%chk=000033996.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000033996

0 1
 N   -1.999800      0.6593000      0.7358000    
 C   0.3813000      0.7027000       1.315800    
 C  -0.9249000       1.493500       1.259500    
 C   0.7871000      0.1910000     -7.2700001E-02
 C    2.086500     -0.5530000     -3.9999999E-02
 C   -3.232200       1.436300      0.5921000    
 C    3.319400      9.3199998E-02 -0.2270000    
 C    4.512400     -0.6669000     -0.1844000    
 C    2.030700      -1.928800      0.1853000    
 C   -2.226600     -0.4958000       1.606100    
 C   -4.321000      0.5915000     -9.3000000E-03
 C    3.394500       1.477000     -0.4550000    
 C    4.437500      -2.050600      4.3800000E-02
 C    3.203900      -2.676200      0.2274000    
 C    5.745300     -2.1000000E-02 -0.3713000    
 C   -4.472700      0.5494000      -1.389300    
 C   -5.162200     -0.1362000      0.8223000    
 C    4.628000       2.102200     -0.6388000    
 C    5.801300       1.354700     -0.5971000    
 C   -5.483000     -0.2340000      -1.947300    
 C   -6.172500     -0.9197000      0.2644000    
 C   -6.332900     -0.9685000      -1.120400    
 H   0.3675000     -0.1016000       2.058300    
 H    1.159400       1.389500       1.676500    
 H   -1.163300       1.875300       2.260700    
 H  -0.7761000       2.365200      0.6095000    
 H   1.7899999E-02 -0.4932000     -0.4562000    
 H   0.7975000       1.001900     -0.8091000    
 H   -3.058200       2.302400     -6.0400002E-02
 H   -3.566700       1.847700       1.554700    
 H    1.079100      -2.432900      0.3341000    
 H   -2.911100      -1.222000       1.158900    
 H   -2.597500     -0.2082000       2.597000    
 H   -1.328900      -1.102200       1.751600    
 H    2.517000       2.115400     -0.4835000    
 H    5.341700      -2.654600      8.0899999E-02
 H    3.160100      -3.747000      0.4041000    
 H    6.675100     -0.5854000     -0.3423000    
 H   -3.815300       1.115700      -2.043000    
 H   -5.062600     -9.5799997E-02   1.903400    
 H    4.673200       3.173700     -0.8110000    
 H    6.761400       1.842200     -0.7392000    
 H   -5.607700     -0.2723000      -3.025500    
 H   -6.836800      -1.488600      0.9083000    
 H   -7.120200      -1.577800      -1.554700    


%chk=000033996-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000033996

0 1
N -2.052035 0.518862 1.088975
C 0.464694 0.700321 1.329267
C -0.909110 1.393782 1.452174
C 0.741857 0.167579 -0.103897
C 2.071254 -0.562879 -0.217237
C -3.303941 1.285726 0.877019
C 3.325659 0.151996 -0.330039
C 4.569326 -0.595694 -0.385739
C 2.095937 -1.964494 -0.177106
C -2.244518 -0.602480 2.033353
C -4.374847 0.499181 0.124748
C 3.396600 1.585675 -0.394774
C 4.537449 -2.028146 -0.331328
C 3.319676 -2.700525 -0.230966
C 5.812319 0.112482 -0.497166
C -4.021403 -0.347896 -0.956200
C -5.743317 0.642158 0.461358
C 4.621536 2.248392 -0.505044
C 5.843647 1.506672 -0.554336
C -5.016454 -1.032919 -1.687454
C -6.743069 -0.038347 -0.271997
C -6.382468 -0.878292 -1.350369
H 0.545564 -0.136060 2.049609
H 1.245790 1.429094 1.621751
H -1.016452 1.794933 2.494232
H -0.928799 2.266183 0.768625
H -0.086278 -0.511282 -0.375562
H 0.688823 1.016303 -0.814306
H -3.038124 2.184350 0.284100
H -3.736988 1.660355 1.840833
H 1.147307 -2.510420 -0.103024
H -3.090411 -1.225727 1.697696
H -2.458398 -0.254919 3.076022
H -1.345082 -1.240425 2.063460
H 2.471537 2.170738 -0.364850
H 5.482175 -2.583397 -0.373396
H 3.293120 -3.795332 -0.196056
H 6.743748 -0.465395 -0.539011
H -2.959396 -0.466953 -1.198491
H -6.028449 1.287204 1.302432
H 4.650753 3.342611 -0.556221
H 6.798720 2.036682 -0.640019
H -4.729448 -1.685290 -2.520428
H -7.797833 0.081961 0.000817
H -7.155069 -1.408863 -1.918455


