
 ( -0.033575   0.000000    -0.000000  -0.705511     0.033575   0.000000   )
     freq (    3) =      27.180543 [THz] =     906.645317 [cm-1]
 ( -0.472984  -0.000000     0.000000  -0.229288     0.472984   0.000000   )
 ( -0.472984  -0.000000    -0.000000   0.229288     0.472984   0.000000   )
     freq (    4) =      36.319299 [THz] =    1211.481427 [cm-1]
 (  0.500000  -0.000000    -0.000000  -0.000000     0.500000   0.000000   )
 ( -0.500000  -0.000000     0.000000   0.000000    -0.500000   0.000000   )
     freq (    5) =      37.536758 [THz] =    1252.091456 [cm-1]
 ( -0.498871   0.000000     0.000000  -0.047482     0.498871   0.000000   )
 (  0.498871   0.000000     0.000000  -0.047482    -0.498871   0.000000   )
     freq (    6) =      38.233790 [THz] =    1275.341968 [cm-1]
 (  0.162131  -0.000000     0.000000  -0.668900    -0.162131  -0.000000   )
 (  0.162131   0.000000    -0.000000   0.668900    -0.162131   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       1.2500      0.2500      0.2500
 **************************************************************************
     freq (    1) =      20.904021 [THz] =     697.283088 [cm-1]
 ( -0.000000   0.000000    -0.182967  -0.465321     0.182967   0.465321   )
 (  0.000000  -0.000000    -0.500000   0.000000     0.500000   0.000000   )
     freq (    2) =      24.542229 [THz] =     818.640646 [cm-1]
 (  0.339797   0.189265     0.372901   0.187892     0.372901   0.187892   )
 (  0.388617  -0.016122     0.417562   0.000000     0.417562   0.000000   )
     freq (    3) =      30.345099 [THz] =    1012.203553 [cm-1]
 (  0.543101   0.040473    -0.192757   0.254060    -0.192757   0.254060   )
 (  0.296024  -0.457129    -0.318907   0.000000    -0.318907   0.000000   )
     freq (    4) =      34.976150 [THz] =    1166.678795 [cm-1]
 (  0.000000  -0.000000     0.182967   0.465321    -0.182967  -0.465321   )
 ( -0.000000  -0.000000    -0.500000   0.000000     0.500000   0.000000   )
     freq (    5) =      35.641257 [THz] =    1188.864371 [cm-1]
 (  0.192245  -0.173076    -0.465228  -0.010315    -0.465228  -0.010315   )
 ( -0.188361  -0.177295     0.465342  -0.000000     0.465342   0.000000   )
     freq (    6) =      38.358011 [THz] =    1279.485524 [cm-1]
 ( -0.676096   0.167631    -0.008032   0.085629    -0.008032   0.085629   )
 (  0.230039  -0.657487     0.086005   0.000000     0.086005   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       1.0000      0.5000      0.0000
 **************************************************************************
     freq (    1) =      27.315740 [THz] =     911.155005 [cm-1]
 ( -0.197859  -0.000000    -0.459186   0.459186    -0.000000   0.197859   )
 ( -0.000000   0.197859    -0.459186   0.459186    -0.197859   0.000000   )
     freq (    2) =      27.315740 [THz] =     911.155005 [cm-1]
 ( -0.197859  -0.000000     0.459186  -0.459186    -0.000000   0.197859   )
 (  0.000000  -0.197859    -0.459186   0.459186     0.197859   0.000000   )
     freq (    3) =      31.225732 [THz] =    1041.578317 [cm-1]
 ( -0.500000   0.000000    -0.000000  -0.000000    -0.000000  -0.500000   )
 (  0.000000   0.500000     0.000000   0.000000     0.500000   0.000000   )
     freq (    4) =      31.225733 [THz] =    1041.578325 [cm-1]
 (  0.500000  -0.000000     0.000000   0.000000    -0.000000   0.500000   )
 ( -0.000000   0.500000     0.000000   0.000000     0.500000   0.000000   )
     freq (    5) =      35.941029 [THz] =    1198.863691 [cm-1]
 (  0.459186   0.000000     0.197859  -0.197859     0.000000  -0.459186   )
 (  0.000000   0.459186    -0.197859   0.197859    -0.459186   0.000000   )
     freq (    6) =      35.941029 [THz] =    1198.863691 [cm-1]
 ( -0.459186  -0.000000     0.197859  -0.197859    -0.000000   0.459186   )
 ( -0.000000   0.459186     0.197859  -0.197859    -0.459186   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.0000      0.0000     -1.0000
 **************************************************************************
     freq (    1) =      24.442448 [THz] =     815.312306 [cm-1]
 (  0.500000   0.000000    -0.500000  -0.000000    -0.000000   0.000000   )
 ( -0.500000  -0.000000     0.500000   0.000000     0.000000   0.000000   )
     freq (    2) =      24.442448 [THz] =     815.312307 [cm-1]
 ( -0.500000   0.000000    -0.500000   0.000000    -0.000000  -0.000000   )
 ( -0.500000   0.000000    -0.500000   0.000000    -0.000000   0.000000   )
     freq (    3) =      32.545918 [THz] =    1085.614961 [cm-1]
 ( -0.500000   0.000000    -0.500000   0.000000     0.000000   0.000000   )
 (  0.500000  -0.000000     0.500000  -0.000000    -0.000000   0.000000   )
     freq (    4) =      32.545918 [THz] =    1085.614962 [cm-1]
 (  0.500000  -0.000000    -0.500000   0.000000     0.000000  -0.000000   )
 (  0.500000  -0.000000    -0.500000   0.000000     0.000000   0.000000   )
