%chk=000093852.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093852

0 1
 O   -3.965100     -2.5000000E-02 -0.3304000    
 O    2.192200      -2.227800      1.3000000E-03
 O   -2.554900      0.3575000       1.453600    
 N  -0.3677000      9.7099997E-02 -0.1486000    
 C   0.7028000     -6.4700000E-02  -1.123300    
 C    2.058700      0.1116000     -0.5031000    
 C   -1.671900     -6.7900002E-02 -0.7752000    
 C    2.737300     -0.9794000      2.8899999E-02
 C    2.624100       1.381900     -0.4698000    
 C    3.996300     -0.7981000      0.6013000    
 C    3.883200       1.563100      0.1028000    
 C   -2.744500      0.1186000      0.2687000    
 C    4.569300      0.4731000      0.6383000    
 C   -5.097300      0.1231000      0.5327000    
 C   -6.362600     -6.3199997E-02 -0.2771000    
 H   0.5872000      0.6705000      -1.931100    
 H   0.6410000      -1.047100      -1.609200    
 H  -0.2600000     -0.6004000      0.5884000    
 H   -1.820200      0.6887000      -1.553300    
 H   -1.774000      -1.072300      -1.200300    
 H    2.099600       2.239700     -0.8817000    
 H    4.542200      -1.638300       1.022300    
 H    4.329200       2.553000      0.1320000    
 H    5.549600      0.6144000       1.084100    
 H   -5.051800     -0.6303000       1.327000    
 H   -5.087600       1.123700      0.9792000    
 H   -7.249800      4.3699998E-02  0.3533000    
 H   -6.413500      0.6720000      -1.087000    
 H   -6.378500      -1.053100     -0.7450000    
 H    2.810200      -2.853300      0.4169000    


%chk=000093852-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000093852

0 1
O -4.000716 0.051055 -0.286183
O 1.706814 -1.810642 0.637199
O -2.519914 -0.904333 1.242776
N -0.357634 0.066945 -0.302804
C 0.748207 0.020100 -1.285163
C 2.107394 0.196697 -0.628456
C -1.685562 -0.039151 -0.914410
C 2.575902 -0.739255 0.331967
C 2.956438 1.279054 -0.951954
C 3.841660 -0.603472 0.944904
C 4.229390 1.432713 -0.353291
C -2.735412 -0.343471 0.143856
C 4.670525 0.487133 0.598340
C -5.135975 -0.261366 0.638596
C -6.399271 0.287423 -0.015682
H 0.598692 0.837309 -2.017067
H 0.746377 -0.938359 -1.867153
H -0.229883 -0.622674 0.451855
H -1.961505 0.896337 -1.435962
H -1.766740 -0.858428 -1.680299
H 2.607769 2.017011 -1.684051
H 4.178704 -1.340464 1.685989
H 4.865142 2.282113 -0.623443
H 5.651971 0.593958 1.072982
H -5.173296 -1.356496 0.783928
H -4.924202 0.208017 1.616034
H -7.273743 0.081975 0.628447
H -6.324219 1.378405 -0.162190
H -6.572772 -0.184507 -0.997909
H 2.099360 -2.402826 1.324843


