%chk=000174809.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000174809

0 1
 O    2.334700      0.9363000      -1.540800    
 O    2.689100      -2.641200      0.4438000    
 O   -5.170600     -0.2773000      0.6655000    
 O   -4.272400      -1.032600      -1.194800    
 N   0.9327000      0.7922000      -1.458900    
 N   -1.792500     -1.0800000E-02 -0.4556000    
 N   -1.209600       1.106900       1.372800    
 N   -4.168700     -0.4230000     -9.1899998E-02
 C    1.775400      0.8094000      0.7342000    
 C    2.824400       1.303400     -0.2441000    
 C    4.193100      0.6750000     -1.8900000E-02
 C    2.089000     -0.5304000       1.399900    
 C   0.6087000      0.7348000     -0.2048000    
 C    4.147500     -0.8437000     -0.1458000    
 C    2.937900      -1.438500      0.5381000    
 C  -0.7785000      0.6103000      0.2294000    
 C   -2.929200      9.7700000E-02  0.2950000    
 C   -2.544300      0.7908000       1.418500    
 C   -1.666900     -0.6592000      -1.741700    
 H    1.574800       1.557800       1.508900    
 H    2.899500       2.397000     -0.2152000    
 H    4.563800      0.9550000      0.9746000    
 H    4.908500       1.062100     -0.7540000    
 H    1.169600      -1.061100       1.670700    
 H    2.653700     -0.3595000       2.324400    
 H    5.050400      -1.280300      0.2929000    
 H    4.102600      -1.127500      -1.203300    
 H   -3.155100       1.081800       2.261500    
 H   -2.090700      -1.664700      -1.680600    
 H   -2.171400     -4.8799999E-02  -2.494400    
 H  -0.6258000     -0.8059000      -2.020500    


%chk=000174809-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000174809

0 1
O 2.423350 1.080279 -1.701765
O 2.592410 -2.484840 1.434072
O -5.010837 -0.621072 0.906427
O -4.433408 -0.869122 -1.300288
N 1.048445 0.691206 -1.600590
N -1.753039 -0.052137 -0.636243
N -1.006295 0.527005 1.452724
N -4.154242 -0.574199 -0.064725
C 1.797396 1.033433 0.668964
C 2.975715 1.370815 -0.291753
C 4.221879 0.495950 -0.110048
C 2.123813 -0.102986 1.680680
C 0.685617 0.669594 -0.322245
C 3.843360 -0.998580 -0.047148
C 2.823339 -1.308512 1.052791
C -0.663922 0.375268 0.126193
C -2.821585 -0.166878 0.270145
C -2.335951 0.194175 1.541589
C -1.768406 -0.337782 -2.090955
H 1.478434 1.916190 1.249784
H 3.219815 2.446343 -0.302047
H 4.743306 0.807443 0.816692
H 4.917795 0.682906 -0.947418
H 1.211088 -0.423434 2.207323
H 2.811744 0.308896 2.449128
H 4.727458 -1.642764 0.106162
H 3.402773 -1.309871 -1.015687
H -2.891600 0.219110 2.474540
H -2.051064 -1.387684 -2.262212
H -2.512461 0.301337 -2.590198
H -0.765227 -0.134089 -2.488992


