%chk=000043197.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043197

0 1
 I    7.191000      -2.204000     -1.3700000E-02
 O   -1.371900      0.3202000     -3.3000000E-03
 O   0.8234000      0.6039000      2.9000000E-03
 O  -0.5335000       2.467200      1.8600000E-02
 C   -5.124600      0.1369000     -2.5000000E-02
 C   -6.143600      -1.006000     -4.9000001E-03
 C   -3.673900     -0.3424000     -1.2200000E-02
 C   -7.595300     -0.5267000     -4.2599998E-02
 C   -2.699100      0.8278000      3.0000001E-04
 C   -8.566700      -1.693700      5.2400000E-02
 C    3.211400      0.5824000      7.4000000E-03
 C    1.982600       1.443600      1.3500000E-02
 C  -0.3738000       1.254000      6.8999999E-03
 C    3.773200      0.1755000       1.212300    
 C    3.777100      0.1996000      -1.203600    
 C    4.915700     -0.6247000       1.206000    
 C    4.919400     -0.6007000      -1.209800    
 C    5.488800      -1.012900     -5.1000002E-03
 H   -5.293800      0.7513000     -0.9180000    
 H   -5.299800      0.7851000      0.8427000    
 H   -5.983500      -1.607400      0.8988000    
 H   -5.959800      -1.667100     -0.8610000    
 H   -3.492100     -0.9769000      0.8640000    
 H   -3.476600     -0.9744000     -0.8870000    
 H   -7.780100      0.1629000      0.7891000    
 H   -7.779400      2.6200000E-02 -0.9707000    
 H   -2.852400       1.452900     -0.8873000    
 H   -2.855000       1.436300      0.8989000    
 H   -9.598800      -1.330700      2.1199999E-02
 H   -8.425900      -2.389800     -0.7807000    
 H   -8.428600      -2.244600      0.9882000    
 H    1.973900       2.098100     -0.8671000    
 H    1.970400       2.080400      0.9070000    
 H    3.333600      0.4704000       2.161100    
 H    3.340400      0.5134000      -2.147800    
 H    5.342900     -0.9351000       2.156200    
 H    5.349600     -0.8920000      -2.164600    


%chk=000043197-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000043197

0 1
I 7.292925 -2.327393 -0.084168
O -1.368702 0.331537 -0.003806
O 0.847685 0.593049 0.048601
O -0.502600 2.517611 -0.039395
C -5.191418 0.164387 -0.061175
C -6.183800 -1.016762 0.034038
C -3.714786 -0.291417 0.010202
C -7.662848 -0.574110 -0.040287
C -2.755728 0.894595 -0.065706
C -8.649458 -1.756963 0.066379
C 3.273341 0.614657 0.035489
C 2.053408 1.498101 0.071051
C -0.360387 1.272280 -0.002034
C 3.842990 0.122137 1.235237
C 3.869110 0.258013 -1.199027
C 4.981675 -0.713356 1.211490
C 5.008485 -0.576095 -1.244378
C 5.554536 -1.055254 -0.033366
H -5.367532 0.713159 -1.009776
H -5.401085 0.882528 0.758959
H -6.012828 -1.564273 0.984164
H -5.976029 -1.738996 -0.782736
H -3.535481 -0.843864 0.952264
H -3.495409 -0.990005 -0.819675
H -7.866555 0.153240 0.772136
H -7.833940 -0.031916 -0.992705
H -2.861366 1.458917 -1.010890
H -2.887806 1.597428 0.777656
H -9.699358 -1.415079 0.013015
H -8.488530 -2.483265 -0.752661
H -8.517863 -2.297049 1.022966
H 1.991095 2.171736 -0.801432
H 1.998872 2.108491 0.989860
H 3.393730 0.384939 2.199953
H 3.440533 0.627776 -2.137799
H 5.411606 -1.086516 2.145087
H 5.458722 -0.843267 -2.204430


