%chk=000161884.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161884

0 1
 O    1.060700      0.2902000      -1.289100    
 O   0.8363000       3.097100      7.9400003E-02
 O    2.850100       1.863300       1.398500    
 O    4.290300     -0.4328000     -1.3700000E-02
 O    2.697700      -1.718600      -1.084700    
 N   -1.061000      3.7099998E-02 -0.2402000    
 N   -1.989900      -1.865500      0.4639000    
 N   -3.058600       1.387400     -0.5389000    
 N   -5.072400      0.1327000      3.2499999E-02
 N   -5.001100      -2.137600      0.7861000    
 C   0.5800000       1.767400      0.5310000    
 C  -2.0500001E-02  0.9882000     -0.6358000    
 C    1.880800       1.034200      0.7899000    
 C    2.281600      0.5981000     -0.6050000    
 C    3.085600     -0.6593000     -0.6104000    
 C   -2.409600      0.2596000     -0.2120000    
 C  -0.8603000      -1.254300      0.1740000    
 C   -2.966400     -0.9309000      0.2272000    
 C   -4.352000     -0.9711000      0.3461000    
 C    5.167100      -1.562100      5.0200000E-02
 C   -4.391000       1.227200     -0.3843000    
 C    6.452600      -1.150400      0.7355000    
 H  -5.6000002E-02   1.834100       1.419000    
 H  -0.4721000       1.646000      -1.387700    
 H    1.706100      0.1639000       1.434400    
 H    2.814500       1.371700      -1.169400    
 H  -2.4300000E-02   3.515600     -9.4599999E-02
 H    2.474500       2.184700       2.235900    
 H   0.1227000      -1.697300      0.2522000    
 H    4.685700      -2.365900      0.6183000    
 H    5.384500      -1.913600     -0.9645000    
 H   -4.999400       2.092000     -0.6267000    
 H   -6.008900      -2.141800      0.8651000    
 H   -4.465600      -2.962300       1.021600    
 H    7.147300      -1.992200      0.8022000    
 H    6.936600     -0.3347000      0.1884000    
 H    6.248900     -0.7789000       1.745200    


%chk=000161884-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000161884

0 1
O 1.240556 0.413565 -1.128683
O 0.807318 3.237872 0.137590
O 2.437849 2.132779 1.909524
O 4.405849 -0.511308 -0.046622
O 2.473931 -1.720500 0.447048
N -0.979584 -0.025974 -0.311395
N -1.924503 -2.033643 0.263852
N -3.029090 1.365566 -0.489785
N -5.061761 0.060435 -0.016395
N -5.020105 -2.234957 0.548421
C 0.353584 1.906612 0.552561
C -0.003952 1.022863 -0.667046
C 1.621351 1.226553 1.140501
C 2.324566 0.668083 -0.145024
C 3.040930 -0.652864 0.111650
C -2.359230 0.196849 -0.260845
C -0.771361 -1.382807 0.013861
C -2.924489 -1.056121 0.094282
C -4.344806 -1.093231 0.213163
C 5.239825 -1.725805 0.246692
C -4.381094 1.199491 -0.347208
C 6.692250 -1.326310 0.017396
H -0.481487 1.970348 1.271734
H -0.442628 1.618330 -1.486840
H 1.337204 0.399397 1.811886
H 3.023050 1.416032 -0.555807
H 0.033394 3.818103 -0.063960
H 2.361366 3.024527 1.469486
H 0.228503 -1.813309 0.046414
H 5.038915 -2.031893 1.288974
H 4.905291 -2.536132 -0.425285
H -4.997483 2.087227 -0.517968
H -6.035212 -2.207196 0.617264
H -4.504678 -3.096360 0.716945
H 7.351274 -2.189327 0.222904
H 6.854563 -1.006554 -1.025859
H 6.984395 -0.499141 0.686174


