%chk=000061807.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000061807

0 1
 O    5.767000      0.9427000     -0.7947000    
 O   -5.893700       1.077000     -0.2010000    
 N    3.475400      0.6888000     -0.3435000    
 N   -3.548700       1.153300     -8.4799998E-02
 C  -0.5227000      -1.252600     -0.1383000    
 C    1.008600     -0.9696000     -0.2178000    
 C    1.654800     -0.2649000       1.000900    
 C   -1.383200      4.2800002E-02 -9.5799997E-02
 C  -0.8690000      -2.089600       1.108300    
 C  -0.9100000      -2.090500      -1.378100    
 C    3.178000     -0.1368000      0.8314000    
 C    1.039100       1.132200       1.174400    
 C   -2.896500     -0.1588000     -0.1515000    
 C    4.620200      0.8139000     -0.5665000    
 C   -4.719400       1.112200     -0.1430000    
 H    1.202800     -0.3865000      -1.128200    
 H    1.531000      -1.926200     -0.3583000    
 H    1.476800     -0.8515000       1.909400    
 H   -1.239800      0.5799000      0.8361000    
 H   -1.084500      0.7089000     -0.9153000    
 H  -0.1922000      -2.947500       1.197300    
 H   -1.885700      -2.494300       1.070300    
 H  -0.7803000      -1.502300       2.028400    
 H   -1.939300      -2.459800      -1.330200    
 H  -0.8014000      -1.502900      -2.296500    
 H  -0.2660000      -2.973000      -1.471100    
 H    3.610100      0.3108000       1.737100    
 H    3.612800      -1.139800      0.7201000    
 H   0.7375000       1.599900      0.2336000    
 H   0.2242000       1.115000       1.901500    
 H    1.770500       1.813300       1.629200    
 H   -3.234300     -0.7813000      0.6855000    
 H   -3.177900     -0.6569000      -1.087100    


%chk=000061807-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000061807

0 1
O 4.975836 2.033330 -1.637604
O -5.667190 2.313930 -0.661894
N 3.489949 0.703219 -0.239367
N -3.668478 0.943814 -0.418719
C -0.543244 -1.336170 -0.098436
C 0.974225 -0.936985 -0.173731
C 1.692328 -0.385059 1.091606
C -1.430764 -0.064843 -0.302226
C -0.859520 -2.050228 1.243196
C -0.800806 -2.333220 -1.267105
C 3.213598 -0.270579 0.801201
C 1.157148 0.960164 1.633837
C -2.955173 -0.300087 -0.198976
C 4.287564 1.338163 -0.904349
C -4.705870 1.569221 -0.530199
H 1.108066 -0.206923 -0.998005
H 1.532537 -1.847821 -0.478382
H 1.612177 -1.142854 1.898913
H -1.163963 0.712515 0.433485
H -1.214962 0.362314 -1.301296
H -0.141800 -2.873192 1.421344
H -1.870238 -2.498386 1.234052
H -0.804878 -1.359804 2.104945
H -1.858399 -2.651438 -1.317732
H -0.534888 -1.879258 -2.240492
H -0.189092 -3.246038 -1.140813
H 3.743465 0.025834 1.728994
H 3.607897 -1.258549 0.487334
H 1.138903 1.728335 0.840056
H 0.138506 0.861184 2.045071
H 1.804306 1.334347 2.449801
H -3.215267 -0.692631 0.803228
H -3.287774 -1.046403 -0.945937


