%chk=000072210.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072210

0 1
 I    4.999400       1.820600      2.3100000E-02
 O   -1.112500      0.7894000       1.357300    
 O  -9.1399997E-02  -1.617800     -0.1224000    
 O    4.439100      -1.323500     -0.4344000    
 N   0.8943000      0.5298000      9.1200002E-02
 N   -3.633300      0.8318000     -0.3072000    
 N    2.161500      -1.471100     -0.2673000    
 N   -4.694600      0.1887000     -0.3608000    
 N   -5.675400     -0.3916000     -0.4084000    
 C   -1.910000     -0.3302000      0.9502000    
 C   -2.403600      3.9700001E-02 -0.4410000    
 C  -0.4003000       1.220300      0.1916000    
 C   -1.306800      0.9281000      -1.005900    
 C   -1.013800      -1.564300      0.9846000    
 C    1.035300     -0.8469000     -8.3400004E-02
 C    2.071500       1.256700      0.1240000    
 C    3.284700      0.7119000     -2.9899999E-02
 C    3.355900     -0.7716000     -0.2614000    
 H   -2.717100     -0.4500000       1.680700    
 H   -2.582200     -0.8357000      -1.077400    
 H  -0.2555000       2.302800      0.2854000    
 H  -0.7678000      0.4422000      -1.826900    
 H   -1.712400       1.861900      -1.413600    
 H  -0.4434000      -1.617200       1.919600    
 H   -1.628700      -2.467300      0.9127000    
 H    1.933600       2.320600      0.2837000    


%chk=000072210-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000072210

0 1
I 5.110844 1.884345 0.266063
O -1.137283 0.842489 1.296821
O -0.093331 -1.594957 -0.208070
O 4.571110 -1.334564 -0.412755
N 0.929540 0.551395 0.034605
N -3.716611 0.774660 -0.523282
N 2.230409 -1.456760 -0.212551
N -4.791873 0.201199 -0.167651
N -5.888673 -0.148248 0.124139
C -1.937282 -0.347740 0.916897
C -2.445754 -0.026040 -0.521776
C -0.402350 1.227085 0.090546
C -1.330038 0.877798 -1.110329
C -1.049219 -1.599227 0.937585
C 1.082484 -0.843637 -0.107386
C 2.107187 1.303008 0.171353
C 3.343909 0.711673 0.066725
C 3.481074 -0.744289 -0.212870
H -2.744810 -0.432839 1.663309
H -2.574199 -0.952896 -1.111593
H -0.199885 2.304413 0.184390
H -0.779313 0.372912 -1.917006
H -1.784601 1.797737 -1.509321
H -0.491430 -1.665898 1.888799
H -1.640331 -2.516540 0.783886
H 1.976926 2.372218 0.353573


