%chk=000128879.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128879

0 1
 O   -3.491700      7.1000000E-03   1.234800    
 O   -1.637100      -2.206500      -1.014600    
 O  -0.1221000      -3.148800      0.3840000    
 O    4.762100       1.104200     -0.2508000    
 N   -1.495200      0.1572000      1.1900000E-02
 N   -2.888200       2.840500     -0.2526000    
 C   -1.407000       1.087600      -1.083300    
 C   -2.862600       1.473800     -0.7586000    
 C  -0.5043000     -0.7561000      0.5452000    
 C   -2.762900      0.4300000      0.3666000    
 C   0.8876000     -0.2646000      0.3349000    
 C  -0.7289000      -2.159900     -9.8999999E-03
 C    1.471200      0.5960000       1.264300    
 C    1.605900     -0.6656000     -0.7916000    
 C    2.773200       1.055900       1.067400    
 C    2.908100     -0.2058000     -0.9886000    
 C    3.491800      0.6550000     -5.9099998E-02
 H   -1.271100      0.5980000      -2.052600    
 H  -0.6427000       1.859900     -0.9524000    
 H   -3.605300       1.241400      -1.525800    
 H  -0.7215000     -0.8480000       1.618100    
 H   -2.761400       3.546000     -0.9773000    
 H   -2.187800       3.042800      0.4602000    
 H   0.9210000      0.9172000       2.144900    
 H    1.174000      -1.319900      -1.543400    
 H    3.216200       1.726700       1.798700    
 H    3.461400     -0.5181000      -1.870100    
 H   -1.747700      -3.115400      -1.366800    
 H    5.004600       1.688700      0.4879000    


%chk=000128879-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128879

0 1
O -2.960946 0.888028 1.802104
O -1.000946 -2.255869 -1.320056
O -0.583412 -3.237489 0.743782
O 4.879800 1.093489 -0.166530
N -1.517690 0.157712 -0.004665
N -2.956505 3.008414 -0.866957
C -1.662381 0.819581 -1.338035
C -2.928267 1.564967 -0.757507
C -0.534420 -0.765585 0.561300
C -2.564032 0.859978 0.616223
C 0.914233 -0.295167 0.375757
C -0.705010 -2.207058 0.053401
C 1.628323 0.223273 1.481961
C 1.552389 -0.337279 -0.892706
C 2.950250 0.694831 1.335375
C 2.869757 0.129962 -1.053244
C 3.569052 0.646602 0.062836
H -1.840283 0.115723 -2.165825
H -0.833134 1.506332 -1.581911
H -3.868214 1.153101 -1.162509
H -0.756813 -0.813143 1.643520
H -3.865068 3.444308 -0.699960
H -2.187678 3.502222 -0.406447
H 1.150103 0.261063 2.467492
H 1.017216 -0.746304 -1.756860
H 3.491569 1.091020 2.204067
H 3.373124 0.100312 -2.023900
H -1.086191 -3.208920 -1.597466
H 5.294773 1.425197 0.668160


