%chk=000162556.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162556

0 1
 O   -3.682200      0.5215000     -6.5099999E-02
 O    1.835500      0.4995000      0.1884000    
 N    4.439600     -0.5646000     -7.4299999E-02
 N    6.155700      -1.808600      0.8601000    
 N    6.712700      0.2112000     -3.7400000E-02
 C   -4.420700     -0.7103000      3.9700001E-02
 C   -3.735700      -1.852600     -0.7279000    
 C   -2.312100      -2.076200     -0.2376000    
 C   -1.601600     -0.7627000     -9.7499996E-02
 C   -2.315700      0.4382000     -1.2700000E-02
 C   -4.634300      -1.038100       1.525200    
 C   -5.789200     -0.4347000     -0.6006000    
 C  -0.2027000     -0.7329000     -1.8900000E-02
 C   -1.635500       1.652900      0.1133000    
 C  -0.2431000       1.672900      0.1786000    
 C   0.4731000      0.4801000      0.1162000    
 C   0.5932000      -2.000600     -7.1599998E-02
 C   -2.401900       2.937100      0.1873000    
 C   0.4864000       2.971200      0.3183000    
 C    2.545900      0.6132000      -1.042000    
 C    4.036000      0.6665000     -0.7591000    
 C    5.696800     -0.6830000      0.2173000    
 H   -3.691300      -1.591000      -1.794500    
 H   -4.308700      -2.784200     -0.6496000    
 H   -1.806200      -2.725400     -0.9612000    
 H   -2.321200      -2.589700      0.7307000    
 H   -3.686400      -1.153700       2.060500    
 H   -5.164300     -0.2208000       2.028300    
 H   -5.216100      -1.956900       1.652400    
 H   -6.294800      0.3994000     -0.1001000    
 H   -5.676000     -0.1391000      -1.650000    
 H   -6.441400      -1.313200     -0.5558000    
 H    1.596400      -1.890100      0.3522000    
 H   0.1193000      -2.792900      0.5173000    
 H   0.6954000      -2.337300      -1.108100    
 H   -2.443000       3.290900       1.222600    
 H   -1.943700       3.709600     -0.4397000    
 H   -3.430600       2.844900     -0.1751000    
 H    1.515800       2.843000      0.6677000    
 H   0.5203000       3.490600     -0.6449000    
 H   7.7999998E-03   3.618900       1.060600    
 H    2.317000     -0.2483000      -1.680500    
 H    2.241100       1.525100      -1.568400    
 H    4.245300       1.530100     -0.1163000    
 H    4.575300      0.7801000      -1.706500    
 H    5.523900      -2.559800       1.115700    
 H    7.134900      -1.921400       1.098200    
 H    7.667600      9.8000001E-03  0.2394000    
 H    6.550000       1.096400     -0.5038000    


%chk=000162556-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000162556

0 1
O -3.665148 0.445031 -0.131647
O 1.954331 0.878744 0.082414
N 4.434371 -0.669738 -0.657950
N 5.490240 -2.345488 0.600164
N 6.306417 -0.161453 0.825149
C -4.324688 -0.878284 0.132355
C -3.577085 -1.959331 -0.681088
C -2.092202 -2.052587 -0.274725
C -1.445470 -0.678934 -0.153844
C -2.249279 0.490762 -0.088570
C -4.291359 -1.141755 1.653555
C -5.760214 -0.677127 -0.372469
C -0.029217 -0.551516 -0.106153
C -1.681328 1.791514 0.002529
C -0.266845 1.918509 0.036944
C 0.535982 0.746400 -0.018051
C 0.862081 -1.781163 -0.134095
C -2.573641 3.017799 0.068140
C 0.379888 3.286545 0.154792
C 2.657489 0.939983 -1.218776
C 4.151361 0.745131 -0.945001
C 5.366429 -1.004367 0.202943
H -3.655996 -1.690310 -1.752017
H -4.077179 -2.936965 -0.545401
H -1.545228 -2.660751 -1.020019
H -1.994235 -2.602780 0.684567
H -3.258156 -1.136508 2.040517
H -4.857037 -0.356349 2.184253
H -4.746992 -2.121767 1.888184
H -6.232565 0.175390 0.146067
H -5.763502 -0.466887 -1.456137
H -6.365840 -1.582208 -0.184605
H 1.920107 -1.501666 -0.008493
H 0.587168 -2.488117 0.672385
H 0.764942 -2.333521 -1.090015
H -2.432538 3.567165 1.019690
H -2.339762 3.728855 -0.747305
H -3.632714 2.732979 -0.011205
H 1.461967 3.184801 0.332298
H 0.225771 3.891031 -0.760877
H -0.055456 3.863725 0.991831
H 2.291991 0.136645 -1.887475
H 2.465613 1.926451 -1.693284
H 4.430022 1.448703 -0.122693
H 4.702596 1.066079 -1.856917
H 4.782736 -2.971131 0.218272
H 6.418060 -2.728699 0.775626
H 6.655729 -0.402412 1.750990
H 6.354984 0.814574 0.545947