     freq (    5) =      36.813053 [THz] =    1227.951271 [cm-1]
 (  0.000000  -0.000000     0.000000  -0.000000     0.707107  -0.000000   )
 ( -0.000000   0.000000    -0.000000   0.000000    -0.707107   0.000000   )
     freq (    6) =      36.813053 [THz] =    1227.951276 [cm-1]
 ( -0.000000  -0.000000    -0.000000  -0.000000     0.707107  -0.000000   )
 ( -0.000000   0.000000    -0.000000   0.000000     0.707107   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =      -0.2500      0.2500     -1.2500
 **************************************************************************
     freq (    1) =      20.904021 [THz] =     697.283094 [cm-1]
 (  0.398328  -0.302216     0.398328  -0.302216    -0.000000   0.000000   )
 (  0.481292  -0.135493     0.481292  -0.135493    -0.000000   0.000000   )
     freq (    2) =      24.542229 [THz] =     818.640639 [cm-1]
 ( -0.203187   0.364792     0.203187  -0.364792    -0.203186   0.331660   )
 ( -0.417204  -0.017307     0.417204   0.017307    -0.388951   0.000000   )
     freq (    3) =      30.345099 [THz] =    1012.203560 [cm-1]
 (  0.023700  -0.318025    -0.023700   0.318025    -0.477864   0.261233   )
 (  0.173343   0.267682    -0.173343  -0.267682    -0.544607   0.000000   )
     freq (    4) =      34.976150 [THz] =    1166.678792 [cm-1]
 ( -0.251528   0.432127    -0.251528   0.432127     0.000000   0.000000   )
 (  0.392212  -0.310112     0.392212  -0.310112     0.000000   0.000000   )
     freq (    5) =      35.641257 [THz] =    1188.864371 [cm-1]
 ( -0.311353  -0.345836     0.311353   0.345836     0.257793   0.021362   )
 ( -0.338850   0.318942     0.338850  -0.318942     0.258676   0.000000   )
     freq (    6) =      38.358011 [THz] =    1279.485524 [cm-1]
 (  0.020697   0.083477    -0.020697  -0.083477    -0.582805   0.381504   )
 (  0.028403   0.081179    -0.028403  -0.081179     0.696568   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.5000     -0.5000     -0.5000
 **************************************************************************
     freq (    1) =      17.028048 [THz] =     567.994538 [cm-1]
 ( -0.000000   0.000000    -0.500000  -0.000000     0.500000   0.000000   )
 ( -0.000000   0.000000    -0.500000   0.000000     0.500000   0.000000   )
     freq (    2) =      17.028048 [THz] =     567.994541 [cm-1]
 (  0.577350   0.000000     0.288675   0.000000     0.288675   0.000000   )
 (  0.577350  -0.000000     0.288675  -0.000000     0.288675   0.000000   )
     freq (    3) =      31.900796 [THz] =    1064.096013 [cm-1]
 ( -0.408248  -0.000000     0.408248   0.000000     0.408248   0.000000   )
 ( -0.408248  -0.000000     0.408248  -0.000000     0.408248   0.000000   )
     freq (    4) =      37.001544 [THz] =    1234.238663 [cm-1]
 ( -0.577350  -0.000000    -0.288675  -0.000000    -0.288675  -0.000000   )
 (  0.577350   0.000000     0.288675   0.000000     0.288675   0.000000   )
     freq (    5) =      37.001544 [THz] =    1234.238664 [cm-1]
 ( -0.000000  -0.000000    -0.500000  -0.000000     0.500000   0.000000   )
 (  0.000000   0.000000     0.500000   0.000000    -0.500000   0.000000   )
     freq (    6) =      38.855614 [THz] =    1296.083761 [cm-1]
 (  0.408248   0.000000    -0.408248  -0.000000    -0.408248  -0.000000   )
 ( -0.408248  -0.000000     0.408248   0.000000     0.408248   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.2500     -0.2500     -0.7500
 **************************************************************************
     freq (    1) =      20.904021 [THz] =     697.283094 [cm-1]
 (  0.398328   0.302216     0.398328   0.302216    -0.000000  -0.000000   )
 (  0.481291   0.135494     0.481291   0.135494    -0.000000   0.000000   )
     freq (    2) =      24.542229 [THz] =     818.640639 [cm-1]
 ( -0.203187  -0.364792     0.203187   0.364792    -0.203186  -0.331660   )
 ( -0.417204   0.017307     0.417204  -0.017307    -0.388951   0.000000   )
     freq (    3) =      30.345099 [THz] =    1012.203560 [cm-1]
 (  0.023700   0.318025    -0.023700  -0.318025    -0.477864  -0.261233   )
 (  0.173343  -0.267682    -0.173343   0.267682    -0.544607   0.000000   )
     freq (    4) =      34.976150 [THz] =    1166.678792 [cm-1]
 ( -0.251529  -0.432127    -0.251529  -0.432127     0.000000  -0.000000   )
 (  0.392212   0.310112     0.392212   0.310112     0.000000   0.000000   )
     freq (    5) =      35.641257 [THz] =    1188.864371 [cm-1]
 ( -0.311353   0.345836     0.311353  -0.345836     0.257793  -0.021362   )
 ( -0.338850  -0.318942     0.338850   0.318942     0.258676   0.000000   )
     freq (    6) =      38.358011 [THz] =    1279.485524 [cm-1]
 (  0.020697  -0.083477    -0.020697   0.083477    -0.582805  -0.381504   )
 (  0.028403  -0.081179    -0.028403   0.081179     0.696568   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.2500      0.2500     -0.7500
