%chk=000083119.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083119

0 1
 O    4.659100      0.4421000     -0.5737000    
 O   -4.650500      0.4089000      0.5719000    
 N    4.338300      -4.949100      0.7519000    
 N   -4.290800      -4.981000     -0.7492000    
 C  -7.0000002E-03   3.561600     -2.2000000E-03
 C    1.226000       2.736800     -0.1534000    
 C   -1.295000       2.686700      0.1573000    
 C   0.1903000       4.535500       1.212400    
 C  -0.3308000       4.529000      -1.202800    
 C    1.599300       1.848700      0.8552000    
 C   -1.601000       1.836500     -0.8582000    
 C    2.006600       2.854200      -1.303400    
 C   -2.015500       2.840700       1.299700    
 C    2.753300       1.077900      0.7138000    
 C   -2.749300       1.057500     -0.7161000    
 C    3.160400       2.083400      -1.444800    
 C   -3.163800       2.061700       1.441700    
 C    3.533900       1.195300     -0.4362000    
 C   -3.530800       1.170100      0.4338000    
 C    4.579300     -0.9005000     -0.2436000    
 C   -4.561000     -0.9333000      0.2429000    
 C    3.495400      -1.639000     -0.6827000    
 C   -3.471800      -1.663500      0.6826000    
 C    5.585600      -1.468100      0.5168000    
 C   -5.563200      -1.508700     -0.5170000    
 C    3.414900      -2.991200     -0.3499000    
 C   -3.381600      -3.015500      0.3509000    
 C    5.505200      -2.820300      0.8495000    
 C   -5.473000      -2.860700     -0.8486000    
 C    4.419800      -3.581800      0.4161000    
 C   -4.382100      -3.613900     -0.4146000    
 H    1.084900       5.153600       1.057500    
 H  -0.6504000       5.229900       1.331500    
 H   0.3448000       4.009900       2.162100    
 H   0.4663000       5.269500      -1.342800    
 H  -0.4604000       3.998100      -2.152900    
 H   -1.258900       5.086100      -1.020200    
 H    1.008300       1.740600       1.760600    
 H   -1.001600       1.738400      -1.756200    
 H    1.762700       3.529000      -2.116400    
 H   -1.781400       3.509400       2.115800    
 H    3.031700      0.4112000       1.525800    
 H   -3.022500      0.3877000      -1.527400    
 H    3.764900       2.178200      -2.342800    
 H   -3.768500       2.151800       2.340200    
 H    2.712400      -1.208400      -1.300000    
 H   -2.691900      -1.226700       1.299400    
 H    6.430700     -0.8762000      0.8551000    
 H   -6.412500     -0.9233000     -0.8558000    
 H    2.566700      -3.575300     -0.6978000    
 H   -2.529200      -3.593100      0.6994000    
 H    6.294600      -3.268900       1.447000    
 H   -6.259200      -3.315500      -1.445900    
 H    3.551000      -5.501300      0.4386000    
 H    5.066000      -5.378000       1.308000    
 H   -5.015500      -5.415500      -1.304900    
 H   -3.499600      -5.527100     -0.4355000    


%chk=000083119-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000083119

0 1
O 4.746379 0.323058 -1.030469
O -4.759002 0.270615 1.025122
N 6.225880 -4.529582 1.484333
N -6.185176 -4.603485 -1.478783
C -0.022896 3.482621 0.002315
C 1.212381 2.601710 -0.315370
C -1.248641 2.587538 0.317581
C 0.357036 4.404513 1.199819
C -0.412783 4.403536 -1.192837
C 1.591314 1.577421 0.592735
C -1.616335 1.561775 -0.593501
C 2.036182 2.805418 -1.451498
C -2.074745 2.779244 1.454097
C 2.741182 0.787353 0.391246
C -2.757692 0.758824 -0.394562
C 3.188898 2.022591 -1.676534
C -3.219064 1.983478 1.676546
C 3.543539 1.016868 -0.752261
C -3.562761 0.976649 0.749368
C 5.047905 -0.888416 -0.340832
C -5.046592 -0.945493 0.337838
C 4.197677 -2.015104 -0.404928
C -4.180613 -2.060412 0.397547
C 6.291588 -0.974848 0.317614
C -6.292878 -1.049433 -0.313142
C 4.587077 -3.223344 0.205116
C -4.557013 -3.274170 -0.209719
C 6.687994 -2.185317 0.921091
C -6.676158 -2.265538 -0.913723
C 5.839068 -3.329334 0.880333
C -5.811321 -3.397703 -0.877572
H 1.262893 4.982794 0.945262
H -0.451355 5.124141 1.427484
H 0.576384 3.821204 2.111889
H 0.387497 5.132902 -1.418083
H -0.625124 3.820330 -2.106628
H -1.325201 4.970880 -0.937133
H 0.966599 1.386875 1.473613
H -0.989275 1.380521 -1.474658
H 1.783687 3.580174 -2.181567
H -1.830727 3.554634 2.186344
H 3.014538 0.011886 1.113149
H -3.022793 -0.017326 -1.118801
H 3.822980 2.180488 -2.554409
H -3.855098 2.132187 2.554608
H 3.241230 -1.948260 -0.934094
H -3.222228 -1.980478 0.921355
H 6.940909 -0.094312 0.344782
H -6.954376 -0.177913 -0.336806
H 3.922606 -4.094419 0.151924
H -3.880381 -4.136032 -0.159918
H 7.658410 -2.245734 1.428508
H -7.648658 -2.339619 -1.415304
H 5.624795 -5.347008 1.451533
H 7.118002 -4.607825 1.962550
H -7.079265 -4.694370 -1.951055
H -5.572879 -5.412657 -1.449017


