%chk=000115534.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000115534

0 1
 O   0.1257000      0.5021000       2.237000    
 O  -0.2664000     -0.6450000      -2.353500    
 O   -3.948600     -0.4123000      0.3559000    
 N   -1.898200      8.1500001E-02   1.265200    
 N   -2.103800     -0.4268000      -1.011800    
 C    1.556400      4.6999998E-02 -0.2871000    
 C   5.2900001E-02  0.4363000     -0.1979000    
 C    2.303300       1.317300      0.1079000    
 C   5.2600000E-02   1.958400     -0.5375000    
 C    1.516900       2.397900     -0.6141000    
 C    1.983500      -1.185000      0.5001000    
 C  -0.5322000      0.3135000       1.214100    
 C  -0.7529000     -0.2813000      -1.282700    
 C    1.169600      -2.405900      7.4299999E-02
 C    3.477600      -1.448900      0.3203000    
 C   -2.736200     -0.2489000      0.2098000    
 H    1.816400     -0.1383000      -1.340400    
 H    3.347900       1.317900     -0.2177000    
 H    2.284200       1.483000       1.190500    
 H  -0.4599000       2.546900      0.2338000    
 H  -0.4506000       2.184100      -1.485300    
 H    1.673800       3.387100     -0.1736000    
 H    1.829600       2.448400      -1.664200    
 H    1.828400      -1.038700       1.573800    
 H    1.249100      -2.586800      -1.002700    
 H    1.536300      -3.304500      0.5836000    
 H   0.1131000      -2.310300      0.3379000    
 H    3.742000      -1.551200     -0.7378000    
 H    3.769900      -2.375400      0.8271000    
 H    4.084700     -0.6465000      0.7507000    
 H   -2.326900      0.1152000       2.185900    
 H   -2.681700     -0.7790000      -1.769800    


%chk=000115534-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000115534

0 1
O -0.000511 0.828644 2.228321
O -0.386910 0.000515 -2.558252
O -3.750162 -1.211234 0.404985
N -1.826742 -0.201321 1.271722
N -2.036548 -0.562412 -1.048781
C 1.545921 0.091172 -0.284239
C 0.033622 0.610905 -0.219080
C 2.385086 1.355819 0.027800
C 0.150917 2.185097 -0.480336
C 1.651608 2.470549 -0.743346
C 1.890631 -1.169049 0.555222
C -0.565420 0.422289 1.178072
C -0.779614 -0.006620 -1.361815
C 1.018625 -2.388627 0.164300
C 3.388650 -1.528960 0.384293
C -2.620471 -0.694020 0.221734
H 1.701594 -0.159039 -1.355097
H 3.433593 1.241527 -0.297224
H 2.374541 1.556994 1.115365
H -0.183269 2.720246 0.425096
H -0.491434 2.494809 -1.322149
H 1.935181 3.485461 -0.413150
H 1.870622 2.389059 -1.824041
H 1.719168 -0.935613 1.624924
H 1.132034 -2.625554 -0.911177
H 1.322716 -3.281586 0.740312
H -0.056022 -2.225834 0.365818
H 3.632582 -1.711350 -0.680479
H 3.629281 -2.449656 0.947037
H 4.049908 -0.727154 0.756045
H -2.227563 -0.289959 2.211600
H -2.585115 -0.933297 -1.831679


