%chk=000146351.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146351

0 1
 I   -2.571200       3.290100       1.791100    
 I    2.021300      -1.380300       2.745700    
 S    5.048000      -1.213800     -0.4815000    
 O  -0.3869000       2.267500     -0.4126000    
 O    4.348000     -0.3252000      0.7102000    
 O   -6.164000      -2.842600      3.0700000E-02
 O   -4.075800      -2.451500      0.8308000    
 O    6.340800      -1.895000      0.2461000    
 O    4.142800      -2.279200     -0.8715000    
 O    5.550900     -0.2889000      -1.480700    
 C   -3.818900     -5.6000002E-02 -0.6714000    
 C   -1.525600       1.520300     -0.4752000    
 C   -5.044400     -0.8995000     -0.7766000    
 C   -3.758100      0.9730000      0.2683000    
 C   -2.733000     -0.2968000      -1.513200    
 C   -2.611500       1.761100      0.3664000    
 C   -1.586400      0.4914000      -1.415200    
 C   0.7959000       1.610700     -0.1225000    
 C   0.8189000      0.6813000      0.9023000    
 C    1.927400       1.900400     -0.8646000    
 C    3.162400      0.2989000      0.4570000    
 C    2.011700      2.0099999E-02   1.194400    
 C    3.120200       1.239300     -0.5726000    
 C   -5.012600      -2.125400      0.1147000    
 H   -5.179300      -1.234500      -1.812200    
 H   -5.927500     -0.3058000     -0.5106000    
 H   -4.609700       1.150900      0.9215000    
 H   -2.768000      -1.095000      -2.249900    
 H  -0.7555000      0.2956000      -2.087900    
 H  -7.0699997E-02  0.4747000       1.490800    
 H    1.897700       2.638800      -1.660200    
 H    4.003500       1.513900      -1.138400    
 H   -6.143000      -3.636100      0.6071000    
 H    6.888500      -1.282400      0.7909000    


%chk=000146351-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000146351

0 1
I -2.340482 3.710082 1.118043
I 2.296023 -2.293075 2.076637
S 5.866941 -1.209879 -0.668354
O -0.300837 1.855217 -0.552227
O 4.598704 -0.265417 0.991329
O -6.930304 -2.308776 0.297887
O -4.697944 -2.870452 -0.005133
O 7.289593 -0.478572 0.258982
O 6.291518 -2.745724 -0.954898
O 5.495944 -0.267677 -1.944859
C -4.124996 0.005091 -0.559861
C -1.552109 1.183702 -0.498277
C -5.520786 -0.593056 -0.600396
C -3.916425 1.244412 0.093576
C -3.026358 -0.633767 -1.190714
C -2.635525 1.838727 0.127026
C -1.748235 -0.046398 -1.166634
C 0.887139 1.235684 -0.166737
C 0.930653 0.036140 0.599069
C 2.074016 1.919423 -0.556825
C 3.413751 0.188538 0.604671
C 2.176815 -0.486845 0.964432
C 3.309683 1.398711 -0.185299
C -5.612539 -2.024683 -0.079072
H -5.897179 -0.623254 -1.644072
H -6.242247 0.022392 -0.037990
H -4.754576 1.750680 0.582881
H -3.167881 -1.594036 -1.693748
H -0.904475 -0.524520 -1.674645
H 0.004979 -0.458441 0.903197
H 1.983883 2.834046 -1.148553
H 4.243592 1.880955 -0.486841
H -6.994468 -3.255585 0.600456
H 6.840031 0.096356 0.948152


