%chk=000133680.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133680

0 1
 O    1.020600      -1.103800      -1.670000    
 O    4.192600      0.2114000       1.614000    
 N   0.5192000      0.5210000     -9.6600004E-02
 N   -3.017800     -0.2688000     -0.2518000    
 N   -1.658500     -0.3536000      0.2044000    
 N   -5.807300      0.1576000      0.3548000    
 C    2.858500     -0.2982000     -0.3421000    
 C    3.424100      -1.727200     -0.3267000    
 C    3.594900      0.5383000      -1.401200    
 C    1.380900     -0.3573000     -0.7548000    
 C    3.130300      0.3487000       1.009200    
 C  -0.8741000      0.6319000     -0.5237000    
 C   -3.806100      -1.290600      0.4496000    
 C   -3.529000       1.071600      6.3000001E-02
 C   -5.285000      -1.178400      6.8899997E-02
 C   -5.008200       1.181800     -0.3175000    
 C   0.8961000       1.273800      0.9951000    
 C    2.096000       1.232800       1.571600    
 C    2.750800      -2.566100      0.7371000    
 C    3.121900       1.975200      -1.383500    
 H    4.504600      -1.715300     -0.1345000    
 H    3.291100      -2.211700      -1.302200    
 H    3.433400      0.1210000      -2.403200    
 H    4.677400      0.5219000      -1.221400    
 H  -0.9232000      0.4448000      -1.604200    
 H   -1.151400       1.675800     -0.3541000    
 H   -3.700000      -1.197700       1.540000    
 H   -3.452100      -2.291500      0.1720000    
 H   -3.050000       1.857200     -0.5283000    
 H   -3.399700       1.317600       1.126500    
 H   -5.423800      -1.416400     -0.9933000    
 H   -5.861200      -1.914200      0.6405000    
 H   -5.383900       2.169300     -2.7500000E-02
 H   -5.130600       1.098100      -1.405000    
 H   -1.291300      -1.281900     -4.4000000E-03
 H   0.1324000       1.917500       1.421300    
 H    2.331100       1.822100       2.449300    
 H    2.922300      -2.181700       1.746800    
 H    1.670900      -2.648400      0.5809000    
 H    3.156500      -3.583500      0.7112000    
 H    2.057200       2.084000      -1.603500    
 H    3.364700       2.499900     -0.4562000    
 H    3.646500       2.522600      -2.176500    
 H   -6.775300      0.2198000      4.1400000E-02


%chk=000133680-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000133680

0 1
O 1.671017 -1.681009 -1.603915
O 3.337089 1.849238 1.309858
N 0.331327 0.129504 -1.029226
N -2.784107 -0.325786 -0.297034
N -1.768850 -1.136544 -0.891981
N -5.234931 0.223348 1.070388
C 2.698112 -0.026076 -0.117376
C 3.049166 -1.103098 0.974601
C 3.949423 0.155934 -1.048099
C 1.547465 -0.592938 -0.969375
C 2.418840 1.319806 0.603956
C -0.830563 -0.474293 -1.765208
C -4.096279 -0.434494 -1.004978
C -2.924917 -0.613112 1.160517
C -5.112099 0.534201 -0.368040
C -3.945394 0.360187 1.780286
C 0.138312 1.321750 -0.329831
C 1.100570 1.921140 0.447933
C 1.901868 -1.425629 1.955143
C 3.751459 1.162177 -2.200673
H 3.921342 -0.711326 1.529939
H 3.359479 -2.021190 0.442039
H 4.206351 -0.839081 -1.456029
H 4.777907 0.489636 -0.396444
H -0.396933 -1.209403 -2.462131
H -1.307349 0.350781 -2.329864
H -4.497685 -1.474950 -0.942488
H -3.940088 -0.177922 -2.068676
H -1.932342 -0.491023 1.626218
H -3.273299 -1.659081 1.331212
H -4.761257 1.579014 -0.558757
H -6.095105 0.406180 -0.856559
H -4.086548 0.108986 2.846916
H -3.523938 1.394057 1.717682
H -1.988535 -2.124686 -1.073271
H -0.865689 1.745094 -0.435813
H 0.891025 2.862112 0.963086
H 1.591801 -0.530686 2.524840
H 1.015583 -1.827145 1.429154
H 2.229209 -2.188677 2.684352
H 2.939046 0.846843 -2.881669
H 3.514955 2.172832 -1.821189
H 4.675142 1.239629 -2.802233
H -6.005081 0.725100 1.528141


