%chk=000139972.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000139972

0 1
 O   0.5516000      1.0000000E-03   2.218600    
 O   0.5510000     -5.0000002E-04  -2.218700    
 N    1.364900      9.4999997E-03 -1.9999999E-04
 C  -0.6953000      1.7500000E-02  1.9999999E-04
 C   0.4429000     -1.3000000E-03   1.012700    
 C   0.4426000     -1.8000000E-03  -1.012800    
 C   -1.509300      -1.302700      3.0000001E-04
 C   -1.539700       1.252900     -1.9999999E-04
 C    2.739800      2.6799999E-02 -3.0000001E-04
 C   -1.875300      -1.896600      -1.207600    
 C   -1.964200       1.874000       1.207700    
 C   -1.875700      -1.896200       1.208500    
 C   -1.964200       1.873500      -1.208300    
 C    3.457400      3.6600001E-02   1.207900    
 C    3.457700      3.4200002E-02  -1.208200    
 C   -2.607700      -3.083700      -1.207500    
 C   -2.751700       3.025400       1.207500    
 C   -2.608000      -3.083300       1.208400    
 C   -2.751600       3.024900      -1.208400    
 C   -2.974000      -3.677000      3.9999999E-04
 C   -3.145300       3.600800     -3.9999999E-04
 C    4.852100      5.3800002E-02   1.208100    
 C    4.852500      5.1199999E-02  -1.207900    
 C    5.549600      6.1000001E-02  3.0000001E-04
 H   -1.618100      -1.446200      -2.161300    
 H   -1.684800       1.442900       2.166200    
 H   -1.618800      -1.445400       2.162000    
 H   -1.684900       1.442100      -2.166800    
 H    2.957600      3.1500001E-02   2.171100    
 H    2.958100      2.7000001E-02  -2.171500    
 H   -2.896600      -3.543900      -2.147900    
 H   -3.061000       3.472200       2.147900    
 H   -2.897300      -3.543300       2.148800    
 H   -3.060900       3.471500      -2.148800    
 H   -3.546000      -4.600300      5.0000002E-04
 H   -3.759600       4.496400     -6.0000003E-04
 H    5.395600      6.1400000E-02   2.148400    
 H    5.396300      5.6800000E-02  -2.148000    
 H    6.635600      7.4299999E-02  3.9999999E-04


%chk=000139972-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000139972

0 1
O 0.587191 0.011507 2.279688
O 0.587320 0.010555 -2.279667
N 1.464396 0.023889 0.000031
C -0.694913 -0.007385 -0.000021
C 0.473423 0.009626 1.043193
C 0.473480 0.009179 -1.043178
C -1.527070 -1.295837 0.000248
C -1.564773 1.255648 -0.000306
C 2.887898 0.042899 0.000066
C -1.932240 -1.882243 -1.224928
C -1.987940 1.829223 1.224880
C -1.932357 -1.881625 1.225680
C -1.988019 1.828607 -1.225753
C 3.587709 0.052694 1.234387
C 3.587779 0.051788 -1.234223
C -2.738811 -3.041879 -1.221809
C -2.830306 2.963096 1.221755
C -2.738924 -3.041265 1.223069
C -2.830388 2.962479 -1.223143
C -3.146273 -3.623827 0.000758
C -3.255833 3.531948 -0.000823
C 4.997775 0.071322 1.223072
C 4.997844 0.070432 -1.222842
C 5.708634 0.080215 0.000131
H -1.614034 -1.438640 -2.174752
H -1.656055 1.395666 2.174683
H -1.614232 -1.437551 2.175312
H -1.656206 1.394567 -2.175359
H 3.032810 0.045810 2.176738
H 3.032933 0.044216 -2.176600
H -3.047065 -3.490531 -2.172704
H -3.152397 3.401976 2.172628
H -3.047263 -3.489440 2.174162
H -3.152545 3.400877 -2.174216
H -3.772820 -4.522662 0.000954
H -3.910097 4.410815 -0.001023
H 5.541428 0.078907 2.173902
H 5.541551 0.077320 -2.173647
H 6.803693 0.094624 0.000157


