$vibrational spectrum
#  mode     symmetry     wave number   IR intensity    selection rules
#                         cm**(-1)        km/mol         IR     RAMAN
     1        a             -20.55         0.00000       YES     YES
     2        a             -17.96         0.00000       YES     YES
     3        a             -13.23         0.00000       YES     YES
     4        a              -8.96         0.00000       YES     YES
     5        a              -6.88         0.00000       YES     YES
     6        a              -3.74         0.00000       YES     YES
     7                       -0.00         0.00000        -       -
     8                       -0.00         0.00000        -       -
     9                       -0.00         0.00000        -       -
    10                       -0.00         0.00000        -       -
    11                        0.00         0.00000        -       -
    12                        0.00         0.00000        -       -
    13        a               6.57         0.00016       YES     YES
    14        a              10.03         0.00000       YES     YES
    15        a              10.49         0.00004       YES     YES
    16        a              11.97         0.00003       YES     YES
    17        a              12.97         0.00030       YES     YES
    18        a              14.01         0.00013       YES     YES
    19        a              15.20         0.00006       YES     YES
    20        a              18.01         0.00007       YES     YES
    21        a              19.33         0.00007       YES     YES
    22        a              20.63         0.00006       YES     YES
    23        a              21.25         0.00008       YES     YES
    24        a              23.03         0.00011       YES     YES
    25        a              25.80         0.00043       YES     YES
    26        a              28.29         0.00029       YES     YES
    27        a              36.04         0.00406       YES     YES
    28        a              42.18         0.00028       YES     YES
    29        a              48.09         0.00192       YES     YES
    30        a              59.15         0.00517       YES     YES
    31        a              60.65         0.00055       YES     YES
    32        a              73.04         0.00071       YES     YES
    33        a              82.09         0.00121       YES     YES
    34        a              82.91         0.00091       YES     YES
    35        a              97.84         0.00101       YES     YES
    36        a             105.20         0.00032       YES     YES
    37        a             519.93         0.00023       YES     YES
    38        a             523.27         0.01101       YES     YES
    39        a             523.51         0.00009       YES     YES
    40        a             523.98         0.00021       YES     YES
    41        a             524.31         0.00033       YES     YES
    42        a             524.50         0.00090       YES     YES
    43        a             525.04         0.00103       YES     YES
    44        a             525.16         0.00564       YES     YES
    45        a             525.48         0.01247       YES     YES
    46        a             525.94         0.00279       YES     YES
    47        a             526.05         0.00442       YES     YES
    48        a             526.21         0.01064       YES     YES
    49        a             526.46         0.00528       YES     YES
    50        a             526.73         0.00685       YES     YES
    51        a             526.87         0.00457       YES     YES
    52        a             527.05         0.00436       YES     YES
    53        a             527.41         0.00493       YES     YES
    54        a             527.77         0.01430       YES     YES
    55        a             528.10         0.00388       YES     YES
    56        a             528.27         0.00028       YES     YES
    57        a             529.00         0.00279       YES     YES
    58        a             529.32         0.00253       YES     YES
    59        a             529.53         0.00125       YES     YES
    60        a             530.35         0.00659       YES     YES
    61        a             530.58         0.00022       YES     YES
    62        a             531.17         0.00231       YES     YES
    63        a             531.41         0.00317       YES     YES
    64        a             531.53         0.00039       YES     YES
    65        a             531.85         0.00670       YES     YES
    66        a             532.70         0.00074       YES     YES
    67        a             533.52         0.01060       YES     YES
    68        a             536.02         0.00545       YES     YES
    69        a             536.27         0.00028       YES     YES
    70        a             537.30         0.00300       YES     YES
    71        a             539.46         0.01505       YES     YES
    72        a             542.08         0.01089       YES     YES
    73        a            1722.75         2.48666       YES     YES
    74        a            1723.12        11.21794       YES     YES
    75        a            1723.23         5.43242       YES     YES
    76        a            1723.63        13.58550       YES     YES
    77        a            1723.86        14.40712       YES     YES
    78        a            1724.22         8.00774       YES     YES
    79        a            1724.31         2.07116       YES     YES
    80        a            1724.38         1.00251       YES     YES
    81        a            1724.66         8.93363       YES     YES
    82        a            1724.71        10.55427       YES     YES
    83        a            1724.84         1.12248       YES     YES
    84        a            1724.87         3.78589       YES     YES
    85        a            1724.94         2.25867       YES     YES
    86        a            1725.23         3.46977       YES     YES
    87        a            1725.35         5.50983       YES     YES
    88        a            1725.40        15.23085       YES     YES
    89        a            1725.53         0.64033       YES     YES
