%chk=000023009.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023009

0 1
 O    4.595600     -0.5725000     -9.0000004E-02
 O   -3.027500      -2.438400     -0.5898000    
 O  -0.9976000      -1.950500      0.1025000    
 N    2.017600      0.6280000      2.9800000E-02
 N   -1.714200      0.7275000      0.3864000    
 N   -3.640200       1.731300     -1.4000000E-03
 N   -2.177500      -1.595900     -0.1819000    
 C   0.6297000      0.7634000     -0.4073000    
 C    2.265600     -0.7156000      0.5705000    
 C    2.942900      0.9036000      -1.078200    
 C  -0.3152000      0.5746000      0.7758000    
 C    3.722300     -0.8364000       1.008700    
 C    4.383900      0.7438000     -0.6018000    
 C   -2.547000     -0.2537000     -4.4000000E-02
 C   -2.399700       1.899900      0.3998000    
 C   -3.738600      0.3909000     -0.2792000    
 H   0.3945000      4.9699999E-02  -1.207500    
 H   0.4728000       1.766000     -0.8265000    
 H    2.046700      -1.480000     -0.1862000    
 H    1.668500     -0.9290000       1.459600    
 H    2.802200       1.926200      -1.446600    
 H    2.755700      0.2130000      -1.910700    
 H  -0.1242000       1.379100       1.501600    
 H  -0.2222000     -0.3361000       1.364300    
 H    3.955600     -0.1527000       1.834200    
 H    3.924600      -1.855000       1.355500    
 H    5.072000      0.8891000      -1.440700    
 H    4.639600       1.481600      0.1685000    
 H   -1.959800       2.840100      0.7038000    
 H   -4.666000     -3.5799999E-02 -0.6345000    


%chk=000023009-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000023009

0 1
O 4.776088 -0.456295 -0.024805
O -3.242970 -2.444105 -0.174889
O -1.095652 -1.973367 0.472846
N 2.019475 0.449317 -0.044113
N -1.731703 0.834104 0.389287
N -3.746975 1.755452 -0.177250
N -2.299705 -1.612069 0.126513
C 0.618686 0.604648 -0.483513
C 2.367547 -0.956020 0.308426
C 3.017282 1.002799 -0.997695
C -0.294110 0.790078 0.754413
C 3.779873 -1.005281 0.911515
C 4.420677 0.928876 -0.371348
C -2.615709 -0.216657 0.069976
C -2.467323 1.993370 0.217823
C -3.847130 0.376831 -0.270247
H 0.260632 -0.267598 -1.078365
H 0.539013 1.501149 -1.126895
H 2.327995 -1.613563 -0.594364
H 1.637206 -1.351236 1.037120
H 2.766697 2.058768 -1.213360
H 3.021715 0.440519 -1.964219
H -0.048546 1.742561 1.253588
H -0.135132 -0.032559 1.465938
H 3.800914 -0.428266 1.861208
H 4.094873 -2.044462 1.100514
H 5.192317 1.262925 -1.084383
H 4.451811 1.564265 0.540286
H -2.044492 2.980043 0.394779
H -4.763248 -0.128030 -0.564087