 **************************************************************************
     freq (    1) =      20.904021 [THz] =     697.283088 [cm-1]
 ( -0.054487  -0.497022     0.054487   0.497022    -0.000000  -0.000000   )
 ( -0.482488  -0.131169     0.482488   0.131169    -0.000000   0.000000   )
     freq (    2) =      24.542229 [THz] =     818.640646 [cm-1]
 ( -0.364792  -0.203187    -0.364792  -0.203187    -0.331660  -0.203186   )
 ( -0.417204  -0.017308    -0.417204  -0.017308    -0.388951   0.000000   )
     freq (    3) =      30.345099 [THz] =    1012.203553 [cm-1]
 (  0.318025   0.023700     0.318025   0.023700    -0.261233  -0.477864   )
 (  0.173343   0.267682     0.173343   0.267682    -0.544607   0.000000   )
     freq (    4) =      34.976150 [THz] =    1166.678795 [cm-1]
 (  0.498235   0.041975    -0.498235  -0.041975    -0.000000   0.000000   )
 ( -0.221384   0.448318     0.221384  -0.448318     0.000000   0.000000   )
     freq (    5) =      35.641257 [THz] =    1188.864371 [cm-1]
 (  0.345836  -0.311353     0.345836  -0.311353    -0.021362   0.257793   )
 ( -0.338850   0.318942    -0.338850   0.318942     0.258676   0.000000   )
     freq (    6) =      38.358011 [THz] =    1279.485524 [cm-1]
 (  0.083477  -0.020697     0.083477  -0.020697     0.381504   0.582805   )
 ( -0.028403  -0.081179    -0.028403  -0.081179    -0.696568   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.0000      0.5000     -1.0000
 **************************************************************************
     freq (    1) =      27.315740 [THz] =     911.155005 [cm-1]
 ( -0.197859  -0.000000    -0.459186  -0.459186     0.000000  -0.197859   )
 ( -0.000000  -0.197859    -0.459186  -0.459186    -0.197859   0.000000   )
     freq (    2) =      27.315740 [THz] =     911.155005 [cm-1]
 ( -0.197859  -0.000000     0.459186   0.459186     0.000000  -0.197859   )
 (  0.000000   0.197859    -0.459186  -0.459186     0.197859   0.000000   )
     freq (    3) =      31.225732 [THz] =    1041.578317 [cm-1]
 ( -0.500000   0.000000    -0.000000   0.000000     0.000000   0.500000   )
 (  0.000000  -0.500000     0.000000  -0.000000     0.500000   0.000000   )
     freq (    4) =      31.225733 [THz] =    1041.578325 [cm-1]
 (  0.500000  -0.000000     0.000000  -0.000000    -0.000000  -0.500000   )
 ( -0.000000  -0.500000     0.000000  -0.000000     0.500000   0.000000   )
     freq (    5) =      35.941029 [THz] =    1198.863691 [cm-1]
 (  0.459186  -0.000000     0.197859   0.197859     0.000000   0.459186   )
 (  0.000000  -0.459186    -0.197859  -0.197859    -0.459186   0.000000   )
     freq (    6) =      35.941029 [THz] =    1198.863691 [cm-1]
 ( -0.459186   0.000000     0.197859   0.197859    -0.000000  -0.459186   )
 ( -0.000000  -0.459186     0.197859   0.197859    -0.459186   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.7500     -0.2500     -0.2500
 **************************************************************************
     freq (    1) =      20.904021 [THz] =     697.283088 [cm-1]
 ( -0.000000   0.000000    -0.182967   0.465321     0.182967  -0.465321   )
 ( -0.000000  -0.000000    -0.500000   0.000000     0.500000   0.000000   )
     freq (    2) =      24.542229 [THz] =     818.640646 [cm-1]
 (  0.339797  -0.189265     0.372901  -0.187892     0.372901  -0.187892   )
 (  0.388617   0.016122     0.417562  -0.000000     0.417562   0.000000   )
     freq (    3) =      30.345099 [THz] =    1012.203553 [cm-1]
 (  0.543101  -0.040473    -0.192757  -0.254060    -0.192757  -0.254060   )
 (  0.296024   0.457129    -0.318907  -0.000000    -0.318907   0.000000   )
     freq (    4) =      34.976150 [THz] =    1166.678795 [cm-1]
 (  0.000000   0.000000     0.182967  -0.465321    -0.182967   0.465321   )
 ( -0.000000   0.000000    -0.500000  -0.000000     0.500000   0.000000   )
     freq (    5) =      35.641257 [THz] =    1188.864371 [cm-1]
 (  0.192245   0.173076    -0.465228   0.010315    -0.465228   0.010315   )
 ( -0.188361   0.177295     0.465342   0.000000     0.465342   0.000000   )
     freq (    6) =      38.358011 [THz] =    1279.485524 [cm-1]
 ( -0.676096  -0.167631    -0.008032  -0.085629    -0.008032  -0.085629   )
 (  0.230039   0.657487     0.086005  -0.000000     0.086005   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.5000      0.0000     -0.5000
 **************************************************************************
     freq (    1) =      18.354960 [THz] =     612.255561 [cm-1]
 (  0.500000   0.000000     0.000000  -0.000000     0.500000  -0.000000   )
 (  0.500000  -0.000000     0.000000   0.000000     0.500000   0.000000   )
     freq (    2) =      23.228240 [THz] =     774.810684 [cm-1]
 (  0.033575  -0.000000    -0.000000   0.705511    -0.033575  -0.000000   )
 ( -0.033575  -0.000000    -0.000000   0.705511     0.033575   0.000000   )
