%chk=000169874.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000169874

0 1
 O    3.959900       1.161500       1.269300    
 O    3.832600     -0.6630000     -6.8800002E-02
 N    2.223900       1.019600     -0.1618000    
 C  -0.9741000      0.1814000     -0.2825000    
 C   0.2742000     -0.3679000     -0.6178000    
 C   -1.979300     -0.6596000      0.2516000    
 C    1.381000      0.4649000      -1.187200    
 C   0.5278000      -1.726800     -0.4292000    
 C   -1.246800       1.546700     -0.4658000    
 C   -1.706600      -2.025000      0.4348000    
 C   -3.227600     -0.1103000      0.5868000    
 C  -0.4607000      -2.553700      9.6100003E-02
 C   -2.492700       2.075500     -0.1272000    
 C   -3.481200       1.248600      0.3980000    
 C    3.369800      0.4082000      0.3036000    
 H    2.001600     -0.1544000      -1.848600    
 H    1.026900       1.277900      -1.826900    
 H    1.490500      -2.159100     -0.6883000    
 H  -0.5131000       2.245400     -0.8552000    
 H   -2.464400      -2.690200      0.8437000    
 H   -4.015000     -0.7380000      0.9991000    
 H  -0.2629000      -3.611600      0.2423000    
 H   -2.690300       3.134000     -0.2702000    
 H   -4.450600       1.661000      0.6623000    
 H    1.955000       1.906900      0.2526000    
 H    4.777100      0.7408000       1.611900    


%chk=000169874-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000169874

0 1
O 3.915869 1.372374 1.349325
O 4.109551 -0.358408 -0.232258
N 2.220415 1.044888 -0.137749
C -0.961001 0.148258 -0.298310
C 0.294652 -0.470302 -0.660451
C -2.022916 -0.680547 0.243272
C 1.456715 0.359159 -1.199858
C 0.459163 -1.850393 -0.489244
C -1.208910 1.556362 -0.443855
C -1.806983 -2.089202 0.402514
C -3.270175 -0.074866 0.610907
C -0.588321 -2.664374 0.042370
C -2.434068 2.118401 -0.076299
C -3.476010 1.297146 0.457732
C 3.450747 0.592614 0.264519
H 2.174665 -0.295900 -1.719291
H 1.108258 1.113751 -1.928558
H 1.415995 -2.311825 -0.759699
H -0.431601 2.206342 -0.861510
H -2.615362 -2.706141 0.812693
H -4.064216 -0.712603 1.017723
H -0.425937 -3.740581 0.164221
H -2.602708 3.194017 -0.198738
H -4.432201 1.749278 0.742388
H 1.780927 1.785306 0.410582
H 4.808453 1.030048 1.610176


