%chk=000013643.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000013643

0 1
 O    2.504300       1.453100       1.023000    
 N    1.899800     -0.3202000      4.6799999E-02
 N    2.261900      0.9513000     -8.1299998E-02
 C   0.8829000     -0.7650000     -0.8720000    
 C  -0.4885000     -0.3792000     -0.4298000    
 C   -1.225700      -1.237800      0.3856000    
 C   -1.033700      0.8400000     -0.8321000    
 C   -2.508400     -0.8773000      0.7986000    
 C   -2.316300       1.200700     -0.4189000    
 C    3.077400      -1.207600     -1.6500000E-02
 C   -3.053600      0.3420000      0.3965000    
 H   0.8890000      -1.861300     -0.9632000    
 H    1.067600     -0.4118000      -1.897800    
 H  -0.8126000      -2.189800      0.7085000    
 H  -0.4730000       1.517500      -1.470400    
 H   -3.082300      -1.545500       1.434000    
 H   -2.741300       2.149600     -0.7327000    
 H    3.833500     -0.9203000      0.7251000    
 H    3.546000      -1.198700      -1.008600    
 H    2.793600      -2.239300      0.2229000    
 H   -4.052200      0.6227000      0.7182000    


%chk=000013643-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000013643

0 1
O 3.750744 1.267048 -0.767888
N 2.061705 -0.230267 -0.622676
N 2.732370 0.747602 -1.353551
C 0.889777 -0.810838 -1.302034
C -0.429808 -0.506660 -0.596842
C -1.307613 -1.553581 -0.225693
C -0.802154 0.834967 -0.324553
C -2.541558 -1.268670 0.404253
C -2.030966 1.121507 0.308431
C 2.459680 -0.647147 0.730241
C -2.905263 0.069985 0.673936
H 1.023362 -1.906627 -1.391286
H 0.902836 -0.380788 -2.320937
H -1.027374 -2.594748 -0.430340
H -0.126360 1.650913 -0.608903
H -3.213351 -2.087367 0.685289
H -2.309846 2.161085 0.513649
H 3.325245 -0.029233 1.023086
H 2.748461 -1.714419 0.737990
H 1.628028 -0.492750 1.439832
H -3.859515 0.293089 1.163896


