%chk=000064532.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064532

0 1
 O  -0.5574000      0.3835000      0.8044000    
 O   0.2964000       2.464100      0.2761000    
 N   -4.227500      0.1806000      0.5452000    
 C    1.697600      0.5048000      0.1846000    
 C    4.124200      0.7104000     -0.4799000    
 C    2.804800      -1.334100      -1.143600    
 C    3.434200     -0.9687000       1.271700    
 C    2.810400       1.478200     -0.2527000    
 C    1.496200     -0.5582000     -0.9138000    
 C    2.122900     -0.1937000       1.491100    
 C    3.907200     -0.3505000      -1.572700    
 C    4.533700      1.2400000E-02  0.8288000    
 C    3.221600      -2.020500      0.1690000    
 C   0.4176000       1.254900      0.4180000    
 C   -2.894900     -0.2997000      0.9543000    
 C   -1.883600      0.7465000      0.4348000    
 C   -4.263800     -0.1525000     -0.8914000    
 C   -2.744700      -1.656400      0.2513000    
 C   -1.943000      0.9053000      -1.090400    
 C   -3.655200      -1.556800     -0.9750000    
 C   -3.385600      0.8940000      -1.609200    
 C   -5.311200     -0.4436000       1.299600    
 H    4.911300       1.406500     -0.7904000    
 H    2.656500      -2.087700      -1.925000    
 H    3.732600      -1.463100       2.202800    
 H    2.965100       2.254900      0.5081000    
 H    2.524600       2.000700      -1.175400    
 H    1.175500     -8.2400002E-02  -1.849800    
 H   0.7037000      -1.266400     -0.6411000    
 H    1.349400     -0.8901000       1.839900    
 H    2.254700      0.5446000       2.293200    
 H    3.629000      0.1353000      -2.516100    
 H    4.842000     -0.8938000      -1.757700    
 H    5.479400     -0.5248000      0.6863000    
 H    4.706900      0.7594000       1.613300    
 H    2.450400      -2.736500      0.4783000    
 H    4.144500      -2.593000      1.5000000E-02
 H   -2.780300     -0.4023000       2.039800    
 H   -2.121200       1.708600      0.9109000    
 H   -5.275500     -0.1159000      -1.311000    
 H   -3.095600      -2.467500      0.9004000    
 H   -1.711600      -1.884800     -2.7799999E-02
 H   -1.381400      9.6799999E-02  -1.575400    
 H   -1.457800       1.831400      -1.418000    
 H   -3.104200      -1.725000      -1.906000    
 H   -4.437700      -2.322400     -0.9121000    
 H   -3.824800       1.890100      -1.466100    
 H   -3.381800      0.7043000      -2.689100    
 H   -5.232100     -0.1767000       2.359100    
 H   -5.332300      -1.535700       1.227000    
 H   -6.277800     -6.2899999E-02  0.9515000    


%chk=000064532-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000064532

0 1
O -0.567633 0.159766 0.024500
O 0.268935 2.329126 -0.120492
N -4.223197 0.166432 0.768095
C 1.838092 0.402172 -0.030471
C 4.346524 0.739504 -0.268430
C 3.290193 -1.433700 -1.036296
C 3.457191 -0.909498 1.440155
C 2.961255 1.436962 -0.320570
C 1.901502 -0.743474 -1.091682
C 2.068349 -0.218642 1.390069
C 4.401952 -0.391381 -1.332005
C 4.568943 0.133107 1.143960
C 3.510744 -2.039647 0.376582
C 0.472347 1.092892 -0.057022
C -2.838753 -0.403321 0.705031
C -1.971613 0.688603 0.039552
C -4.673202 0.014264 -0.657732
C -2.951683 -1.696475 -0.175865
C -2.431435 0.989546 -1.401940
C -4.194349 -1.421628 -1.087441
C -3.976225 1.129109 -1.475093
C -5.099069 -0.507665 1.754729
H 5.135218 1.488337 -0.479421
H 3.322017 -2.239884 -1.795883
H 3.607334 -1.340029 2.450168
H 2.909685 2.257822 0.419023
H 2.796996 1.895597 -1.314708
H 1.727365 -0.322376 -2.102351
H 1.097083 -1.475392 -0.894990
H 1.265272 -0.947847 1.608153
H 2.014418 0.580558 2.156306
H 4.263024 0.034609 -2.346127
H 5.396377 -0.881017 -1.315273
H 5.564975 -0.350294 1.198448
H 4.551024 0.935364 1.908848
H 2.732848 -2.800527 0.589257
H 4.492269 -2.552952 0.419360
H -2.453309 -0.604215 1.719179
H -1.991707 1.602925 0.658449
H -5.769773 0.131493 -0.716643
H -3.110280 -2.583806 0.461914
H -2.025713 -1.866545 -0.751545
H -2.101723 0.153289 -2.048550
H -1.935299 1.903746 -1.770703
H -3.941590 -1.459157 -2.162130
H -4.990466 -2.166895 -0.910779
H -4.289659 2.103650 -1.057589
H -4.302220 1.093049 -2.532394
H -4.685325 -0.358805 2.767865
H -5.226981 -1.604966 1.592134
H -6.099325 -0.040186 1.727149