    90        a            1725.63         4.50897       YES     YES
    91        a            1725.80         3.89450       YES     YES
    92        a            1725.83         2.87381       YES     YES
    93        a            1725.89         2.53629       YES     YES
    94        a            1726.17         1.73259       YES     YES
    95        a            1726.26         3.80375       YES     YES
    96        a            1726.35         1.55902       YES     YES
    97        a            1726.50         4.26241       YES     YES
    98        a            1726.60         3.59327       YES     YES
    99        a            1726.75         0.34368       YES     YES
   100        a            1726.84         0.65749       YES     YES
   101        a            1727.44         3.12939       YES     YES
   102        a            1727.48         0.12723       YES     YES
   103        a            1727.58         0.53723       YES     YES
   104        a            1727.97         0.40581       YES     YES
   105        a            1728.15         0.53723       YES     YES
   106        a            1728.39         1.58213       YES     YES
   107        a            1728.75         0.19426       YES     YES
   108        a            1729.18         3.84831       YES     YES
   109        a            1913.15         0.03368       YES     YES
   110        a            1914.40         0.01055       YES     YES
   111        a            1914.69         0.05227       YES     YES
   112        a            1915.04         0.02108       YES     YES
   113        a            1915.16         0.00109       YES     YES
   114        a            1915.68         0.03802       YES     YES
   115        a            1915.81         0.03392       YES     YES
   116        a            1915.87         0.04498       YES     YES
   117        a            1916.15         0.01256       YES     YES
   118        a            1916.35         0.01468       YES     YES
   119        a            1916.56         0.02153       YES     YES
   120        a            1916.60         0.06063       YES     YES
   121        a            1916.70         0.00046       YES     YES
   122        a            1916.82         0.02277       YES     YES
   123        a            1916.90         0.01410       YES     YES
   124        a            1917.28         0.03917       YES     YES
   125        a            1917.60         0.01129       YES     YES
   126        a            1917.88         0.10635       YES     YES
   127        a            1917.95         0.01081       YES     YES
   128        a            1918.00         0.01457       YES     YES
   129        a            1918.17         0.04840       YES     YES
   130        a            1918.84         0.03688       YES     YES
   131        a            1919.04         0.03534       YES     YES
   132        a            1919.89         0.08507       YES     YES
   133        a            3307.85         0.02641       YES     YES
   134        a            3307.97         0.00239       YES     YES
   135        a            3308.07         0.00139       YES     YES
   136        a            3308.09         0.00092       YES     YES
   137        a            3308.52         0.00078       YES     YES
   138        a            3308.57         0.01359       YES     YES
   139        a            3308.83         0.00180       YES     YES
   140        a            3308.94         0.00439       YES     YES
   141        a            3309.24         0.01683       YES     YES
   142        a            3309.83         0.00381       YES     YES
   143        a            3309.86         0.01721       YES     YES
   144        a            3310.96         0.15319       YES     YES
   145        a            3551.26         1.71130       YES     YES
   146        a            3551.46         1.48573       YES     YES
   147        a            3553.49         2.56157       YES     YES
   148        a            3553.59         1.86361       YES     YES
   149        a            3553.86         1.48765       YES     YES
   150        a            3554.00         1.41206       YES     YES
   151        a            3554.26         3.24435       YES     YES
   152        a            3554.57         1.55575       YES     YES
   153        a            3554.63         1.15767       YES     YES
   154        a            3554.72         1.73584       YES     YES
   155        a            3554.91         1.42558       YES     YES
   156        a            3554.96         1.08036       YES     YES
   157        a            3555.09         3.12890       YES     YES
   158        a            3555.15         4.19264       YES     YES
   159        a            3555.22         2.43013       YES     YES
   160        a            3555.22         0.58969       YES     YES
   161        a            3555.29         1.44160       YES     YES
   162        a            3555.37         0.81571       YES     YES
   163        a            3555.58         2.01770       YES     YES
   164        a            3555.64         1.87941       YES     YES
   165        a            3555.74         0.95190       YES     YES
   166        a            3555.91         0.19281       YES     YES
   167        a            3555.97         0.68095       YES     YES
   168        a            3556.15         1.50722       YES     YES
   169        a            3556.21         2.20696       YES     YES
   170        a            3556.23         1.75409       YES     YES
   171        a            3556.26         0.95981       YES     YES
   172        a            3556.63         1.50854       YES     YES
   173        a            3557.10         2.36726       YES     YES
   174        a            3557.32         2.07309       YES     YES
   175        a            3557.80         0.59895       YES     YES
   176        a            3558.37         1.33531       YES     YES
   177        a            3559.04         0.97410       YES     YES
   178        a            3561.31         1.47026       YES     YES
   179        a            3562.32         1.88519       YES     YES
   180        a            3565.04         0.83502       YES     YES
$end
