%chk=000160067.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000160067

0 1
 O   -2.971200     -0.7397000      -1.411500    
 O   -3.982200     -0.5723000       1.520600    
 O   -2.170400      -2.427600      0.8763000    
 O   -2.885100       2.680900     -0.7143000    
 N   0.4400000     -3.7300002E-02  6.6000000E-02
 N    1.715900       1.620700      0.8266000    
 N    2.155400      -1.542500     -0.7638000    
 N    4.386600     -0.6182000     -0.4125000    
 N    4.747800       1.506900      0.6270000    
 C   -2.941100      0.3187000     -0.4501000    
 C   -1.714000     -8.0200002E-02  -1.189100    
 C  -0.7735000     -0.7991000     -0.2532000    
 C   -2.771600     -7.0600003E-02  0.9859000    
 C   -1.630800      -1.112100       1.001900    
 C   -3.707800       1.522600     -0.8276000    
 C    1.727600     -0.4120000     -0.1820000    
 C   0.4818000       1.188600      0.6712000    
 C    2.504700      0.6301000      0.2978000    
 C    3.883500      0.4987000      0.1665000    
 C    3.504300      -1.555600     -0.8354000    
 H   -1.285100      0.5027000      -1.986200    
 H  -0.4461000      -1.729900     -0.7316000    
 H   -2.479100      0.8093000       1.568500    
 H   -1.061400      -1.084700       1.936900    
 H   -4.574000       1.657300     -0.1725000    
 H   -4.079400       1.471900      -1.857000    
 H   -4.264400      -1.322100      0.9694000    
 H   -2.694400      -2.602000       1.676700    
 H  -0.4044000       1.728400      0.9725000    
 H   -2.190200       2.617500      -1.391200    
 H    3.941900      -2.436000      -1.293700    
 H    5.746000       1.387800      0.5209000    
 H    4.374900       2.340900       1.060100    


%chk=000160067-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000160067

0 1
O -2.698360 -0.680314 -1.624848
O -3.846871 -1.634287 0.657601
O -1.566560 -1.810059 2.040204
O -3.888359 2.606309 -0.057428
N 0.522763 0.142630 0.238113
N 2.087863 1.715108 0.843082
N 2.032878 -1.586548 -0.707086
N 4.398064 -0.921393 -0.570355
N 5.108282 1.135580 0.349518
C -3.027699 0.367988 -0.558466
C -1.612590 0.203321 -1.044142
C -0.764219 -0.524522 0.008056
C -3.154758 -0.341291 0.796503
C -1.681375 -0.583097 1.289715
C -3.990002 1.458492 -0.975011
C 1.771090 -0.388213 -0.114446
C 0.778557 1.405418 0.803492
C 2.720788 0.594618 0.271397
C 4.090671 0.281438 0.021949
C 3.374349 -1.770347 -0.896560
H -1.133816 0.865922 -1.774112
H -0.520962 -1.547208 -0.334537
H -3.738529 0.246321 1.519249
H -1.388053 0.236909 1.971614
H -5.030566 1.109176 -0.871127
H -3.811898 1.742158 -2.031184
H -3.639382 -1.965781 -0.261926
H -2.362695 -2.362877 1.788841
H -0.013977 2.049722 1.178258
H -3.071067 3.125678 -0.267130
H 3.671500 -2.712202 -1.366802
H 6.067436 0.856667 0.153360
H 4.901698 2.025783 0.797309


