%chk=000164155.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000164155

0 1
 O  -0.2118000     -0.9268000      0.7157000    
 O    3.454200       2.452500     -0.1287000    
 N   -1.972600      -2.208300     -2.3000000E-02
 N   -4.059700      -1.181800     -0.6528000    
 C    1.883500      -1.927900       1.365300    
 C    2.708100      -1.070400      0.4360000    
 C   0.4740000      -2.167100      0.8355000    
 C   -2.247100      0.1893000      0.1125000    
 C    2.695600      0.3066000      0.5911000    
 C    3.461800      -1.676400     -0.5568000    
 C   -1.503500     -0.9783000      0.2595000    
 C   -3.559800      3.1800002E-02 -0.3612000    
 C    3.456800       1.098500     -0.2688000    
 C    4.222600     -0.8845000      -1.416900    
 C   -1.735000       1.463100      0.4143000    
 C    4.220200      0.5029000      -1.272900    
 C   -4.335000       1.177800     -0.5213000    
 C   -2.531600       2.591300      0.2450000    
 C   -3.833000       2.448100     -0.2233000    
 C   -3.239200      -2.235800     -0.4678000    
 C    2.651400       2.995200      0.9185000    
 H    1.831700      -1.440600       2.347600    
 H    2.387400      -2.888800       1.527000    
 H  -5.4499999E-02  -2.819100       1.542300    
 H   0.5283000      -2.663000     -0.1424000    
 H    2.084000      0.7153000       1.388000    
 H    3.468200      -2.755800     -0.6781000    
 H    4.816500      -1.348200      -2.199100    
 H  -0.7201000       1.590100      0.7821000    
 H    4.814900       1.114500      -1.945900    
 H   -5.356800       1.093000     -0.8863000    
 H   -2.139600       3.576700      0.4772000    
 H   -4.461500       3.323600     -0.3582000    
 H   -3.647800      -3.210600     -0.7046000    
 H    1.588400       2.786000      0.7600000    
 H    2.770400       4.083100      0.8857000    
 H    2.997900       2.665900       1.904100    


%chk=000164155-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000164155

0 1
O -0.283403 -1.026984 0.823288
O 3.242252 2.303916 -0.765461
N -1.992156 -2.017291 -0.464909
N -4.029666 -0.782288 -1.010596
C 1.861035 -2.076391 1.330289
C 2.832862 -1.213147 0.532453
C 0.493997 -2.296623 0.666227
C -2.252213 0.274924 0.366225
C 2.542621 0.155218 0.285477
C 4.034104 -1.767117 0.029748
C -1.519000 -0.963167 0.220740
C -3.536870 0.312812 -0.292512
C 3.445044 0.946912 -0.462361
C 4.934442 -0.963887 -0.713382
C -1.787233 1.408220 1.096493
C 4.648966 0.390326 -0.964010
C -4.324013 1.501038 -0.205470
C -2.580139 2.560016 1.167826
C -3.850321 2.605004 0.512417
C -3.240628 -1.866151 -1.050314
C 2.005254 2.926843 -0.289865
H 1.686212 -1.644776 2.335245
H 2.308426 -3.076081 1.488617
H -0.078174 -3.102676 1.160048
H 0.575079 -2.529803 -0.409173
H 1.609472 0.572468 0.672182
H 4.268551 -2.821334 0.218055
H 5.863708 -1.398417 -1.098379
H -0.819126 1.353986 1.604136
H 5.328930 1.028522 -1.536251
H -5.293617 1.510122 -0.712025
H -2.231804 3.432222 1.731568
H -4.458179 3.514066 0.577759
H -3.607739 -2.736288 -1.603282
H 1.111421 2.425139 -0.709550
H 2.050431 3.965646 -0.648674
H 1.948769 2.916923 0.816721