     freq (    3) =      27.180543 [THz] =     906.645317 [cm-1]
 ( -0.472984   0.000000     0.000000   0.229288     0.472984  -0.000000   )
 ( -0.472984   0.000000    -0.000000  -0.229288     0.472984   0.000000   )
     freq (    4) =      36.319299 [THz] =    1211.481427 [cm-1]
 (  0.500000   0.000000    -0.000000   0.000000     0.500000  -0.000000   )
 ( -0.500000   0.000000     0.000000  -0.000000    -0.500000   0.000000   )
     freq (    5) =      37.536758 [THz] =    1252.091456 [cm-1]
 ( -0.498871  -0.000000     0.000000   0.047482     0.498871  -0.000000   )
 (  0.498871  -0.000000     0.000000   0.047482    -0.498871   0.000000   )
     freq (    6) =      38.233790 [THz] =    1275.341968 [cm-1]
 (  0.162131   0.000000     0.000000   0.668900    -0.162131   0.000000   )
 (  0.162131  -0.000000    -0.000000  -0.668900    -0.162131   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.2500      0.2500     -0.2500
 **************************************************************************
     freq (    1) =      12.190474 [THz] =     406.630448 [cm-1]
 (  0.283159  -0.056162     0.283159  -0.056162     0.566318  -0.112325   )
 (  0.288675  -0.000000     0.288675   0.000000     0.577350   0.000000   )
     freq (    2) =      12.190474 [THz] =     406.630450 [cm-1]
 ( -0.414909   0.279017     0.414909  -0.279017     0.000000  -0.000000   )
 ( -0.461265   0.192964     0.461265  -0.192964     0.000000   0.000000   )
     freq (    3) =      21.517617 [THz] =     717.750447 [cm-1]
 ( -0.353688   0.203890    -0.353688   0.203890     0.353688  -0.203890   )
 ( -0.408248   0.000000    -0.408248   0.000000     0.408248   0.000000   )
     freq (    4) =      38.639132 [THz] =    1288.862717 [cm-1]
 (  0.492903  -0.083946    -0.492903   0.083946     0.000000  -0.000000   )
 ( -0.499816  -0.013554     0.499816   0.013554    -0.000000   0.000000   )
     freq (    5) =      38.639132 [THz] =    1288.862718 [cm-1]
 ( -0.283159   0.056162    -0.283159   0.056162    -0.566318   0.112325   )
 (  0.288675  -0.000000     0.288675   0.000000     0.577350   0.000000   )
     freq (    6) =      40.229138 [THz] =    1341.899601 [cm-1]
 (  0.353688  -0.203890     0.353688  -0.203890    -0.353688   0.203890   )
 ( -0.408248   0.000000    -0.408248   0.000000     0.408248   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.0000      0.5000     -0.5000
 **************************************************************************
     freq (    1) =      18.354960 [THz] =     612.255561 [cm-1]
 (  0.000000  -0.000000     0.500000  -0.000000     0.500000  -0.000000   )
 (  0.000000   0.000000     0.500000  -0.000000     0.500000   0.000000   )
     freq (    2) =      23.228240 [THz] =     774.810684 [cm-1]
 ( -0.000000   0.705511     0.033575  -0.000000    -0.033575  -0.000000   )
 ( -0.000000   0.705511    -0.033575  -0.000000     0.033575   0.000000   )
     freq (    3) =      27.180543 [THz] =     906.645317 [cm-1]
 (  0.000000   0.229288    -0.472984   0.000000     0.472984  -0.000000   )
 ( -0.000000  -0.229288    -0.472984   0.000000     0.472984   0.000000   )
     freq (    4) =      36.319299 [THz] =    1211.481427 [cm-1]
 ( -0.000000   0.000000     0.500000  -0.000000     0.500000  -0.000000   )
 (  0.000000   0.000000    -0.500000   0.000000    -0.500000   0.000000   )
     freq (    5) =      37.536758 [THz] =    1252.091456 [cm-1]
 (  0.000000   0.047482    -0.498871   0.000000     0.498871  -0.000000   )
 (  0.000000   0.047482     0.498871  -0.000000    -0.498871   0.000000   )
     freq (    6) =      38.233790 [THz] =    1275.341968 [cm-1]
 (  0.000000   0.668900     0.162131  -0.000000    -0.162131   0.000000   )
 ( -0.000000  -0.668900     0.162131  -0.000000    -0.162131   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.7500     -0.2500      0.2500
 **************************************************************************
     freq (    1) =      20.904021 [THz] =     697.283094 [cm-1]
 ( -0.000000   0.000000     0.465321  -0.182967     0.465321  -0.182967   )
 ( -0.000000  -0.000000     0.500000   0.000000     0.500000   0.000000   )
     freq (    2) =      24.542229 [THz] =     818.640639 [cm-1]
 ( -0.189265   0.339797    -0.187892   0.372901     0.187892  -0.372901   )
 ( -0.388617   0.016122    -0.417562   0.000000     0.417562   0.000000   )
     freq (    3) =      30.345099 [THz] =    1012.203560 [cm-1]
 ( -0.040473   0.543101    -0.254060  -0.192757     0.254060   0.192757   )
 ( -0.296024   0.457129     0.318907   0.000000    -0.318907   0.000000   )
     freq (    4) =      34.976150 [THz] =    1166.678792 [cm-1]
 ( -0.000000   0.000000    -0.465321   0.182967    -0.465321   0.182967   )
 (  0.000000   0.000000     0.500000  -0.000000     0.500000   0.000000   )
     freq (    5) =      35.641257 [THz] =    1188.864371 [cm-1]
