%chk=000013780.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000013780

0 1
 O   -3.251300      0.7363000     -0.6271000    
 N    2.430000      3.7999999E-02 -0.1400000    
 N   -1.955800      0.7099000      -1.128900    
 C    1.030500      0.3379000      0.1607000    
 C   8.8799998E-02 -0.5267000     -0.6811000    
 C    2.724400      -1.365900      0.1447000    
 C    3.316400      0.9120000      0.6276000    
 C   -1.354600     -0.2215000     -0.4084000    
 C    4.158400      -1.711000     -0.2195000    
 C    3.024400       2.375700      0.3440000    
 C   -2.167200     -0.8202000      0.5447000    
 C   -3.364900     -0.1791000      0.3689000    
 C   -4.679000     -0.2854000       1.014400    
 H   0.8151000      0.2014000       1.229300    
 H   0.7868000       1.377000     -8.5400000E-02
 H   0.2063000      -1.594200     -0.4682000    
 H   0.3000000     -0.3895000      -1.749900    
 H    2.533300      -1.623500       1.193900    
 H    2.120800      -2.032500     -0.4764000    
 H    3.244600      0.7248000       1.706500    
 H    4.359500      0.7563000      0.3335000    
 H    4.420500      -1.354700      -1.221700    
 H    4.880400      -1.312800      0.5001000    
 H    4.286200      -2.799600     -0.2172000    
 H    2.939600       2.575000     -0.7299000    
 H    2.119100       2.728600      0.8474000    
 H    3.847800       2.991900      0.7235000    
 H   -1.935900      -1.597700       1.257400    
 H   -4.672200      -1.045600       1.801700    
 H   -4.963600      0.6691000       1.467700    
 H   -5.445500     -0.5615000      0.2838000    


%chk=000013780-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000013780

0 1
O -3.449358 0.775351 -0.648877
N 2.420249 0.000327 0.153456
N -2.078980 0.870222 -1.190987
C 0.978355 0.216502 0.421195
C 0.094992 -0.232348 -0.776031
C 2.846434 -1.399947 0.421701
C 3.294135 1.012489 0.807054
C -1.375969 -0.059178 -0.498511
C 4.079452 -1.824853 -0.398656
C 3.263646 2.378336 0.095187
C -2.198972 -0.755900 0.462473
C -3.468673 -0.217549 0.340597
C -4.782824 -0.468432 1.007706
H 0.646071 -0.308994 1.351691
H 0.802597 1.293433 0.590033
H 0.303570 -1.293687 -1.011143
H 0.378612 0.360858 -1.661671
H 3.041016 -1.563777 1.512855
H 2.004129 -2.065687 0.155000
H 3.031893 1.141352 1.888386
H 4.329957 0.627956 0.781977
H 3.873024 -1.713340 -1.477168
H 4.967082 -1.212292 -0.158407
H 4.336978 -2.880618 -0.191964
H 3.586900 2.265790 -0.954146
H 2.250807 2.820352 0.091411
H 3.938810 3.093596 0.601345
H -1.886268 -1.548691 1.137511
H -4.682285 -1.264810 1.762261
H -5.154532 0.443385 1.509031
H -5.547947 -0.777346 0.272791


