%chk=000121973.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121973

0 1
 O   -3.630000      0.5926000      -2.319200    
 O   -3.123400       1.357600       2.222300    
 N   -2.882000      0.8136000     -7.6499999E-02
 N    2.531300     -0.7109000     -0.4305000    
 C   -1.171300     -0.9754000      5.2999999E-02
 C   0.1886000      -1.356700     -3.6200002E-02
 C   -1.522600      0.3686000     -0.1532000    
 C    1.157300     -0.3828000     -0.3288000    
 C  -0.5471000       1.323000     -0.4428000    
 C   0.7902000      0.9480000     -0.5305000    
 C   -2.139900      -1.949300      0.3456000    
 C   0.5399000      -2.700800      0.1700000    
 C   -3.765900      0.8576000      -1.135900    
 C   -3.508500       1.263500       1.068300    
 C   -1.773000      -3.280000      0.5475000    
 C  -0.4356000      -3.655100      0.4599000    
 C    3.702100      2.0300001E-02 -0.1724000    
 C   -5.038700       1.369100     -0.6073000    
 C   -4.883900       1.618800      0.6891000    
 C    4.870700     -0.2459000     -0.8919000    
 C    3.706500       1.019700      0.8051000    
 C    6.033500      0.4810000     -0.6362000    
 C    4.869100       1.746500       1.060800    
 C    6.032700       1.477100      0.3400000    
 H  -0.8199000       2.362300     -0.6085000    
 H    1.519100       1.712100     -0.7861000    
 H   -3.195600      -1.701500      0.4238000    
 H    1.570100      -3.043400      0.1224000    
 H    2.704700      -1.608400     -0.8727000    
 H   -2.531700      -4.023600      0.7738000    
 H  -0.1509000      -4.691000      0.6195000    
 H   -5.928300       1.516900      -1.196300    
 H   -5.624100       2.004000       1.370100    
 H    4.885400      -1.018700      -1.656500    
 H    2.823200       1.235600       1.400400    
 H    6.939600      0.2713000      -1.197200    
 H    4.870500       2.518300       1.824900    
 H    6.938400       2.042100      0.5401000    


%chk=000121973-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000121973

0 1
O -3.488707 0.638427 -2.369550
O -3.199215 1.242556 2.294949
N -2.947361 0.810418 -0.045002
N 2.544845 -0.706637 -0.342421
C -1.203361 -0.971485 0.059000
C 0.197085 -1.340549 0.029071
C -1.562566 0.413882 -0.080238
C 1.200083 -0.313053 -0.199820
C -0.574516 1.383993 -0.253942
C 0.797451 1.029983 -0.322518
C -2.188469 -1.995866 0.241895
C 0.544168 -2.716203 0.234816
C -3.804715 0.901446 -1.186644
C -3.661073 1.200295 1.131712
C -1.818340 -3.331298 0.406789
C -0.437674 -3.694049 0.416769
C 3.720608 0.064792 -0.164822
C -5.138818 1.377951 -0.669527
C -5.055165 1.552523 0.676566
C 4.897828 -0.334135 -0.858108
C 3.787696 1.172427 0.725445
C 6.110093 0.359928 -0.669382
C 5.004101 1.865526 0.896808
C 6.172289 1.471407 0.203245
H -0.865506 2.433347 -0.366995
H 1.538117 1.806659 -0.526352
H -3.246564 -1.715158 0.254610
H 1.597265 -3.013203 0.296685
H 2.697580 -1.649732 -0.701984
H -2.584032 -4.102042 0.544541
H -0.149062 -4.737156 0.583850
H -5.986277 1.535977 -1.337128
H -5.817655 1.888038 1.380042
H 4.855302 -1.184135 -1.551175
H 2.907488 1.466357 1.304178
H 7.005255 0.036700 -1.212369
H 5.040361 2.712999 1.590726
H 7.111960 2.015169 0.344180


