%chk=000077276.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077276

0 1
 O   -3.158000      0.5438000       1.543000    
 O   2.2600001E-02  -2.091200      -2.029500    
 O    3.694500       1.846100     -0.9134000    
 O    1.533300      -2.366100      0.9492000    
 N    2.144700     -0.3094000     -3.0000001E-04
 C   -2.858800     -0.4883000     -0.4467000    
 C   -4.212900     -4.9899999E-02 -0.3672000    
 C   -2.259200     -9.9200003E-02  0.7471000    
 C   -4.341500      0.5747000      0.8695000    
 C  -0.1670000      -1.020000      0.1076000    
 C   -2.076300      -1.170200      -1.396900    
 C  -0.9243000     -0.3418000       1.066900    
 C  -0.7305000      -1.428100      -1.103400    
 C   -5.341500     -0.1129000      -1.205200    
 C   -5.523500       1.146700       1.337400    
 C    1.234000      -1.295500      0.3994000    
 C   -6.544200      0.4536000     -0.7617000    
 C   -6.630900       1.071900      0.4877000    
 C    3.555400     -0.3111000      0.1274000    
 C    4.292600      0.7675000     -0.3325000    
 C    4.167400      -1.405200      0.7169000    
 C    5.681000      0.7516000     -0.1997000    
 C    5.555800      -1.421000      0.8498000    
 C    6.312600     -0.3427000      0.3912000    
 C    3.890500       3.110900     -0.2851000    
 C    2.684100       3.985900     -0.5514000    
 H   -2.506200      -1.491400      -2.341500    
 H  -0.5034000     -1.7800000E-02   2.012300    
 H   -5.290500     -0.5900000      -2.179300    
 H   -5.583100       1.624700       2.307900    
 H   -7.422300      0.4106000      -1.401000    
 H   -7.576800       1.503100      0.8059000    
 H    1.758400      0.5213000     -0.4448000    
 H    3.659100      -2.277900       1.097000    
 H   0.9335000      -2.201800      -1.712600    
 H    6.285200       1.580000     -0.5596000    
 H    6.049300      -2.272600       1.309300    
 H    7.393900     -0.3561000      0.4928000    
 H    4.019900       2.996300      0.7984000    
 H    4.788800       3.579900     -0.7009000    
 H    2.805600       4.970600     -9.1300003E-02
 H    2.531400       4.115200      -1.628000    
 H    1.775800       3.520000     -0.1552000    


%chk=000077276-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000077276

0 1
O -2.766426 1.530620 0.036594
O -0.568336 -3.530425 -0.789407
O 3.301171 1.935015 0.334773
O 1.756010 -2.634120 -0.502194
N 2.187407 -0.378307 -0.100133
C -2.966055 -0.778328 -0.399633
C -4.307888 -0.201916 -0.357485
C -2.064576 0.305466 -0.156305
C -4.137895 1.190006 -0.092229
C -0.140367 -1.140903 -0.332777
C -2.444726 -2.064750 -0.611652
C -0.683653 0.161570 -0.117108
C -1.039652 -2.253397 -0.578800
C -5.616391 -0.714725 -0.513865
C -5.202564 2.092427 0.023813
C 1.319058 -1.425370 -0.315378
C -6.707425 0.174638 -0.401344
C -6.502980 1.557623 -0.136401
C 3.604480 -0.398877 -0.034306
C 4.218810 0.871653 0.204156
C 4.419614 -1.545342 -0.182190
C 5.618442 0.991445 0.291936
C 5.825477 -1.419923 -0.092833
C 6.423699 -0.164046 0.141807
C 3.831446 3.292097 0.578162
C 2.632972 4.230430 0.685079
H -3.076061 -2.936548 -0.801494
H -0.062618 1.041292 0.077927
H -5.782578 -1.777636 -0.717701
H -5.032525 3.152924 0.227727
H -7.728581 -0.202795 -0.519270
H -7.368676 2.223691 -0.054375
H 1.803267 0.561554 0.034583
H 3.941062 -2.508480 -0.363429
H 0.467384 -3.479619 -0.723832
H 6.087743 1.962365 0.474164
H 6.449556 -2.311938 -0.208738
H 7.512972 -0.073634 0.209241
H 4.424521 3.284687 1.514763
H 4.495056 3.575117 -0.263580
H 2.979753 5.262283 0.874655
H 2.046393 4.228707 -0.249615
H 1.972177 3.929669 1.516194


