%chk=000019254.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019254

0 1
 O   0.6607000      8.4299996E-02   2.424200    
 O    1.153700       1.040700      -2.259000    
 O    3.682400      -2.167300     -0.1827000    
 N    2.155600      -1.022400       1.092800    
 N    2.398100     -0.5542000      -1.191100    
 C   -2.515600      -1.476700     -0.4823000    
 C   -3.160600      0.7760000     -0.3445000    
 C   -3.201200     -0.4004000      -1.325700    
 C   -3.218000      -1.323700      0.8828000    
 C   -3.712300      0.1330000      0.9341000    
 C   -1.005300      -1.152300     -0.3886000    
 C  -0.7224000      0.3153000     -0.1339000    
 C   -1.730600       1.207400     -0.1098000    
 C   0.7124000      0.7024000      9.0899996E-02
 C   0.8324000       2.199700      0.4052000    
 C    1.160400     -8.5800000E-02   1.310100    
 C    1.428100      0.4321000      -1.222600    
 C    2.278300       2.599300      0.5998000    
 C    2.803800      -1.307100     -9.9600002E-02
 H   -2.655600      -2.482800     -0.8901000    
 H   -3.765500       1.619300     -0.6897000    
 H   -4.235300     -0.6824000      -1.558100    
 H   -2.679400     -0.1978000      -2.267400    
 H   -2.555800      -1.558300       1.722700    
 H   -4.078400      -2.000400      0.9443000    
 H   -4.808800      0.1463000      0.9199000    
 H   -3.388200      0.6402000       1.849400    
 H  -0.5398000      -1.442600      -1.338600    
 H  -0.5675000      -1.783800      0.3917000    
 H   -1.603200       2.263300      9.2799999E-02
 H   0.2887000       2.468600       1.320600    
 H   0.4402000       2.821400     -0.4108000    
 H    2.748600       2.062100       1.429100    
 H    2.880100       2.438700     -0.2999000    
 H    2.336300       3.667600      0.8360000    
 H    2.449500      -1.561200       1.902900    
 H    2.871000     -0.7470000      -2.069800    


%chk=000019254-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000019254

0 1
O 0.753977 0.173276 2.481733
O 1.287912 1.052980 -2.288976
O 3.668045 -2.307243 -0.145777
N 2.165785 -1.046850 1.126655
N 2.416313 -0.628676 -1.185118
C -2.543430 -1.482804 -0.518772
C -3.246999 0.780756 -0.329019
C -3.271827 -0.389508 -1.345277
C -3.202774 -1.356447 0.897157
C -3.806182 0.091760 0.958934
C -1.027441 -1.147320 -0.475303
C -0.775237 0.328140 -0.156135
C -1.804284 1.213977 -0.092395
C 0.705606 0.736317 0.083839
C 0.889312 2.259735 0.386095
C 1.195016 -0.045222 1.325496
C 1.477453 0.421610 -1.219528
C 2.355407 2.680482 0.621589
C 2.807675 -1.395048 -0.074326
H -2.675313 -2.496160 -0.939505
H -3.859607 1.645430 -0.639564
H -4.313583 -0.688615 -1.568385
H -2.762438 -0.149966 -2.295435
H -2.458338 -1.518739 1.697334
H -3.994778 -2.115856 1.028668
H -4.911773 0.064424 0.917561
H -3.516753 0.626936 1.879872
H -0.557323 -1.407147 -1.448447
H -0.539990 -1.793070 0.285303
H -1.630736 2.265575 0.159486
H 0.288990 2.491131 1.283356
H 0.475008 2.818800 -0.471075
H 2.801914 2.154431 1.485554
H 2.985980 2.495733 -0.267600
H 2.403445 3.762589 0.837088
H 2.460945 -1.575835 1.954429
H 2.896825 -0.848076 -2.064412


