%chk=000070381.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070381

0 1
 O   0.3984000      -2.125000      -1.286600    
 N  -0.7580000      -2.833600      0.5926000    
 C   5.0000002E-04 -0.5203000      0.5193000    
 C   -1.187900      0.3495000      0.2831000    
 C    1.346700      0.1620000      0.2288000    
 C  -7.3899999E-02  -1.898600     -0.1742000    
 C   -1.580000       1.273000       1.252000    
 C    2.392700     -6.7800000E-02   1.087300    
 C   -1.907200      0.2392000     -0.9069000    
 C    1.442500      0.9709000     -0.8760000    
 C   -2.691500       2.086300       1.030900    
 C    3.614400      0.5516000      0.8237000    
 C   -3.018700       1.052500      -1.127900    
 C    2.664100       1.590300      -1.139700    
 C   -3.410800       1.976100     -0.1590000    
 C    3.750100       1.380700     -0.2898000    
 C  -0.9815000      -4.186900      0.1422000    
 H  -1.1000000E-03 -0.7387000       1.599700    
 H   -1.028100       1.371200       2.183200    
 H    2.295900     -0.7139000       1.954000    
 H   -1.624100     -0.4589000      -1.688700    
 H   0.6238000       1.138700      -1.565800    
 H   -1.164600      -2.556500       1.481100    
 H   -2.996400       2.806000       1.785100    
 H    4.460400      0.3875000       1.484800    
 H   -3.577300      0.9691000      -2.055700    
 H    2.771500       2.232400      -2.009100    
 H   -4.275600       2.610000     -0.3315000    
 H    4.701800       1.861800     -0.4958000    
 H  -0.1285000      -4.539100     -0.4435000    
 H   -1.881500      -4.199900     -0.4776000    
 H   -1.125400      -4.825400       1.016800    


%chk=000070381-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000070381

0 1
O -0.313181 -1.968751 -1.480742
N -0.484535 -3.004748 0.593274
C -0.154694 -0.557383 0.553655
C -1.320262 0.416571 0.293370
C 1.215896 0.069511 0.240832
C -0.324191 -1.890753 -0.213562
C -1.743768 1.258284 1.354162
C 2.166288 0.229263 1.279745
C -1.958712 0.533411 -0.967771
C 1.551245 0.498175 -1.068656
C -2.779981 2.198914 1.164695
C 3.429509 0.809835 1.022164
C -2.998779 1.471928 -1.155692
C 2.813952 1.073725 -1.327487
C -3.413010 2.309326 -0.094887
C 3.757177 1.234710 -0.284935
C -0.654680 -4.355100 0.043245
H -0.159787 -0.782154 1.638393
H -1.252105 1.184042 2.332738
H 1.918129 -0.098439 2.297788
H -1.648495 -0.121833 -1.788212
H 0.830848 0.363414 -1.880790
H -0.489384 -2.882228 1.606384
H -3.092331 2.841649 1.995691
H 4.152334 0.929150 1.837327
H -3.485973 1.548323 -2.134591
H 3.063237 1.397935 -2.344275
H -4.218525 3.036792 -0.246117
H 4.734941 1.685379 -0.489432
H -0.609622 -4.269831 -1.054196
H -1.632210 -4.784634 0.330126
H 0.151368 -5.030280 0.384556