 (  0.173076   0.192245     0.010315  -0.465228    -0.010315   0.465228   )
 (  0.188361   0.177295    -0.465342   0.000000     0.465342   0.000000   )
     freq (    6) =      38.358011 [THz] =    1279.485524 [cm-1]
 ( -0.167630  -0.676096    -0.085629  -0.008032     0.085629   0.008032   )
 ( -0.230039   0.657486    -0.086005  -0.000000     0.086005   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.5000      0.0000      0.0000
 **************************************************************************
     freq (    1) =      16.034554 [THz] =     534.855142 [cm-1]
 ( -0.000000  -0.000000    -0.237826   0.439817     0.237826  -0.439817   )
 ( -0.000000  -0.000000    -0.500000  -0.000000     0.500000   0.000000   )
     freq (    2) =      16.034554 [THz] =     534.855147 [cm-1]
 ( -0.000000   0.000000    -0.439817   0.237826    -0.439817   0.237826   )
 ( -0.000000   0.000000    -0.500000  -0.000000    -0.500000   0.000000   )
     freq (    3) =      23.072896 [THz] =     769.628960 [cm-1]
 ( -0.432195   0.559650     0.000000  -0.000000     0.000000  -0.000000   )
 ( -0.701340   0.090124     0.000000  -0.000000     0.000000   0.000000   )
     freq (    4) =      37.402124 [THz] =    1247.600550 [cm-1]
 (  0.000000  -0.000000    -0.439817   0.237826    -0.439817   0.237826   )
 ( -0.000000  -0.000000     0.500000   0.000000     0.500000   0.000000   )
     freq (    5) =      37.402124 [THz] =    1247.600552 [cm-1]
 ( -0.000000   0.000000    -0.237826   0.439817     0.237826  -0.439817   )
 (  0.000000  -0.000000     0.500000   0.000000    -0.500000   0.000000   )
     freq (    6) =      40.733389 [THz] =    1358.719598 [cm-1]
 ( -0.627668   0.325627    -0.000000   0.000000    -0.000000   0.000000   )
 (  0.674081   0.213575     0.000000  -0.000000     0.000000   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.5000      0.5000      0.0000
 **************************************************************************
     freq (    1) =      18.354960 [THz] =     612.255560 [cm-1]
 ( -0.210107   0.453713     0.210107  -0.453713     0.000000   0.000000   )
 ( -0.453713  -0.210107     0.453713   0.210107    -0.000000   0.000000   )
     freq (    2) =      23.228240 [THz] =     774.810683 [cm-1]
 (  0.033575   0.000000     0.033575   0.000000    -0.000000  -0.705511   )
 ( -0.000000  -0.033575    -0.000000  -0.033575     0.705511   0.000000   )
     freq (    3) =      27.180543 [THz] =     906.645326 [cm-1]
 (  0.472984  -0.000000     0.472984  -0.000000     0.000000   0.229288   )
 (  0.000000   0.472984     0.000000   0.472984     0.229288   0.000000   )
     freq (    4) =      36.319299 [THz] =    1211.481427 [cm-1]
 ( -0.078235  -0.493841     0.078235   0.493841     0.000000   0.000000   )
 ( -0.493841   0.078235     0.493841  -0.078235     0.000000   0.000000   )
     freq (    5) =      37.536757 [THz] =    1252.091450 [cm-1]
 ( -0.498871   0.000000    -0.498871   0.000000    -0.000000  -0.047482   )
 (  0.000000   0.498871     0.000000   0.498871     0.047482   0.000000   )
     freq (    6) =      38.233790 [THz] =    1275.341968 [cm-1]
 ( -0.162131  -0.000000    -0.162131  -0.000000     0.000000   0.668900   )
 ( -0.000000  -0.162131    -0.000000  -0.162131     0.668900   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.2500      0.7500     -0.2500
 **************************************************************************
     freq (    1) =      20.904021 [THz] =     697.283094 [cm-1]
 (  0.465321  -0.182967    -0.000000   0.000000     0.465321  -0.182967   )
 (  0.500000  -0.000000    -0.000000  -0.000000     0.500000   0.000000   )
     freq (    2) =      24.542229 [THz] =     818.640639 [cm-1]
 ( -0.187892   0.372901     0.189265  -0.339797     0.187892  -0.372901   )
 ( -0.417562  -0.000000     0.388617  -0.016122     0.417562   0.000000   )
     freq (    3) =      30.345099 [THz] =    1012.203560 [cm-1]
 ( -0.254060  -0.192757     0.040473  -0.543101     0.254060   0.192757   )
 (  0.318907  -0.000000     0.296024  -0.457129    -0.318907   0.000000   )
     freq (    4) =      34.976150 [THz] =    1166.678792 [cm-1]
 ( -0.465321   0.182967    -0.000000   0.000000    -0.465321   0.182967   )
 (  0.500000   0.000000     0.000000   0.000000     0.500000   0.000000   )
     freq (    5) =      35.641257 [THz] =    1188.864371 [cm-1]
 (  0.010315  -0.465228    -0.173076  -0.192245    -0.010315   0.465228   )
 ( -0.465342  -0.000000    -0.188361  -0.177295     0.465342   0.000000   )
     freq (    6) =      38.358011 [THz] =    1279.485524 [cm-1]
 ( -0.085629  -0.008032     0.167630   0.676096     0.085629   0.008032   )
 ( -0.086005   0.000000     0.230039  -0.657486     0.086005   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       1.0000      0.0000      0.5000
