%chk=000037858.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037858

0 1
 O   0.2035000     -7.4900001E-02  0.4761000    
 O  -0.7372000      -1.675500     -0.9029000    
 O    6.475900      0.4471000     -0.6060000    
 N    3.897000     -6.5899998E-02  0.4840000    
 C   -3.019300      0.4348000     -0.7002000    
 C   -3.383200     -0.9261000     -0.1515000    
 C   -2.140700     -0.2232000      0.3294000    
 C   -3.810100       1.661500     -0.3499000    
 C   -4.503800      -1.099900      0.7805000    
 C  -0.8236000     -0.7496000     -0.1092000    
 C   -5.284200       1.551200     -0.6175000    
 C   -5.677400     -0.4479000      0.7978000    
 C   -6.083700      0.5985000     -0.1131000    
 C    1.515000     -0.5136000      0.1081000    
 C    2.538900      0.3362000      0.8435000    
 C    4.109600      5.1300000E-02 -0.9653000    
 C    4.889100      0.7435000       1.205400    
 C    5.536500     -0.3622000      -1.314200    
 C    6.297800      0.3147000      0.8049000    
 H   -2.681800      0.4615000      -1.731500    
 H   -3.276100      -1.759000     -0.8391000    
 H   -2.154600      0.1960000       1.331600    
 H   -3.415700       2.497000     -0.9418000    
 H   -3.658900       1.950400      0.6980000    
 H   -4.361300      -1.872200       1.534000    
 H   -5.725100       2.307900      -1.261700    
 H   -6.419900     -0.7315000       1.539700    
 H   -7.144300      0.6276000     -0.3494000    
 H    1.578000     -0.3960000     -0.9768000    
 H    1.631400      -1.572100      0.3708000    
 H    2.381500      0.2155000       1.922900    
 H    2.358400       1.397900      0.6272000    
 H    3.931300       1.081300      -1.299800    
 H    3.464900     -0.6199000      -1.538000    
 H    4.771900      0.6136000       2.287400    
 H    4.753000       1.807900      0.9736000    
 H    5.719700      -1.419500      -1.086500    
 H    5.715700     -0.2185000      -2.384700    
 H    7.036400      0.9570000       1.295000    
 H    6.506700     -0.7195000       1.104800    


%chk=000037858-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000037858

0 1
O 0.223607 0.117669 0.242792
O -0.765628 -1.214660 -1.405073
O 6.825732 0.128029 -0.185865
N 3.963443 0.004323 0.319854
C -3.335309 0.383482 -0.886264
C -3.392369 -0.810758 0.044100
C -2.146196 0.137386 0.088825
C -4.238274 1.592271 -0.625255
C -4.349361 -0.920432 1.183252
C -0.878763 -0.399358 -0.453892
C -5.720556 1.262462 -0.660097
C -5.638703 -0.450439 1.205865
C -6.316635 0.367526 0.187982
C 1.559789 -0.383245 -0.186403
C 2.585730 0.507688 0.524609
C 4.497622 0.278984 -1.041425
C 4.910697 0.507666 1.349179
C 5.883314 -0.367923 -1.202136
C 6.288062 -0.147138 1.157328
H -3.123451 0.156378 -1.936696
H -3.138644 -1.773812 -0.422676
H -2.052884 0.813929 0.941743
H -4.001655 2.392489 -1.348994
H -4.000754 1.994044 0.382100
H -4.013808 -1.545747 2.024067
H -6.351748 1.817809 -1.366925
H -6.258589 -0.740829 2.067363
H -7.410955 0.267633 0.147659
H 1.619575 -0.335100 -1.287941
H 1.671455 -1.436093 0.127014
H 2.365846 0.482457 1.607676
H 2.458627 1.565993 0.187583
H 4.581821 1.379940 -1.227311
H 3.814724 -0.143135 -1.801264
H 4.520086 0.251819 2.352262
H 5.026082 1.619808 1.295180
H 5.788057 -1.472010 -1.118530
H 6.332856 -0.106153 -2.174178
H 7.027777 0.267295 1.862137
H 6.200679 -1.244848 1.307958


