%chk=000096943.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096943

0 1
 O   -3.038300     -0.6876000     -1.9800000E-02
 N    1.400900       1.496800     -8.8000000E-03
 C   -3.790300      0.5457000      1.0900000E-02
 C   0.4462000      0.5034000     -8.7000001E-03
 C  -0.9577000      0.5658000     -1.3500000E-02
 C    1.134100     -0.7139000     -2.4000001E-03
 C   -1.671700     -0.6347000     -1.2100000E-02
 C    2.534900     -0.4207000      2.0000001E-03
 C   -1.007100      -1.859100     -7.4999998E-03
 C   -2.979000       1.821600     -9.4999997E-03
 C    2.668700      0.9664000     -2.2000000E-03
 C   -1.644100       1.841000     -2.1800000E-02
 C   0.3906000      -1.912900     -1.8000000E-03
 C   -4.635200      0.5052000       1.289800    
 C   -4.710200      0.5151000      -1.215700    
 C    3.703400      -1.211300      9.3000000E-03
 C   -1.768800      -3.146400     -8.2000000E-03
 C    3.912900       1.607500      3.0000001E-04
 C    4.954900     -0.5854000      1.2100000E-02
 C    5.055800      0.8036000      7.4999998E-03
 H   -3.515300       2.767500     -1.1300000E-02
 H   -1.095600       2.774100     -3.4699999E-02
 H   0.9101000      -2.867600      2.4999999E-03
 H    1.199900       2.486800     -1.2800000E-02
 H   -5.302400       1.370500       1.369400    
 H   -5.245600     -0.4048000       1.325800    
 H   -3.994800      0.4813000       2.179800    
 H   -5.381500       1.380400      -1.248300    
 H   -4.124000      0.4992000      -2.142500    
 H   -5.321500     -0.3951000      -1.222900    
 H    3.641000      -2.295800      1.2900000E-02
 H   -2.394500      -3.217800     -0.9042000    
 H   -1.104000      -4.016800     -2.6000000E-03
 H   -2.403700      -3.213500      0.8815000    
 H    3.991800       2.689600     -3.1999999E-03
 H    5.857000      -1.191300      1.7700000E-02
 H    6.037300       1.270600      9.7000003E-03


%chk=000096943-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000096943

0 1
O -3.060653 -0.641349 -0.479060
N 1.400364 1.555724 -0.054983
C -3.841853 0.592835 -0.073740
C 0.448824 0.524894 -0.128287
C -0.957861 0.609589 -0.273622
C 1.131573 -0.731937 -0.034366
C -1.666549 -0.626640 -0.294896
C 2.553757 -0.435530 0.101356
C -1.023593 -1.899211 -0.226309
C -3.071207 1.847913 -0.461893
C 2.685565 0.997533 0.084372
C -1.707983 1.845548 -0.498342
C 0.382043 -1.931111 -0.092958
C -4.054477 0.524305 1.457346
C -5.165134 0.460276 -0.843473
C 3.715330 -1.231970 0.233748
C -1.850386 -3.167013 -0.298260
C 3.936244 1.637728 0.196132
C 4.972848 -0.599611 0.346237
C 5.080550 0.818907 0.327875
H -3.653539 2.750249 -0.680454
H -1.163485 2.764990 -0.748200
H 0.887186 -2.901696 -0.028443
H 1.194392 2.551265 -0.065641
H -4.643211 1.393823 1.802709
H -4.596534 -0.400085 1.725955
H -3.084385 0.535235 1.984034
H -5.847101 1.287769 -0.576321
H -4.984224 0.485432 -1.931158
H -5.656368 -0.495207 -0.591880
H 3.643574 -2.325286 0.249085
H -2.384308 -3.244510 -1.263532
H -1.212294 -4.059753 -0.181849
H -2.627279 -3.185127 0.488087
H 4.026922 2.729592 0.181630
H 5.879467 -1.205847 0.448793
H 6.067988 1.285676 0.417005