 **************************************************************************
     freq (    1) =      27.315740 [THz] =     911.155005 [cm-1]
 (  0.139907   0.139907     0.139907  -0.139907     0.649387  -0.000000   )
 (  0.139907  -0.139907     0.139907   0.139907     0.649387   0.000000   )
     freq (    2) =      27.315740 [THz] =     911.155005 [cm-1]
 ( -0.139907  -0.139907    -0.139907   0.139907     0.649387  -0.000000   )
 (  0.139907  -0.139907     0.139907   0.139907    -0.649387   0.000000   )
     freq (    3) =      31.225732 [THz] =    1041.578317 [cm-1]
 ( -0.353553   0.353553    -0.353553  -0.353553    -0.000000   0.000000   )
 (  0.353553   0.353553     0.353553  -0.353553     0.000000   0.000000   )
     freq (    4) =      31.225733 [THz] =    1041.578325 [cm-1]
 (  0.353553  -0.353553     0.353553   0.353553     0.000000   0.000000   )
 (  0.353553   0.353553     0.353553  -0.353553     0.000000   0.000000   )
     freq (    5) =      35.941029 [THz] =    1198.863691 [cm-1]
 (  0.324694   0.324694     0.324694  -0.324694     0.279815  -0.000000   )
 ( -0.324694   0.324694    -0.324694  -0.324694    -0.279815   0.000000   )
     freq (    6) =      35.941029 [THz] =    1198.863691 [cm-1]
 ( -0.324694  -0.324694    -0.324694   0.324694     0.279815  -0.000000   )
 ( -0.324693   0.324694    -0.324694  -0.324693     0.279815   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.7500      0.2500      0.2500
 **************************************************************************
     freq (    1) =      20.904021 [THz] =     697.283088 [cm-1]
 (  0.000000  -0.000000    -0.465321  -0.182967     0.465321   0.182967   )
 (  0.000000  -0.000000     0.500000  -0.000000    -0.500000   0.000000   )
     freq (    2) =      24.542229 [THz] =     818.640643 [cm-1]
 ( -0.189265  -0.339797     0.187892   0.372901     0.187892   0.372901   )
 (  0.388617   0.016122    -0.417562   0.000000    -0.417562   0.000000   )
     freq (    3) =      30.345099 [THz] =    1012.203556 [cm-1]
 ( -0.040473  -0.543101     0.254060  -0.192757     0.254060  -0.192757   )
 (  0.296024   0.457129     0.318907  -0.000000     0.318907   0.000000   )
     freq (    4) =      34.976150 [THz] =    1166.678795 [cm-1]
 (  0.000000   0.000000    -0.465321  -0.182967     0.465321   0.182967   )
 ( -0.000000  -0.000000    -0.500000  -0.000000     0.500000   0.000000   )
     freq (    5) =      35.641257 [THz] =    1188.864372 [cm-1]
 (  0.173076  -0.192245    -0.010315  -0.465228    -0.010315  -0.465228   )
 ( -0.188361   0.177295    -0.465342  -0.000000    -0.465342   0.000000   )
     freq (    6) =      38.358011 [THz] =    1279.485524 [cm-1]
 ( -0.167630   0.676096     0.085629  -0.008032     0.085629  -0.008032   )
 (  0.230039   0.657486    -0.086005   0.000000    -0.086005   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =      -0.2500     -0.2500     -0.7500
 **************************************************************************
     freq (    1) =      20.904021 [THz] =     697.283088 [cm-1]
 ( -0.316338   0.387209     0.316338  -0.387209     0.000000  -0.000000   )
 (  0.436089  -0.244594    -0.436089   0.244594    -0.000000   0.000000   )
     freq (    2) =      24.542229 [THz] =     818.640643 [cm-1]
 (  0.203187  -0.364792     0.203187  -0.364792    -0.203186   0.331660   )
 ( -0.417204  -0.017308    -0.417204  -0.017308     0.388951   0.000000   )
     freq (    3) =      30.345099 [THz] =    1012.203556 [cm-1]
 ( -0.023700   0.318025    -0.023700   0.318025    -0.477864   0.261233   )
 (  0.173343   0.267682     0.173343   0.267682     0.544607   0.000000   )
     freq (    4) =      34.976150 [THz] =    1166.678795 [cm-1]
 ( -0.488338   0.107361     0.488338  -0.107361     0.000000   0.000000   )
 ( -0.493754  -0.078785     0.493754   0.078785    -0.000000   0.000000   )
     freq (    5) =      35.641257 [THz] =    1188.864372 [cm-1]
 (  0.311353   0.345836     0.311353   0.345836     0.257793   0.021362   )
 ( -0.338850   0.318942    -0.338850   0.318942    -0.258676   0.000000   )
     freq (    6) =      38.358011 [THz] =    1279.485524 [cm-1]
 ( -0.020697  -0.083477    -0.020697  -0.083477    -0.582805   0.381504   )
 (  0.028403   0.081179     0.028403   0.081179    -0.696568   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =      -0.5000      0.0000     -1.0000
 **************************************************************************
     freq (    1) =      27.315740 [THz] =     911.155005 [cm-1]
 ( -0.459186   0.459186    -0.197859  -0.000000    -0.000000   0.197859   )
 ( -0.459186   0.459186    -0.000000   0.197859    -0.197859   0.000000   )
     freq (    2) =      27.315740 [THz] =     911.155005 [cm-1]
 (  0.459186  -0.459186    -0.197859  -0.000000    -0.000000   0.197859   )
 ( -0.459186   0.459186     0.000000  -0.197859     0.197859   0.000000   )
