%chk=000133171.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133171

0 1
 O   0.4111000     -0.4076000       2.389700    
 O   0.4315000     -0.3919000      -2.403900    
 O   -1.522700      -3.785500     -2.6500000E-02
 N  -0.5776000      -2.059700       1.154700    
 N  -0.5701000      -2.050800      -1.188500    
 N   -5.432900       2.496500      3.8000001E-03
 C   0.3117000     -6.4300001E-02 -6.5000001E-03
 C  -0.6528000       1.111000     -6.3999998E-03
 C   -2.107200      0.6419000      2.4700001E-02
 C    1.718500      0.4648000      1.1000000E-03
 C   7.3299997E-02 -0.8465000       1.288300    
 C   8.3700001E-02 -0.8376000      -1.308400    
 C   -3.075400       1.826400     -9.1000004E-03
 C    2.784700     -0.4224000      7.7200003E-02
 C    1.936400       1.835000     -6.7699999E-02
 C   -4.527100       1.355100      5.7900000E-02
 C  -0.9365000      -2.701500     -2.0500001E-02
 C    4.090400      6.8599999E-02  8.4700003E-02
 C    3.242000       2.326100     -6.0400002E-02
 C    4.318900       1.442800      1.5799999E-02
 H  -0.5486000       1.725300     -0.9121000    
 H  -0.5137000       1.756200      0.8728000    
 H   -2.312900      6.5200001E-02  0.9329000    
 H   -2.333700     -6.9999998E-04 -0.8325000    
 H   -2.914600       2.404200     -0.9281000    
 H   -2.864400       2.496100      0.8343000    
 H  -0.7915000      -2.552000       2.017700    
 H  -0.7781000      -2.536700      -2.056500    
 H    2.624200      -1.495900      0.1283000    
 H    1.167700       2.594400     -0.1333000    
 H   -4.702400      0.7962000      0.9837000    
 H   -4.745800      0.6869000     -0.7819000    
 H    4.929000     -0.6191000      0.1432000    
 H    3.421900       3.395900     -0.1151000    
 H    5.335400       1.825100      2.1100000E-02
 H   -5.257800       3.111800      0.7973000    
 H   -6.393500       2.170400      0.1018000    


%chk=000133171-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000133171

0 1
O -0.133772 -0.248435 2.439936
O -0.146732 -0.296849 -2.421885
O -0.176598 -4.229353 0.048856
N -0.085143 -2.202553 1.210203
N -0.090805 -2.226397 -1.153918
N -5.627133 2.767664 0.085657
C 0.164352 -0.000051 0.005329
C -0.848404 1.184622 -0.002183
C -2.329769 0.747026 0.004611
C 1.655388 0.463151 -0.004784
C -0.037432 -0.797664 1.315216
C -0.044633 -0.823565 -1.287235
C -3.278518 1.966181 0.030600
C 2.686688 -0.512758 0.013093
C 2.011824 1.831901 -0.033362
C -4.768455 1.567528 0.030002
C -0.115544 -2.975071 0.035660
C 4.043669 -0.128874 0.003106
C 3.371666 2.216282 -0.043410
C 4.392443 1.240606 -0.025259
H -0.653628 1.790278 -0.905402
H -0.647388 1.803170 0.891238
H -2.534827 0.110631 0.889692
H -2.549096 0.139056 -0.896598
H -3.092473 2.618335 -0.844049
H -3.063963 2.574101 0.935214
H -0.150088 -2.729907 2.087552
H -0.159588 -2.770989 -2.020376
H 2.441454 -1.581338 0.035382
H 1.241026 2.606322 -0.048361
H -4.944513 0.843370 0.865069
H -4.995990 1.029089 -0.910488
H 4.825378 -0.896147 0.017298
H 3.631078 3.280448 -0.065925
H 5.445416 1.542438 -0.033336
H -5.496993 3.328761 0.933921
H -6.617793 2.592693 -0.107462


