%chk=000158702.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000158702

0 1
 I  -0.4398000      -3.883100      0.5086000    
 O    1.941200      -1.900600     -0.4833000    
 O   -2.764300       2.233000     -0.1992000    
 O   -3.822500      0.4140000      0.4403000    
 N   -2.783700       1.006800      6.2899999E-02
 C    2.851100       1.432600      8.3700001E-02
 C    2.008800      0.8593000      -1.072800    
 C   0.7532000      0.1536000     -0.6218000    
 C    2.042300       2.388900      0.9637000    
 C    3.403800      0.2891000      0.9383000    
 C   0.7755000      -1.204500     -0.3420000    
 C  -0.4132000      0.8935000     -0.4922000    
 C   -1.583300      0.2603000     -7.3600002E-02
 C  -0.3948000      -1.837700      7.6499999E-02
 C   -1.574300      -1.105200      0.2109000    
 H    3.694000       1.984200     -0.3506000    
 H    2.627700      0.2392000      -1.729100    
 H    1.714600       1.695500      -1.724100    
 H    1.269200       1.876700       1.544800    
 H    1.571500       3.173700      0.3626000    
 H    2.705100       2.883500       1.683100    
 H    4.111700      0.6898000       1.673600    
 H    2.628000     -0.2322000       1.506500    
 H    3.956400     -0.4323000      0.3285000    
 H  -0.4003000       1.955200     -0.7250000    
 H   -2.480200      -1.611100      0.5375000    
 H    2.452200      -1.560700      -1.233100    


%chk=000158702-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000158702

0 1
I -0.496358 -4.014612 0.328166
O 1.832695 -2.038460 -0.512648
O -2.865157 2.264322 -0.149355
O -3.985210 0.358475 0.419993
N -2.912689 0.990187 0.071312
C 2.906964 1.436915 0.067557
C 1.986389 0.883446 -1.073483
C 0.718025 0.165611 -0.625615
C 2.170359 2.465216 0.956528
C 3.542586 0.319846 0.928550
C 0.700084 -1.245481 -0.378999
C -0.486587 0.880402 -0.473522
C -1.666442 0.214406 -0.083976
C -0.504468 -1.903269 -0.003058
C -1.695124 -1.178290 0.151008
H 3.731325 1.968650 -0.452849
H 2.595238 0.231767 -1.736864
H 1.685656 1.741254 -1.703470
H 1.346522 1.992953 1.521933
H 1.741681 3.287933 0.354437
H 2.867789 2.912125 1.688315
H 4.214170 0.758032 1.688756
H 2.777074 -0.267754 1.468460
H 4.162011 -0.371364 0.320436
H -0.525780 1.956173 -0.664502
H -2.633057 -1.655712 0.442779
H 2.642201 -1.491271 -0.675189