     freq (    3) =      31.225732 [THz] =    1041.578317 [cm-1]
 ( -0.000000  -0.000000    -0.500000   0.000000    -0.000000  -0.500000   )
 (  0.000000   0.000000     0.000000   0.500000     0.500000   0.000000   )
     freq (    4) =      31.225733 [THz] =    1041.578325 [cm-1]
 (  0.000000   0.000000     0.500000  -0.000000    -0.000000   0.500000   )
 (  0.000000   0.000000    -0.000000   0.500000     0.500000   0.000000   )
     freq (    5) =      35.941029 [THz] =    1198.863691 [cm-1]
 ( -0.197859   0.197859    -0.459186  -0.000000    -0.000000   0.459186   )
 (  0.197859  -0.197859    -0.000000  -0.459186     0.459186   0.000000   )
     freq (    6) =      35.941029 [THz] =    1198.863691 [cm-1]
 ( -0.197859   0.197859     0.459186   0.000000     0.000000  -0.459186   )
 ( -0.197859   0.197859     0.000000  -0.459186     0.459186   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.2500     -0.7500     -0.2500
 **************************************************************************
     freq (    1) =      20.904021 [THz] =     697.283094 [cm-1]
 (  0.465321   0.182967    -0.000000  -0.000000     0.465321   0.182967   )
 (  0.500000  -0.000000    -0.000000   0.000000     0.500000   0.000000   )
     freq (    2) =      24.542229 [THz] =     818.640639 [cm-1]
 ( -0.187892  -0.372901    -0.189265  -0.339797     0.187892   0.372901   )
 ( -0.417562  -0.000000    -0.388617  -0.016122     0.417562   0.000000   )
     freq (    3) =      30.345099 [THz] =    1012.203560 [cm-1]
 ( -0.254060   0.192757    -0.040473  -0.543101     0.254060  -0.192757   )
 (  0.318907  -0.000000    -0.296024  -0.457129    -0.318907   0.000000   )
     freq (    4) =      34.976150 [THz] =    1166.678792 [cm-1]
 ( -0.465321  -0.182967    -0.000000  -0.000000    -0.465321  -0.182967   )
 (  0.500000   0.000000     0.000000  -0.000000     0.500000   0.000000   )
     freq (    5) =      35.641257 [THz] =    1188.864371 [cm-1]
 (  0.010315   0.465228     0.173076  -0.192245    -0.010315  -0.465228   )
 ( -0.465342  -0.000000     0.188361  -0.177295     0.465342   0.000000   )
     freq (    6) =      38.358011 [THz] =    1279.485524 [cm-1]
 ( -0.085629   0.008032    -0.167630   0.676096     0.085629  -0.008032   )
 ( -0.086005   0.000000    -0.230039  -0.657486     0.086005   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.0000     -0.5000     -0.5000
 **************************************************************************
     freq (    1) =      18.354960 [THz] =     612.255560 [cm-1]
 ( -0.000000  -0.000000     0.000000  -0.500000    -0.000000   0.500000   )
 ( -0.000000   0.000000    -0.500000  -0.000000     0.500000   0.000000   )
     freq (    2) =      23.228240 [THz] =     774.810683 [cm-1]
 (  0.705511  -0.000000    -0.000000  -0.033575    -0.000000  -0.033575   )
 ( -0.000000  -0.705511     0.033575   0.000000     0.033575   0.000000   )
     freq (    3) =      27.180543 [THz] =     906.645326 [cm-1]
 (  0.229288   0.000000     0.000000   0.472984     0.000000   0.472984   )
 (  0.000000   0.229288     0.472984   0.000000     0.472984   0.000000   )
     freq (    4) =      36.319299 [THz] =    1211.481427 [cm-1]
 ( -0.000000  -0.000000     0.000000  -0.500000    -0.000000   0.500000   )
 (  0.000000  -0.000000     0.500000  -0.000000    -0.500000   0.000000   )
     freq (    5) =      37.536757 [THz] =    1252.091450 [cm-1]
 ( -0.047482  -0.000000    -0.000000  -0.498871    -0.000000  -0.498871   )
 (  0.000000   0.047482     0.498871  -0.000000     0.498871   0.000000   )
     freq (    6) =      38.233790 [THz] =    1275.341968 [cm-1]
 ( -0.668900   0.000000     0.000000   0.162131     0.000000   0.162131   )
 ( -0.000000  -0.668900     0.162131   0.000000     0.162131   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.0000      0.0000     -0.5000
 **************************************************************************
     freq (    1) =      16.034554 [THz] =     534.855142 [cm-1]
 ( -0.499987  -0.003604     0.499987   0.003604     0.000000   0.000000   )
 ( -0.240989   0.438091     0.240989  -0.438091     0.000000   0.000000   )
     freq (    2) =      16.034554 [THz] =     534.855147 [cm-1]
 (  0.445913   0.226188     0.445913   0.226188     0.000000   0.000000   )
 (  0.499827  -0.013136     0.499827  -0.013136     0.000000   0.000000   )
     freq (    3) =      23.072896 [THz] =     769.628960 [cm-1]
 (  0.000000   0.000000     0.000000   0.000000    -0.500000  -0.500000   )
 (  0.000000  -0.000000     0.000000  -0.000000    -0.707107   0.000000   )
     freq (    4) =      37.402124 [THz] =    1247.600550 [cm-1]
 (  0.311178   0.391367     0.311178   0.391367    -0.000000  -0.000000   )
 ( -0.459877  -0.196248    -0.459877  -0.196248     0.000000   0.000000   )
     freq (    5) =      37.402124 [THz] =    1247.600552 [cm-1]
