%chk=000153784.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000153784

0 1
 O   -1.104500       1.136400       1.484500    
 O   -2.547900       2.801600      0.8085000    
 O   -3.012000      0.2234000     -0.3944000    
 O   -2.482000     -0.3412000      -2.448500    
 N  -0.2834000       1.199100      -1.128300    
 N    2.067500      -1.944600      0.3391000    
 N   -2.354300     -0.4623000      -1.209300    
 C   0.4881000      0.1130000     -0.6330000    
 C  -7.0400000E-02  -1.152900     -0.4299000    
 C    1.837200      0.3492000     -0.3494000    
 C  -0.4687000       2.404900     -0.3932000    
 C   0.7676000      -2.166800      6.4499997E-02
 C    2.600500     -0.7234000      0.1416000    
 C   -1.423000      -1.418400     -0.7062000    
 C    2.424500       1.611500     -0.5440000    
 C  -0.9072000       3.507900      -1.343700    
 C   0.2174000      -3.429300      0.2689000    
 C    3.944200     -0.4945000      0.4258000    
 C   -1.948600      -2.689300     -0.4931000    
 C   -1.506900       2.169200      0.6849000    
 C   -1.126300      -3.696600     -4.6999999E-03
 C    3.770100       1.814000     -0.2521000    
 C    4.531200      0.7586000      0.2338000    
 C   -2.000200      0.7916000       2.546200    
 C   -1.412900     -0.3612000       3.332000    
 H   0.3977000       2.776300      0.1587000    
 H  -0.7977000       1.050500      -1.988300    
 H    1.930200       2.442500      -1.032600    
 H   -1.841400       3.250600      -1.856900    
 H   -1.076000       4.447100     -0.8055000    
 H  -0.1459000       3.689900      -2.110200    
 H   0.8411000      -4.235200      0.6514000    
 H    4.562000      -1.306000      0.8061000    
 H   -2.992100      -2.913400     -0.7005000    
 H   -1.526200      -4.691900      0.1655000    
 H    4.229200       2.781900     -0.4290000    
 H    5.583700      0.9042000      0.4585000    
 H   -2.124000       1.657200       3.206800    
 H   -2.977800      0.5064000       2.145600    
 H   -1.280200      -1.237800       2.690200    
 H  -0.4232000     -9.9299997E-02   3.720500    
 H   -2.061200     -0.6340000       4.169300    


%chk=000153784-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000153784

0 1
O -1.759191 1.242498 1.415853
O -1.299010 3.465666 1.939817
O -3.584065 -1.217456 -0.531008
O -2.221876 -0.183097 -2.030194
N -0.279808 1.217705 -0.812562
N 2.442288 -1.929396 0.212469
N -2.410367 -0.989702 -1.021304
C 0.571193 0.138936 -0.605458
C 0.105278 -1.222148 -0.416196
C 1.998888 0.377308 -0.564580
C -0.240759 2.481153 -0.062484
C 1.112875 -2.199499 0.028317
C 2.886543 -0.674168 -0.107954
C -1.255269 -1.730154 -0.470854
C 2.584285 1.607603 -1.018675
C -0.634662 3.682692 -0.953991
C 0.726964 -3.543871 0.369179
C 4.296647 -0.412298 0.000519
C -1.597151 -3.037321 -0.090721
C -1.148856 2.469061 1.196233
C -0.599173 -3.957955 0.325882
C 3.960412 1.821831 -0.941266
C 4.823298 0.814067 -0.395204
C -2.645837 1.159331 2.629013
C -3.049054 -0.301160 2.791160
H 0.777852 2.646350 0.330806
H -1.180939 1.001066 -1.259994
H 1.944755 2.356509 -1.495379
H -1.632829 3.527223 -1.402023
H -0.662032 4.607063 -0.354873
H 0.092560 3.801375 -1.775265
H 1.538386 -4.210457 0.675040
H 4.926013 -1.222227 0.381237
H -2.645776 -3.339015 -0.154458
H -0.880546 -4.981054 0.591685
H 4.389390 2.755853 -1.319647
H 5.899860 1.002501 -0.322297
H -2.077275 1.549070 3.492058
H -3.511257 1.823419 2.454001
H -3.585667 -0.667542 1.899794
H -2.163118 -0.938828 2.954893
H -3.714769 -0.402032 3.668033


