%chk=000070374.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070374

0 1
 O   -4.719000      0.9290000      0.6579000    
 O    1.154000      -2.190500      0.6132000    
 N   -2.384300     -0.2417000     -0.4736000    
 N  -3.7400000E-02 -0.5224000     -0.4658000    
 N    2.187800      0.9305000     -0.5815000    
 N    4.624000      2.8200001E-02  0.4757000    
 C   -2.316700      0.5972000      0.7311000    
 C   -3.692500     -0.9067000     -0.5512000    
 C   -3.462700       1.604800      0.7259000    
 C   -4.805700      0.1369000     -0.5271000    
 C   -1.301900      -1.223400     -0.4838000    
 C    1.102000      -1.079200      9.2600003E-02
 C    2.332900     -0.2511000      1.7400000E-02
 C    3.500600     -0.7136000      0.5383000    
 C    3.311200       1.672600     -0.6439000    
 C    4.507800       1.229400     -0.1249000    
 H   -1.380500       1.163600      0.7824000    
 H   -2.385500     -2.6500000E-02   1.632200    
 H   -3.819800      -1.595400      0.2942000    
 H   -3.769000      -1.487700      -1.477400    
 H   -3.449900       2.188800       1.651700    
 H   -3.379500       2.308500     -0.1113000    
 H   -4.767800      0.7898000      -1.407700    
 H   -5.781500     -0.3593000     -0.5249000    
 H   -1.358600      -1.916600      0.3640000    
 H   -1.319900      -1.808400      -1.409900    
 H   1.9300001E-02  0.3796000     -0.9295000    
 H    3.608900      -1.675400       1.023400    
 H    3.218600       2.637800      -1.126300    
 H    5.410000       1.826200     -0.1755000    


%chk=000070374-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000070374

0 1
O -4.783190 0.973993 0.632066
O 1.038942 -1.935370 1.156450
N -2.369970 -0.300424 -0.334980
N 0.004851 -0.673872 -0.537330
N 2.239473 0.808005 -0.907507
N 4.609007 0.325457 0.610634
C -2.425502 0.300596 1.023998
C -3.709282 -0.786368 -0.753919
C -3.448377 1.447159 1.038645
C -4.711059 0.380513 -0.712877
C -1.308386 -1.315687 -0.479869
C 1.058231 -1.014226 0.279346
C 2.296194 -0.175477 0.045596
C 3.474122 -0.412660 0.797878
C 3.368926 1.545624 -1.095744
C 4.544395 1.304745 -0.342106
H -1.424670 0.689572 1.286619
H -2.712430 -0.460683 1.790367
H -4.080866 -1.606650 -0.091154
H -3.646066 -1.180717 -1.786461
H -3.577040 1.852690 2.055494
H -3.112821 2.254528 0.352410
H -4.405327 1.155210 -1.448972
H -5.733497 0.035056 -0.938041
H -1.265957 -2.050686 0.355474
H -1.502945 -1.869140 -1.419617
H 0.155324 0.104647 -1.190325
H 3.493802 -1.203338 1.552140
H 3.328886 2.333039 -1.854893
H 5.450132 1.899462 -0.497624