 ( -0.498975   0.031993     0.498975  -0.031993    -0.000000  -0.000000   )
 (  0.209196  -0.454133    -0.209196   0.454133     0.000000   0.000000   )
     freq (    6) =      40.733389 [THz] =    1358.719598 [cm-1]
 ( -0.000000  -0.000000    -0.000000  -0.000000    -0.500000  -0.500000   )
 (  0.000000   0.000000     0.000000   0.000000     0.707107   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =      -0.2500      0.2500     -0.7500
 **************************************************************************
     freq (    1) =      20.904021 [THz] =     697.283094 [cm-1]
 (  0.398328   0.302216     0.398328   0.302216    -0.000000  -0.000000   )
 (  0.481292   0.135494     0.481291   0.135494    -0.000000   0.000000   )
     freq (    2) =      24.542229 [THz] =     818.640639 [cm-1]
 (  0.203187   0.364792    -0.203187  -0.364792    -0.203186  -0.331660   )
 (  0.417204  -0.017307    -0.417204   0.017307    -0.388951   0.000000   )
     freq (    3) =      30.345099 [THz] =    1012.203560 [cm-1]
 (  0.023700   0.318025    -0.023700  -0.318025     0.477864   0.261233   )
 (  0.173343  -0.267682    -0.173343   0.267682     0.544607   0.000000   )
     freq (    4) =      34.976150 [THz] =    1166.678792 [cm-1]
 ( -0.251528  -0.432127    -0.251528  -0.432127     0.000000  -0.000000   )
 (  0.392212   0.310112     0.392212   0.310112     0.000000   0.000000   )
     freq (    5) =      35.641257 [THz] =    1188.864371 [cm-1]
 ( -0.311353   0.345836     0.311353  -0.345836    -0.257793   0.021362   )
 ( -0.338850  -0.318942     0.338850   0.318942    -0.258676   0.000000   )
     freq (    6) =      38.358011 [THz] =    1279.485524 [cm-1]
 ( -0.020697   0.083477     0.020697  -0.083477    -0.582805  -0.381504   )
 ( -0.028403   0.081179     0.028403  -0.081179     0.696568   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.5000     -0.5000      0.0000
 **************************************************************************
     freq (    1) =      18.354960 [THz] =     612.255561 [cm-1]
 (  0.500000   0.000000     0.500000   0.000000     0.000000  -0.000000   )
 (  0.500000   0.000000     0.500000   0.000000     0.000000   0.000000   )
     freq (    2) =      23.228240 [THz] =     774.810684 [cm-1]
 (  0.000000   0.033575     0.000000  -0.033575    -0.705511   0.000000   )
 (  0.000000  -0.033575     0.000000   0.033575    -0.705511   0.000000   )
     freq (    3) =      27.180543 [THz] =     906.645317 [cm-1]
 ( -0.000000   0.472984    -0.000000  -0.472984     0.229288  -0.000000   )
 (  0.000000   0.472984     0.000000  -0.472984    -0.229288   0.000000   )
     freq (    4) =      36.319299 [THz] =    1211.481427 [cm-1]
 (  0.500000   0.000000     0.500000   0.000000    -0.000000  -0.000000   )
 ( -0.500000  -0.000000    -0.500000  -0.000000     0.000000   0.000000   )
     freq (    5) =      37.536758 [THz] =    1252.091456 [cm-1]
 ( -0.000000   0.498871    -0.000000  -0.498871     0.047482  -0.000000   )
 ( -0.000000  -0.498871    -0.000000   0.498871     0.047482   0.000000   )
     freq (    6) =      38.233790 [THz] =    1275.341968 [cm-1]
 (  0.000000  -0.162131     0.000000   0.162131     0.668900  -0.000000   )
 ( -0.000000  -0.162131    -0.000000   0.162131    -0.668900   0.000000   )
 **************************************************************************
     diagonalizing the dynamical matrix ...

 q =       0.2500     -0.2500     -0.2500
 **************************************************************************
     freq (    1) =      12.190474 [THz] =     406.630448 [cm-1]
 (  0.566318   0.112325     0.283159   0.056162     0.283159   0.056162   )
 (  0.577350   0.000000     0.288675   0.000000     0.288675   0.000000   )
     freq (    2) =      12.190474 [THz] =     406.630450 [cm-1]
 (  0.000000  -0.000000    -0.490446  -0.097276     0.490446   0.097276   )
 (  0.000000  -0.000000    -0.500000  -0.000000     0.500000   0.000000   )
     freq (    3) =      21.517617 [THz] =     717.750447 [cm-1]
 (  0.353688   0.203890    -0.353688  -0.203890    -0.353688  -0.203890   )
 (  0.408248  -0.000000    -0.408248   0.000000    -0.408248   0.000000   )
     freq (    4) =      38.639132 [THz] =    1288.862717 [cm-1]
 (  0.000000  -0.000000     0.490446   0.097276    -0.490446  -0.097276   )
 ( -0.000000   0.000000    -0.500000   0.000000     0.500000   0.000000   )
     freq (    5) =      38.639132 [THz] =    1288.862718 [cm-1]
 (  0.566318   0.112325     0.283159   0.056162     0.283159   0.056162   )
 ( -0.577350   0.000000    -0.288675   0.000000    -0.288675   0.000000   )
     freq (    6) =      40.229138 [THz] =    1341.899601 [cm-1]
 (  0.353688   0.203890    -0.353688  -0.203890    -0.353688  -0.203890   )
 ( -0.408248   0.000000     0.408248   0.000000     0.408248   0.000000   )
 **************************************************************************