%chk=000151717.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000151717

0 1
 O   -1.492700     -0.3481000      0.9970000    
 O   -2.008200       2.638100      0.2240000    
 O   -1.303200     -0.1365000      -1.993600    
 O   -3.426800      -2.368400      0.8248000    
 O    1.713700       2.353500      0.3544000    
 N   0.6913000      0.2665000      0.4718000    
 N    2.976700      0.4861000     -2.7600000E-02
 N    2.168700      -1.708500      2.9200001E-02
 N    4.407100      -1.293900     -0.4830000    
 C   -1.208100       1.606000     -0.3451000    
 C  -0.6182000      0.7717000      0.7869000    
 C   -2.089600      0.6156000      -1.078200    
 C   -2.582300     -0.2679000      6.1600000E-02
 C   -3.007000      -1.669900     -0.3361000    
 C   0.8542000      -1.187800      0.3905000    
 C    1.781300       1.125500      0.2761000    
 C    3.143100     -0.8821000     -0.1528000    
 H  -0.4664000       2.079200     -0.9937000    
 H  -0.5453000       1.339000       1.721900    
 H   -2.924100       1.072600      -1.619000    
 H   -3.404200      0.2206000      0.5997000    
 H   -2.185100      -2.241400     -0.7776000    
 H   -3.839000      -1.643600      -1.045600    
 H   0.1473000      -1.570600     -0.3506000    
 H   0.5908000      -1.604600       1.369300    
 H   -2.616300       2.246500      0.8728000    
 H  -0.9661000      0.4816000      -2.664200    
 H    3.790900       1.074200     -0.1808000    
 H   -2.679200      -2.378700       1.446800    
 H    4.625500      -2.277600     -0.5979000    
 H    5.160700     -0.6298000     -0.6234000    


%chk=000151717-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000151717

0 1
O -1.449856 -0.315167 0.966380
O -1.606866 2.730968 -0.548532
O -1.837226 -0.681195 -2.048871
O -3.683256 -2.019286 1.517413
O 1.712185 1.428605 2.191111
N 0.823102 0.174744 0.388725
N 3.096084 0.029545 0.925809
N 2.370024 -1.075606 -1.074990
N 4.672959 -0.735224 -0.673148
C -1.124232 1.362840 -0.772376
C -0.500772 0.746707 0.527791
C -2.289557 0.408949 -1.170787
C -2.709768 -0.201031 0.178142
C -3.342173 -1.595053 0.155942
C 1.038326 -1.052965 -0.448308
C 1.838694 0.598924 1.245856
C 3.335596 -0.612995 -0.316719
H -0.374848 1.468313 -1.572054
H -0.422660 1.520969 1.315452
H -3.105386 0.987490 -1.645051
H -3.395045 0.499501 0.704425
H -2.649138 -2.302351 -0.335711
H -4.295950 -1.578692 -0.396704
H 0.256064 -1.072083 -1.223000
H 0.900054 -1.951084 0.190998
H -2.160824 2.763888 0.273608
H -1.639237 -0.313500 -2.946627
H 3.854767 0.258194 1.570128
H -2.852142 -1.978512 2.057489
H 4.862095 -1.264418 -1.522083
H 5.368486 -0.063172 -0.356708


