%chk=000147973.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147973

0 1
 O   -6.306500      -1.978200       2.718400    
 O   -6.475400       2.214900      -2.437000    
 O    5.425400      0.6629000      0.7835000    
 N   -4.829100      6.9100000E-02  4.9600001E-02
 N   0.7609000     -5.4699998E-02 -0.2352000    
 N    1.159000      -1.239300     -0.3330000    
 N    6.756700      -1.374700     -0.6283000    
 C   -5.558600      -1.035500      0.6397000    
 C   -5.564300       1.212500     -0.4534000    
 C   -3.420800      3.7999999E-02 -2.2000000E-02
 C   -5.558200     -0.9089000       2.153600    
 C   -5.722500       1.106500      -1.960600    
 C   -2.727700       1.105900     -0.5918000    
 C   -2.721300      -1.060800      0.4771000    
 C   -1.335100       1.075100     -0.6628000    
 C   -1.328600      -1.091700      0.4060000    
 C  -0.6354000     -2.3700001E-02 -0.1639000    
 C    4.707800     -0.3122000      0.1577000    
 C    5.193500       2.006500      0.3661000    
 C    4.720300       2.818200       1.562200    
 C    2.562300      -1.270000     -0.4048000    
 C    5.347700      -1.331500     -0.5474000    
 C    3.315100     -0.2814000      0.2289000    
 C    3.202300      -2.289300      -1.110000    
 C    4.594800      -2.320100      -1.181300    
 C    4.437800       4.262300       1.188700    
 H   -6.601900      -1.023200      0.2950000    
 H   -5.200100      -2.017100      0.3070000    
 H   -6.567100       1.241800     -5.1000002E-03
 H   -5.129400       2.172600     -0.1502000    
 H   -6.024600      3.3700000E-02   2.461300    
 H   -4.551200     -0.9386000       2.578600    
 H   -6.259900      0.1895000      -2.227100    
 H   -4.763900       1.097100      -2.486400    
 H   -3.210300       1.989700     -0.9936000    
 H   -3.199500      -1.920500      0.9330000    
 H  -0.8021000       1.911500      -1.107500    
 H  -0.8214000      -1.957200      0.8253000    
 H    4.477500       2.070700     -0.4633000    
 H    6.146800       2.403400     -1.1000000E-03
 H    3.818200       2.366700       1.990500    
 H    5.478100       2.780300       2.354000    
 H   -6.295600      -1.855800       3.683000    
 H   -6.568200       2.104700      -3.398600    
 H    2.839700      0.5036000      0.8113000    
 H    2.623400      -3.063400      -1.606800    
 H    5.081000      -3.119900      -1.734200    
 H    5.335800       4.748400      0.7943000    
 H    3.651400       4.324400      0.4297000    
 H    4.106100       4.823700       2.067700    
 H    7.308200     -0.6599000     -0.1723000    
 H    7.213500      -2.116700      -1.141500    


%chk=000147973-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000147973

0 1
O -6.791846 -2.668051 1.726652
O -6.556671 3.042389 -1.544163
O 5.843326 0.926568 -0.345443
N -4.914609 0.082142 0.034097
N 0.780612 -0.137756 -0.148206
N 1.364598 -1.314007 -0.018061
N 7.017583 -1.438462 -0.133589
C -5.751469 -1.113923 0.227768
C -5.616360 1.368307 -0.108796
C -3.513149 0.002054 -0.013354
C -5.911244 -1.490564 1.713933
C -5.837272 1.760409 -1.583102
C -2.705178 1.163498 -0.238977
C -2.832378 -1.250258 0.166014
C -1.305543 1.071032 -0.270457
C -1.436025 -1.334379 0.119657
C -0.638804 -0.171501 -0.096039
C 4.953253 -0.162383 -0.207595
C 5.281211 2.289233 -0.424008
C 4.893196 2.848349 0.955965
C 2.782592 -1.280265 -0.056361
C 5.631322 -1.428979 -0.102858
C 3.559579 -0.085632 -0.186025
C 3.442999 -2.532181 0.051956
C 4.847441 -2.606047 0.027405
C 4.351320 4.290557 0.842403
H -6.756567 -0.921823 -0.188091
H -5.343661 -1.979491 -0.323519
H -6.603695 1.298594 0.381353
H -5.068017 2.179157 0.402522
H -6.363393 -0.642053 2.270325
H -4.921488 -1.718659 2.159576
H -6.435389 0.976710 -2.095032
H -4.862376 1.857634 -2.103102
H -3.167315 2.142668 -0.391889
H -3.403112 -2.166350 0.345245
H -0.693647 1.963945 -0.439263
H -0.927578 -2.294113 0.255910
H 4.419631 2.298725 -1.121478
H 6.095034 2.888400 -0.868666
H 4.133927 2.196288 1.424738
H 5.785150 2.826254 1.610208
H -6.903121 -2.992930 2.654383
H -6.710243 3.368035 -2.465599
H 3.012791 0.858716 -0.262101
H 2.829663 -3.432920 0.154155
H 5.350344 -3.576820 0.109205
H 5.097500 4.967739 0.385134
H 3.435294 4.328046 0.223408
H 4.098305 4.693277 1.839037
H 7.508367 -0.553305 -0.234796
H 7.539709 -2.306474 -0.067477


