%chk=000126886.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126886

1 1
 O    2.424700      0.1670000     -0.1318000    
 O    3.392700      -1.885500      0.3009000    
 N   -2.158800      -1.637500      4.6999998E-02
 C   -1.456000     -0.7827000     -0.9977000    
 C   -3.429600     -0.9364000      0.5049000    
 C   -2.514300      -2.987800     -0.5585000    
 C   -1.235300      -1.843300       1.239000    
 C   -1.067800      0.5725000     -0.4841000    
 C   0.1726000      0.7786000      0.1119000    
 C   -1.971300       1.622900     -0.6150000    
 C    1.154400     -0.3369000      0.2606000    
 C   0.5128000       2.047300      0.5816000    
 C   -1.630900       2.891400     -0.1452000    
 C  -0.3890000       3.103600      0.4531000    
 C    3.463700     -0.7194000     -6.2799998E-02
 C    4.731800     -5.3700000E-02 -0.5040000    
 H   -2.165600     -0.6648000      -1.829400    
 H  -0.6323000      -1.358300      -1.428300    
 H   -4.027800     -0.6759000     -0.3731000    
 H   -3.989700      -1.635100       1.135300    
 H   -3.177300     -5.6699999E-02   1.101900    
 H   -3.012800      -3.592200      0.2053000    
 H   -3.182500      -2.820500      -1.408400    
 H   -1.591300      -3.475200     -0.8862000    
 H  -0.3353000      -2.365400      0.9107000    
 H   -1.051700     -0.8979000       1.751000    
 H   -1.763000      -2.497800       1.942900    
 H   -2.938600       1.480100      -1.088500    
 H    1.211600     -0.6351000       1.313600    
 H   0.9652000      -1.207700     -0.3628000    
 H    1.470400       2.232200       1.061200    
 H   -2.332100       3.714500     -0.2470000    
 H  -0.1251000       4.091000      0.8207000    
 H    4.953200      0.7924000      0.1514000    
 H    4.634800      0.2773000      -1.541000    
 H    5.557600     -0.7682000     -0.4416000    


%chk=000126886-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000126886

1 1
O 2.608077 0.290401 -0.137314
O 3.445937 -1.866201 0.109456
N -2.296225 -1.698266 0.108405
C -1.572029 -0.780325 -0.961656
C -3.569458 -1.027154 0.612608
C -2.656582 -3.014500 -0.576998
C -1.379209 -1.980444 1.292926
C -1.101746 0.566079 -0.460813
C 0.231806 0.803703 0.003362
C -2.009491 1.660077 -0.545394
C 1.271283 -0.299011 0.097447
C 0.595205 2.115631 0.398469
C -1.636937 2.956518 -0.142631
C -0.326228 3.181154 0.337301
C 3.667746 -0.654399 -0.096418
C 4.993376 0.020539 -0.329336
H -2.324829 -0.662721 -1.759810
H -0.752477 -1.409025 -1.347064
H -4.244849 -0.847135 -0.237737
H -4.056676 -1.694413 1.340409
H -3.308861 -0.072462 1.090534
H -3.180650 -3.665039 0.140004
H -3.311194 -2.807374 -1.437413
H -1.734997 -3.508514 -0.920828
H -0.472929 -2.492314 0.936299
H -1.114730 -1.027983 1.773914
H -1.912780 -2.626623 2.007105
H -3.011673 1.497460 -0.961442
H 1.285448 -0.771541 1.100163
H 1.117501 -1.110239 -0.638390
H 1.622390 2.295283 0.726631
H -2.348885 3.783744 -0.220963
H -0.017875 4.185849 0.643425
H 5.200372 0.744804 0.477979
H 4.976993 0.584346 -1.277598
H 5.792576 -0.733104 -0.357032


