%chk=000149751.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149751

0 1
 O   -2.122700       1.210900      0.3600000    
 O   -1.722900       2.017300      -1.763800    
 O   -1.167800      -1.127100       1.708500    
 O   -2.175900      -3.021500      0.9617000    
 O    1.797200      -2.358400     -0.3667000    
 N    3.003300     -0.6335000     -0.5049000    
 N   -2.714100      -1.918800      -1.453700    
 N    2.357300      -1.470400      0.2872000    
 C    1.384900       1.812800      0.1449000    
 C    2.546300       1.284500      0.9933000    
 C   0.3643000       2.560700       1.009600    
 C    3.586200      0.5165000      0.1756000    
 C  -0.7903000       3.132200      0.1869000    
 C   -1.578500       2.072100     -0.5501000    
 C   -2.928000      0.1626000     -0.1888000    
 C   -2.049600      -1.050100     -0.4836000    
 C    4.034900      -1.324700      -1.291500    
 C   -1.824400      -1.865200      0.7755000    
 H   0.8849000      0.9856000     -0.3692000    
 H    1.774300       2.485500     -0.6289000    
 H    2.160700      0.6683000       1.815300    
 H    3.050000       2.135800       1.469500    
 H   0.8633000       3.385700       1.532200    
 H  -2.4499999E-02   1.884800       1.780700    
 H    4.401900      0.2098000      0.8450000    
 H    4.019100       1.204900     -0.5619000    
 H   -1.482200       3.689000      0.8288000    
 H  -0.4035000       3.841100     -0.5545000    
 H   -3.698200     -7.5599998E-02  0.5546000    
 H   -3.458700      0.5192000      -1.080700    
 H   -1.069200     -0.7612000     -0.8784000    
 H    4.799500      -1.790000     -0.6565000    
 H    4.539600     -0.6179000      -1.961700    
 H    3.611400      -2.096900      -1.945800    
 H   -2.871500      -1.406100      -2.320700    
 H   -2.099600      -2.696200      -1.693800    
 H   -1.013100      -1.634400       2.533700    


%chk=000149751-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000149751

0 1
O -2.350979 1.331049 0.072040
O -1.354114 2.256016 -1.832578
O -0.912079 -0.946430 2.110700
O -2.912897 -2.030725 1.662080
O 1.374531 -2.152506 -1.408359
N 2.956139 -0.708644 -0.776450
N -1.758591 -2.192895 -1.090016
N 1.665173 -1.125539 -0.662143
C 1.338267 1.945891 0.219296
C 2.340849 1.046178 0.977841
C 0.233465 2.491892 1.155081
C 3.427863 0.406521 0.089840
C -0.916116 3.226803 0.398983
C -1.555447 2.275919 -0.597083
C -2.668371 0.078137 -0.675070
C -1.665743 -1.015306 -0.223828
C 3.892070 -1.390268 -1.693863
C -1.925445 -1.383480 1.243160
H 0.877447 1.360584 -0.596691
H 1.873607 2.789373 -0.263501
H 1.787523 0.253960 1.515129
H 2.870665 1.648704 1.743285
H 0.673689 3.195439 1.889353
H -0.206351 1.652085 1.724785
H 4.242261 0.001843 0.724873
H 3.878417 1.174276 -0.571636
H -1.671500 3.568927 1.128110
H -0.527451 4.097560 -0.156272
H -3.709008 -0.176122 -0.417314
H -2.552276 0.241083 -1.758363
H -0.647114 -0.607148 -0.305436
H 4.059054 -2.434164 -1.371805
H 4.844852 -0.839943 -1.699942
H 3.462092 -1.423778 -2.709958
H -0.845674 -2.592895 -1.330684
H -2.491866 -2.862413 -0.845295
H -1.142539 -1.228682 3.039534


