%chk=000090951.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090951

0 1
 N    2.358200     -0.9012000      0.3135000    
 N   -2.454900      -1.319900      0.2689000    
 C    3.528700     -0.1635000      7.5300001E-02
 C    5.943700      1.1800000E-02  0.1119000    
 C    4.781200     -0.7215000      0.3492000    
 C    3.450000       1.134800     -0.4379000    
 C   -5.455600      0.8088000      0.6044000    
 C    5.859400       1.306700     -0.4002000    
 C    4.612600       1.868100     -0.6752000    
 C   -3.637700     -0.6435000     -4.6599999E-02
 C   -4.276100      0.1341000      0.9197000    
 C    7.277000     -0.5876000      0.4063000    
 C   -5.996800      0.7058000     -0.6772000    
 C   -4.179100     -0.7464000      -1.328100    
 C   -5.358500     -7.1599998E-02  -1.643400    
 C   -6.138300       1.640800       1.637000    
 C    1.067400     -0.5301000      0.1120000    
 C  -2.8999999E-02  -1.256500      0.3488000    
 C   -1.352200     -0.6693000      6.1500002E-02
 H    4.849700      -1.731800      0.7470000    
 H    2.512500       1.626500     -0.6721000    
 H    6.757800       1.887600     -0.5911000    
 H    4.548000       2.876100      -1.074500    
 H   -3.851700      0.2140000       1.918000    
 H    2.495500      -1.835400      0.6857000    
 H    7.223400      -1.264200       1.266000    
 H    7.636100      -1.149500     -0.4617000    
 H    8.013700      0.1846000      0.6525000    
 H   -6.914100       1.228100     -0.9357000    
 H   -3.689700      -1.350100      -2.087900    
 H   -5.779600     -0.1514000      -2.641300    
 H   -5.988400       1.226000       2.639700    
 H   -5.744800       2.662000       1.616800    
 H   -7.219200       1.678200       1.464500    
 H   0.9331000      0.4681000     -0.2846000    
 H   1.6799999E-02  -2.263900      0.7453000    
 H   -1.355200      0.3607000     -0.3419000    


%chk=000090951-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000090951

0 1
N 2.387931 -0.759097 0.001256
N -2.430295 -1.289447 -0.312252
C 3.587024 -0.008646 0.067376
C 6.056270 -0.052415 0.207044
C 4.815957 -0.722863 0.140240
C 3.608651 1.411044 0.062797
C -5.436761 0.898405 0.455502
C 6.063900 1.368621 0.202572
C 4.848395 2.081354 0.130939
C -3.737663 -0.736720 -0.305923
C -4.109611 0.408511 0.460360
C 7.358868 -0.830744 0.278414
C -6.410909 0.224202 -0.327355
C -4.737343 -1.411254 -1.060025
C -6.058368 -0.922176 -1.077530
C -5.812676 2.129692 1.264856
C 1.091913 -0.277484 -0.072713
C -0.033779 -1.072087 -0.141209
C -1.365029 -0.515704 -0.216811
H 4.799224 -1.821397 0.143934
H 2.686153 1.995935 0.006257
H 7.016576 1.908027 0.254339
H 4.860535 3.177134 0.127235
H -3.360314 0.897169 1.096475
H 2.498247 -1.776293 0.005448
H 7.184446 -1.919972 0.306975
H 7.999696 -0.614981 -0.597044
H 7.938335 -0.557655 1.179936
H -7.445983 0.587157 -0.333470
H -4.448970 -2.306394 -1.620061
H -6.821503 -1.442527 -1.667722
H -5.096086 2.309660 2.085359
H -5.822760 3.036307 0.628736
H -6.820125 2.030535 1.707402
H 0.988700 0.811878 -0.074826
H 0.040388 -2.167451 -0.142213
H -1.439134 0.595074 -0.219699


