%chk=000135704.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000135704

0 1
 O   -3.109300     -0.1993000     -0.8826000    
 O   -2.536200      8.2000000E-03   1.342300    
 O    1.917400      -2.090400      0.2603000    
 O    1.398300       2.475800     -1.9300001E-02
 N    1.563200      0.2032000      0.1572000    
 N    2.161200       1.525000     -0.2227000    
 N    3.598500     -0.7938000     -0.5507000    
 C   0.2294000      0.1641000      0.6947000    
 C  -0.8270000      9.3000000E-03 -0.3921000    
 C   -2.235900     -5.2299999E-02  0.1580000    
 C    2.331300     -0.9630000     -2.5400000E-02
 C   -4.491000     -0.2869000     -0.5197000    
 H   3.8199998E-02   1.048800       1.313500    
 H   0.1582000     -0.6920000       1.377800    
 H  -0.6425000     -0.9114000     -0.9580000    
 H  -0.7717000      0.8562000      -1.085900    
 H   -4.660600      -1.160700      0.1167000    
 H   -5.076500     -0.4011000      -1.435800    
 H   -4.808100      0.6291000     -1.2200000E-02
 H    3.988900      0.1066000     -0.8033000    
 H    4.199500      -1.596800     -0.7056000    


%chk=000135704-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000135704

0 1
O -3.154922 -0.203148 -0.904767
O -2.538712 -0.007496 1.334461
O 1.892087 -2.107034 0.230058
O 1.463555 2.465844 -0.062455
N 1.596441 0.223554 0.156777
N 2.202091 1.432784 -0.203651
N 3.655425 -0.748727 -0.508314
C 0.221262 0.138546 0.689958
C -0.815225 -0.016357 -0.442999
C -2.224316 -0.071405 0.124391
C 2.389030 -0.981161 -0.035028
C -4.577184 -0.268356 -0.481961
H 0.029761 1.062458 1.260629
H 0.178445 -0.725682 1.369278
H -0.628154 -0.942506 -1.016367
H -0.755648 0.825804 -1.156434
H -4.738998 -1.139271 0.174834
H -5.142023 -0.366261 -1.419196
H -4.855946 0.651717 0.058296
H 3.967292 0.205449 -0.693749
H 4.261039 -1.550151 -0.666561


