%chk=000063865.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000063865

0 1
 I   -6.653700      -2.757200      9.8899998E-02
 Cl   2.967100      -1.148300       2.672900    
 S   0.1323000       3.477100     -0.4500000    
 O    1.560000      -1.436400      3.1199999E-02
 O   -2.156700       2.618000      0.4314000    
 N  -0.6528000      0.9318000     -0.2350000    
 N   -1.477900      -1.273900     -0.5746000    
 N    1.714400       1.518500      0.1363000    
 C  -0.5072000     -0.4127000     -0.5851000    
 C   -3.035900      0.4927000      7.7399999E-02
 C   -2.762200     -0.8396000     -0.2318000    
 C   -1.919300       1.461000      9.2200004E-02
 C   0.8310000     -0.9339000      -1.068000    
 C   0.4702000       1.824200     -0.1466000    
 C   -4.337700      0.9001000      0.3926000    
 C   -3.811000      -1.766500     -0.2229000    
 C   -5.373400     -3.3000000E-02  0.3972000    
 C   -5.110600      -1.366100      9.0800002E-02
 C    2.931300      -1.364300     -3.8699999E-02
 C    3.697000      -1.230000       1.112100    
 C    3.531400      -1.429400      -1.290000    
 C    1.788000       3.835300     -0.1823000    
 C    2.470300       2.674200      0.1151000    
 C    5.086300      -1.159300       1.010300    
 C    4.920700      -1.358800      -1.391700    
 C    5.698200      -1.223700     -0.2415000    
 H    1.343900     -0.1416000      -1.623800    
 H   0.6428000      -1.760600      -1.765000    
 H   -4.562900       1.934200      0.6383000    
 H   -3.599000      -2.805700     -0.4680000    
 H   -6.378000      0.3008000      0.6444000    
 H    2.969800      -1.569400      -2.208300    
 H    2.170900       4.843200     -0.2536000    
 H    3.529400       2.614300      0.3266000    
 H    5.706100      -1.054300       1.897200    
 H    5.398300      -1.416800      -2.365500    
 H    6.780000      -1.170400     -0.3208000    


%chk=000063865-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000063865

0 1
I -6.786338 -2.865352 -0.319819
Cl 3.157573 -0.126456 2.715800
S 0.827510 2.847685 1.273593
O 1.690293 -0.661999 0.198095
O -2.188892 2.617698 0.715170
N -0.744734 0.968577 -0.167576
N -1.538800 -1.249934 -0.699396
N 1.088566 2.103649 -1.272604
C -0.559507 -0.371170 -0.603110
C -3.125449 0.453813 0.146583
C -2.842611 -0.854127 -0.352295
C -2.046264 1.445939 0.276315
C 0.827369 -0.836159 -0.987384
C 0.334960 1.899229 -0.202130
C -4.452037 0.801233 0.507636
C -3.892868 -1.802468 -0.485052
C -5.492634 -0.132969 0.374747
C -5.197376 -1.432656 -0.123476
C 3.046244 -0.969761 0.046272
C 3.880165 -0.769302 1.177882
C 3.627746 -1.475428 -1.143778
C 2.154970 3.518323 0.282857
C 2.117550 3.011262 -1.006197
C 5.253721 -1.059143 1.132630
C 5.009156 -1.766940 -1.192544
C 5.826156 -1.561326 -0.060548
H 1.223589 -0.238771 -1.829428
H 0.746036 -1.902273 -1.258399
H -4.644103 1.809408 0.888058
H -3.646784 -2.797327 -0.863184
H -6.515547 0.135505 0.651602
H 3.009657 -1.646560 -2.029643
H 2.840138 4.248149 0.708224
H 2.809384 3.274172 -1.806112
H 5.866839 -0.894239 2.023672
H 5.441479 -2.157968 -2.119535
H 6.895941 -1.788815 -0.095226


