%chk=000014198.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014198

0 1
 O    1.266300       1.509900       1.875200    
 O   0.2477000      -2.001000     -0.3751000    
 O    4.993600     -0.3237000     -0.7931000    
 O   -1.950600       2.359900      -1.847500    
 O   -2.960800      -1.222700       1.995100    
 O   0.6104000      -4.269900     -0.2307000    
 N    3.167000       1.021300     -0.2443000    
 N   0.1965000       1.227300     -0.2475000    
 N   -5.100900     -0.3322000      0.5898000    
 N   0.5505000      -3.203600      -2.267000    
 C    2.185800      6.8800002E-02  0.2042000    
 C    2.213000      0.5364000      -1.190000    
 C   0.9348000      0.5674000      0.8578000    
 C   0.9819000       1.344800      -1.473300    
 C  -0.1046000     -0.4617000       1.417400    
 C   -1.145800      0.9383000     -0.1560000    
 C   -1.392200      2.9999999E-02  0.7859000    
 C    4.513800      0.7071000     -0.3278000    
 C   0.1548000      -1.917200       1.034700    
 C   -2.200300       1.525100     -0.9850000    
 C   -2.751000     -0.4178000       1.093100    
 C    1.831800      0.8695000       3.008700    
 C    5.381500       1.806000      0.2226000    
 C   -3.599100       1.054400     -0.7102000    
 C   -3.864500      0.1518000      0.2596000    
 C   -4.640200       1.679800      -1.600300    
 C   0.4808000      -3.248100     -0.8966000    
 H    2.585500     -0.8834000      0.5069000    
 H    2.576100     -8.9100003E-02  -1.989000    
 H    1.225600       2.392000      -1.677600    
 H   0.4479000      0.9242000      -2.332000    
 H  -0.2303000     -0.4046000       2.501600    
 H  -0.6631000      -2.557900       1.385600    
 H    1.083600      -2.270100       1.497800    
 H    2.522400       1.579400       3.474800    
 H    2.397800     -3.7000000E-02   2.774400    
 H    1.058200      0.6540000       3.751000    
 H    6.028400       1.393700       1.001800    
 H    4.784800       2.614200      0.6555000    
 H    5.994500       2.214700     -0.5851000    
 H   -4.421000       1.459200      -2.650700    
 H   -4.645900       2.767300      -1.468800    
 H   -5.654700       1.325600      -1.402900    
 H   -5.929700     -2.2900000E-02  0.1011000    
 H   -5.189200      -1.009900       1.337100    
 H   0.4380000      -2.331500      -2.772900    
 H   0.7181000      -4.040400      -2.815300    


%chk=000014198-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000014198

0 1
O 1.153892 1.691872 1.669269
O -0.052964 -2.304966 -0.219391
O 5.071752 1.188719 -1.665633
O -2.010416 2.187593 -2.158496
O -3.118415 -1.198819 2.077895
O 2.139528 -3.193713 -0.228463
N 3.124852 1.077619 -0.393329
N 0.084690 1.215582 -0.365741
N -5.155611 -0.176102 0.693528
N 0.689033 -3.400715 -2.061587
C 2.121306 0.042703 0.008658
C 2.128468 0.666541 -1.403543
C 0.867103 0.583216 0.738333
C 0.899484 1.578934 -1.548561
C -0.155618 -0.418567 1.407381
C -1.246499 0.924214 -0.244241
C -1.480091 0.051036 0.817048
C 4.523437 0.952458 -0.553579
C 0.069060 -1.930850 1.214222
C -2.326858 1.451857 -1.152265
C -2.800875 -0.363438 1.146843
C 2.067655 1.349575 2.762897
C 5.301102 0.636708 0.716277
C -3.688833 1.073802 -0.811814
C -3.916767 0.232980 0.283810
C -4.827258 1.601886 -1.658630
C 1.029584 -2.998263 -0.792773
H 2.464109 -0.984513 0.171958
H 2.497605 0.109759 -2.270592
H 1.185936 2.643887 -1.520987
H 0.325106 1.393139 -2.468690
H -0.132864 -0.250116 2.500997
H -0.735805 -2.473239 1.737826
H 1.055926 -2.261784 1.584908
H 2.135570 2.261271 3.375810
H 3.072423 1.085226 2.385631
H 1.680987 0.520848 3.391969
H 6.332921 0.368661 0.444727
H 4.843261 -0.191514 1.285288
H 5.329927 1.527985 1.369652
H -4.416798 2.216274 -2.476054
H -5.519401 2.239489 -1.072588
H -5.423160 0.784876 -2.113320
H -6.010719 0.119935 0.230512
H -5.175902 -0.818238 1.493787
H -0.246232 -3.226154 -2.422538
H 1.373572 -3.910255 -2.613413


