%chk=000161806.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161806

0 1
 O   -1.673200     -0.5337000       1.018600    
 O   -1.512800       2.358000      -1.095900    
 O   -3.698300       1.567800      0.3314000    
 O   -2.638200      -3.058200      0.2682000    
 O    1.272100       2.308700      0.7295000    
 O    4.200500      -1.012700     -0.3535000    
 N   0.4166000      0.2063000      0.2773000    
 N    2.783400      0.6948000      0.1973000    
 C   -1.648500      0.9828000     -0.8020000    
 C   -3.083500      0.5955000     -0.5135000    
 C  -0.9503000      0.5892000      0.4883000    
 C   -2.912500     -0.6851000      0.2921000    
 C   -2.804400      -1.932100     -0.5753000    
 C   0.6918000      -1.112300     -7.5400002E-02
 C    1.486700       1.136000      0.4184000    
 C    1.927700      -1.563800     -0.2938000    
 C    2.953900     -0.5400000     -0.1261000    
 C    5.188900     -1.1000000E-03 -0.1857000    
 H   -1.275300      0.4076000      -1.657900    
 H   -3.702600      0.4927000      -1.408400    
 H  -0.9851000       1.399400       1.226300    
 H   -3.702800     -0.8170000       1.039900    
 H   -1.966200      -1.892500      -1.274900    
 H   -3.725200      -2.070100      -1.151700    
 H  -0.5626000       2.545600      -1.181800    
 H   -3.223300       1.597500       1.178600    
 H  -0.1287000      -1.805200     -0.1742000    
 H   -2.585400      -3.841200     -0.3059000    
 H    2.163900      -2.581900     -0.5664000    
 H    5.057400      0.8116000     -0.9085000    
 H    6.163100     -0.4586000     -0.3847000    
 H    5.209300      0.3724000      0.8441000    


%chk=000161806-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000161806

0 1
O -1.805621 -0.617723 1.125514
O -1.691663 2.579680 -0.500693
O -3.911354 1.470767 0.422392
O -2.293755 -3.083153 -0.103241
O 0.957217 2.229942 -0.059753
O 4.292636 -1.074997 -0.220376
N 0.398612 0.003794 0.386234
N 2.671051 0.619839 -0.131200
C -1.678011 1.134459 -0.557086
C -3.137825 0.611641 -0.457589
C -0.988824 0.493071 0.690829
C -2.966015 -0.773645 0.195312
C -2.706486 -1.880945 -0.837519
C 0.737995 -1.330478 0.471799
C 1.361221 1.023980 0.051873
C 2.046482 -1.726617 0.248616
C 2.987840 -0.680624 -0.037287
C 5.284413 -0.005990 -0.496592
H -1.190863 0.767764 -1.483476
H -3.613726 0.550760 -1.458140
H -0.904705 1.236173 1.505638
H -3.822754 -1.032429 0.836410
H -1.916563 -1.574124 -1.557617
H -3.648529 -2.051560 -1.400821
H -0.729195 2.842620 -0.352938
H -3.500300 2.378579 0.350884
H -0.080568 -2.013443 0.722110
H -2.338136 -3.867809 -0.704794
H 2.355098 -2.769328 0.308286
H 5.013703 0.537418 -1.416407
H 6.235965 -0.544402 -0.608938
H 5.319059 0.707179 0.342970


