%chk=000125522.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125522

0 1
 O   0.5136000      0.5740000     -0.2627000    
 O    3.167600      -1.550200      0.4026000    
 N   -2.997400      3.0500000E-02  0.1385000    
 C  -0.1697000     -0.6958000     -0.2419000    
 C  -0.9059000     -0.8769000       1.098400    
 C   -1.191600     -0.7126000      -1.385300    
 C   0.9291000      -1.734500     -0.4502000    
 C   -2.049600      0.1307000       1.255600    
 C   -2.332900      0.2821000      -1.146600    
 C    1.788900      0.4343000      0.3829000    
 C    2.093500      -1.019400      0.1529000    
 C    2.789600       1.357900     -0.2738000    
 C   -4.112500      0.9578000      0.3282000    
 C    2.477400       2.822000      1.3000000E-03
 H  -0.2209000     -0.7514000       1.944800    
 H   -1.312600      -1.894800       1.163400    
 H   -1.607200      -1.722200      -1.499900    
 H  -0.7028000     -0.4501000      -2.331900    
 H    1.150100      -1.896100      -1.509900    
 H   0.7290000      -2.684600      4.9699999E-02
 H   -1.643000       1.147300       1.337200    
 H   -2.566000     -8.7600000E-02   2.198500    
 H   -3.055400      0.1709000      -1.964500    
 H   -1.947400       1.309100      -1.194000    
 H    1.676200      0.6223000       1.455400    
 H    2.795000       1.201600      -1.359800    
 H    3.800600       1.136400      8.7700002E-02
 H   -3.782500       2.002600      0.3555000    
 H   -4.640800      0.7384000       1.262800    
 H   -4.845600      0.8485000     -0.4787000    
 H    1.496600       3.100800     -0.3966000    
 H    2.484200       3.028500       1.076400    
 H    3.227800       3.463300     -0.4717000    


%chk=000125522-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000125522

0 1
O 0.505555 0.602597 -0.257891
O 3.256154 -1.596543 0.498324
N -3.019199 0.057486 0.136020
C -0.205714 -0.734866 -0.245413
C -0.948513 -0.914960 1.101595
C -1.214746 -0.692078 -1.405259
C 0.944192 -1.751772 -0.425924
C -2.066519 0.130468 1.271107
C -2.333886 0.336679 -1.150657
C 1.829277 0.431928 0.366909
C 2.166334 -1.061969 0.190960
C 2.849578 1.379796 -0.287846
C -4.192201 0.930136 0.338805
C 2.509373 2.863874 -0.042492
H -0.235365 -0.843096 1.946289
H -1.397687 -1.926768 1.124849
H -1.666071 -1.696344 -1.516489
H -0.680232 -0.442974 -2.341062
H 1.150979 -1.924387 -1.501192
H 0.765753 -2.733317 0.043929
H -1.606011 1.147903 1.354358
H -2.621731 -0.066461 2.207196
H -3.081351 0.278772 -1.963832
H -1.894043 1.365446 -1.165428
H 1.773768 0.650338 1.458733
H 2.876869 1.170951 -1.374252
H 3.847469 1.131387 0.121955
H -3.932008 2.017941 0.396947
H -4.706285 0.651867 1.276526
H -4.905284 0.794870 -0.494437
H 1.506250 3.101504 -0.436600
H 2.517307 3.101079 1.038211
H 3.243387 3.523316 -0.539638


