%chk=000039491.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039491

0 1
 O    3.277300     -0.1607000       1.075700    
 N   0.9837000      0.5303000     -0.4678000    
 N    1.462400       1.833500     -0.3362000    
 C    1.928600     -0.4939000     -0.8837000    
 C  -0.3667000      0.2160000     -0.2092000    
 C    2.562600      -1.142100      0.3353000    
 C  -0.8171000      -1.096500     -0.3510000    
 C   -1.252100       1.218100      0.1881000    
 C   -2.152800      -1.407000     -9.5899999E-02
 C   -2.587800      0.9074000      0.4434000    
 C   -3.038000     -0.4051000      0.3013000    
 H    2.727100     -1.3400000E-02  -1.466800    
 H    1.498800      -1.233700      -1.566200    
 H    3.274800      -1.912900      2.5800001E-02
 H    1.823900      -1.605800      0.9963000    
 H  -0.1769000      -1.922500     -0.6393000    
 H  -0.9492000       2.253600      0.3116000    
 H   -2.503500      -2.429500     -0.2023000    
 H   -3.277800       1.687000      0.7528000    
 H   0.9545000       2.446800     -0.9715000    
 H    1.291400       2.167000      0.6109000    
 H   -4.077800     -0.6470000      0.5010000    
 H    2.634500      0.5072000       1.368900    


%chk=000039491-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000039491

0 1
O 3.905503 0.395927 -0.370467
N 0.883504 0.139755 0.209407
N 1.465409 1.451728 0.283406
C 1.790172 -0.924318 -0.285469
C -0.522614 0.036360 0.062090
C 3.233577 -0.755639 0.225594
C -1.131791 -1.153970 -0.440745
C -1.372027 1.124075 0.429712
C -2.534094 -1.247830 -0.549593
C -2.772845 1.014111 0.309312
C -3.370660 -0.170206 -0.178032
H 1.802732 -0.956907 -1.397723
H 1.400434 -1.892187 0.082266
H 3.821306 -1.643050 -0.066881
H 3.222762 -0.693512 1.336847
H -0.519144 -2.000827 -0.760503
H -0.945261 2.049765 0.829487
H -2.974515 -2.172629 -0.940052
H -3.400349 1.863262 0.604297
H 1.060359 2.094599 -0.419015
H 1.383482 1.842177 1.232546
H -4.458519 -0.250011 -0.269775
H 3.252479 1.146128 -0.205507


