%chk=000053433.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000053433

0 1
 O    1.276300      -1.076600      -1.285200    
 O    3.689800       1.390600      0.7613000    
 O    5.963000       1.103400     -0.6679000    
 N    1.889100     -0.6919000      0.9211000    
 N    5.172900     -3.7000000E-03 -0.3302000    
 C   -1.421700     -0.4656000     -0.8422000    
 C  -0.4163000     -0.3949000      0.3057000    
 C   -2.807900     -8.1699997E-02 -0.3935000    
 C   0.9902000     -0.7615000     -0.1332000    
 C   -3.666500      -1.061700      8.2800001E-02
 C   -3.204600       1.245800     -0.4637000    
 C    3.292700     -0.9922000      0.7637000    
 C   -4.949700     -0.7065000      0.4982000    
 C   -4.487900       1.601000     -4.8300002E-02
 C   -5.360600      0.6249000      0.4327000    
 C    4.041200      0.2704000      0.3986000    
 H   -1.438400      -1.477000      -1.269400    
 H   -1.105900      0.1907000      -1.664000    
 H  -0.7121000      -1.077200       1.112400    
 H  -0.3889000      0.6188000      0.7248000    
 H   -3.355400      -2.101000      0.1396000    
 H   -2.531800       2.013700     -0.8349000    
 H    1.562100     -0.4040000       1.838900    
 H    3.420100      -1.760700     -5.2000000E-03
 H    3.672500      -1.366700       1.718700    
 H   -5.629000      -1.466500      0.8732000    
 H   -4.807600       2.637800     -9.8700002E-02
 H   -6.359800      0.9016000      0.7564000    
 H    5.457500     -0.9070000     -0.6922000    
 H    6.237800      0.8534000      -1.566200    


%chk=000053433-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000053433

0 1
O 1.532345 -1.587183 -0.494698
O 5.180669 0.890351 0.464723
O 4.634924 0.290305 -2.103274
N 2.038657 -0.337670 1.388022
N 3.958727 -0.369314 -1.020538
C -1.041487 -0.134782 -0.651979
C -0.327946 -0.490257 0.683444
C -2.535691 0.069971 -0.451753
C 1.140902 -0.845248 0.470511
C -3.415508 -1.043105 -0.405572
C -3.078197 1.368345 -0.273727
C 3.470541 -0.697790 1.357307
C -4.799264 -0.864702 -0.184563
C -4.462403 1.552417 -0.052036
C -5.327716 0.435344 -0.004896
C 4.266865 0.015396 0.251288
H -0.843931 -0.956187 -1.364022
H -0.581091 0.777790 -1.074622
H -0.825713 -1.375241 1.126597
H -0.440699 0.335648 1.411619
H -3.013673 -2.053369 -0.556399
H -2.413635 2.240640 -0.318490
H 1.713589 0.319901 2.098299
H 3.552793 -1.791732 1.224666
H 3.930783 -0.413795 2.315874
H -5.465214 -1.734740 -0.159012
H -4.865129 2.563444 0.077589
H -6.401352 0.575993 0.162831
H 3.161780 -0.971603 -1.284443
H 5.277177 0.886873 -1.599447


