%chk=000039240.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039240

0 1
 I   -2.739300      -2.530700      0.3610000    
 O    2.668500      -1.308700     -0.8969000    
 O    3.179900     -2.4800001E-02  0.9159000    
 C   0.9330000     -1.0400000E-02  1.6300000E-02
 C   -1.463700     -0.8090000      0.1235000    
 C  -0.8301000       1.093700      -1.412700    
 C  -0.8328000       1.440800       1.085400    
 C   1.8200001E-02  -1.240800      0.1861000    
 C   0.6419000      0.6528000      -1.344000    
 C   0.6391000      0.9977000       1.143900    
 C   -1.737100     -0.1379000      -1.240400    
 C   -1.740500      0.2085000       1.252300    
 C   -1.112100       2.094000     -0.2788000    
 C    2.374900     -0.4252000      8.8299997E-02
 H   -1.029500       1.566800      -2.380700    
 H   -1.034700       2.159400       1.887500    
 H   0.2252000      -1.985400     -0.5948000    
 H   0.2370000      -1.739000       1.141000    
 H   0.8514000     -3.7000000E-02  -2.171800    
 H    1.299200       1.519300      -1.494000    
 H    1.290400       1.877600       1.055800    
 H   0.8499000      0.5529000       2.125700    
 H   -2.788500      0.1691000      -1.317500    
 H   -1.556700     -0.8429000      -2.062500    
 H   -1.562900     -0.2458000       2.236000    
 H   -2.791900      0.5247000       1.239800    
 H  -0.4849000       2.985500     -0.4019000    
 H   -2.155300       2.429700     -0.3266000    
 H    3.607300      -1.591300     -0.8676000    


%chk=000039240-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000039240

0 1
I -2.782170 -2.607222 0.368698
O 2.711964 -1.368150 -0.917946
O 3.265715 -0.054547 0.907026
C 0.944545 0.007515 0.019787
C -1.452117 -0.774843 0.118603
C -0.838437 1.112482 -1.417845
C -0.839789 1.456429 1.089245
C 0.013000 -1.252245 0.184590
C 0.647120 0.670701 -1.365781
C 0.646011 1.020901 1.157789
C -1.759289 -0.138393 -1.251747
C -1.762961 0.209079 1.264553
C -1.129948 2.125328 -0.280020
C 2.401271 -0.436270 0.086485
H -1.045116 1.576268 -2.401615
H -1.050449 2.168771 1.909705
H 0.225295 -1.980943 -0.615996
H 0.211425 -1.742208 1.155494
H 0.869915 -0.046567 -2.176688
H 1.308449 1.548175 -1.505259
H 1.311099 1.898753 1.057845
H 0.873274 0.560865 2.137614
H -2.821876 0.160883 -1.304960
H -1.571129 -0.864357 -2.063788
H -1.578920 -0.270643 2.243418
H -2.825901 0.510552 1.231730
H -0.497767 3.026689 -0.402408
H -2.185954 2.456472 -0.326852
H 3.668640 -1.629877 -0.833377


