%chk=000095319.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095319

0 1
 O   -1.632000      0.9128000       1.724500    
 O   -2.493800       2.205900      6.4000003E-02
 N    1.048300      -2.305800      0.5398000    
 N   -4.194000      0.1027000     -0.5405000    
 C  -0.6145000      -1.190300     -0.4182000    
 C   -1.944700     -0.8513000     -0.9637000    
 C   0.5328000     -0.3487000     -0.3989000    
 C    1.561800      -1.072500      0.2072000    
 C   -2.898800     -0.2037000      6.9899999E-02
 C  -0.2663000      -2.386400      0.1658000    
 C   0.7952000      0.9634000     -0.8404000    
 C    2.845400     -0.5476000      0.3947000    
 C    3.082400      0.7559000     -5.1199999E-02
 C    2.074600       1.501500     -0.6595000    
 C   -2.334400       1.107900      0.5785000    
 C    4.438000       1.356300      0.1279000    
 H   -1.822300     -0.1790000      -1.824000    
 H   -2.413600      -1.761700      -1.361300    
 H   -3.066700     -0.8785000      0.9179000    
 H  -0.8344000      -3.287600      0.3502000    
 H    1.567300      -3.044100      0.9945000    
 H   2.4900001E-02   1.558400      -1.322000    
 H    3.623100      -1.136000      0.8713000    
 H    2.269900       2.515000      -1.002200    
 H   -4.836800      0.4429000      0.1741000    
 H   -4.607300     -0.7531000     -0.9092000    
 H    4.481400       1.909900       1.071200    
 H    5.215600      0.5849000      0.1385000    
 H    4.677400       2.040300     -0.6935000    
 H   -1.263200       1.751700       2.074300    


%chk=000095319-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000095319

0 1
O -1.723958 0.945936 1.882714
O -2.487614 2.149777 0.050809
N 1.125163 -2.398548 0.451358
N -4.347705 0.019421 -0.292139
C -0.642528 -1.235097 -0.422361
C -2.030447 -0.882311 -0.892189
C 0.521928 -0.361440 -0.382761
C 1.613496 -1.117795 0.168715
C -2.991491 -0.256462 0.202525
C -0.230266 -2.465182 0.092893
C 0.760537 0.987370 -0.763487
C 2.906344 -0.573771 0.344049
C 3.128096 0.766645 -0.038580
C 2.046462 1.528897 -0.590142
C -2.406243 1.066640 0.677668
C 4.496319 1.408493 0.126413
H -1.991299 -0.168503 -1.738142
H -2.550173 -1.788952 -1.259213
H -3.033518 -0.948460 1.060833
H -0.801064 -3.382881 0.226789
H 1.668542 -3.163154 0.844754
H -0.042885 1.601433 -1.185995
H 3.724108 -1.170390 0.765970
H 2.236579 2.568270 -0.885530
H -4.404975 0.862607 -0.872691
H -4.824132 -0.790248 -0.697485
H 4.449679 2.289255 0.794943
H 5.228835 0.701565 0.553549
H 4.895112 1.760261 -0.844065
H -1.277601 1.809829 2.100499


