%chk=000063654.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000063654

0 1
 I    7.491800      0.5355000       2.158600    
 Cl  -4.948500      7.4500002E-02   3.203400    
 O    2.367800       2.224700      0.7799000    
 O   -3.386400       3.529000     -0.7361000    
 N    1.331000      0.6091000     -0.5870000    
 N  -0.5361000      -1.924200      -1.301500    
 N    2.489200      -1.388000      -1.120200    
 C    1.442700     -0.6264000      -1.221300    
 C   0.3413000      -1.129500      -2.131700    
 C   -1.654400      -2.461500      -2.072100    
 C   -2.590900      -3.278700      -1.181400    
 C    3.589600      0.3083000      0.2622000    
 C    2.383100       1.159000      0.1692000    
 C   0.1307000       1.351800     -0.6256000    
 C    3.581200     -0.9383000     -0.3677000    
 C   -3.182700      -2.435500     -7.9999998E-02
 C    4.707700      0.7355000      0.9881000    
 C    4.712100      -1.756600     -0.2624000    
 C  -5.6100000E-02   2.300400      -1.622100    
 C  -0.8459000       1.124100      0.3348000    
 C    5.827200     -8.9800000E-02   1.083400    
 C    5.829600      -1.335300      0.4597000    
 C   -2.520800      -2.339500       1.134600    
 C   -4.379700      -1.770600     -0.2998000    
 C   -1.241300       3.034900      -1.658900    
 C   -2.031200       1.858600      0.2981000    
 C   -2.229000       2.814000     -0.6989000    
 C   -3.068800      -1.560600       2.153700    
 C   -4.927700     -0.9915000      0.7192000    
 C   -4.272200     -0.8863000       1.946000    
 C   -4.353500       3.252400      0.2758000    
 H   0.7901000      -1.741800      -2.923400    
 H  -0.1901000     -0.3032000      -2.609300    
 H   -2.216200      -1.641500      -2.536800    
 H   -1.281900      -3.107500      -2.876200    
 H  -1.6500000E-02  -2.695200     -0.8817000    
 H   -2.059100      -4.136800     -0.7497000    
 H   -3.396000      -3.706400      -1.792400    
 H    4.704300       1.706200       1.477900    
 H    4.730000      -2.729600     -0.7477000    
 H   0.7075000       2.479400      -2.374300    
 H  -0.6954000      0.3873000       1.119000    
 H    6.691600      -1.994800      0.5212000    
 H   -1.586000      -2.863900       1.311400    
 H   -4.896400      -1.844200      -1.252500    
 H   -1.389900       3.777400      -2.438200    
 H   -2.752200       1.644700       1.078200    
 H   -2.547000      -1.487900       3.104500    
 H   -5.865300     -0.4706000      0.5426000    
 H   -3.971300       3.489000       1.274600    
 H   -4.724800       2.224800      0.2060000    
 H   -5.207700       3.913300      9.5899999E-02


%chk=000063654-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000063654

0 1
I 7.871914 0.513666 1.810112
Cl -5.763231 0.361239 2.698198
O 2.573205 2.354754 0.590513
O -3.241259 3.819836 -0.447105
N 1.464855 0.652829 -0.619975
N -0.431960 -2.095909 -1.154893
N 2.589476 -1.402720 -1.216496
C 1.524614 -0.609591 -1.245735
C 0.321713 -1.137941 -2.007234
C -1.595355 -2.706664 -1.837555
C -2.490250 -3.496797 -0.842984
C 3.789650 0.314996 0.097241
C 2.614509 1.207807 0.066341
C 0.233845 1.436565 -0.587480
C 3.733281 -0.966112 -0.532880
C -3.308842 -2.594049 0.065909
C 4.966615 0.740856 0.767542
C 4.875523 -1.812748 -0.478641
C 0.204994 2.731950 -1.159474
C -0.909556 0.918755 0.054809
C 6.076253 -0.114444 0.805010
C 6.040112 -1.395172 0.184601
C -2.827823 -2.179047 1.333387
C -4.569507 -2.105203 -0.365929
C -0.970724 3.497517 -1.098079
C -2.096612 1.679300 0.114957
C -2.125891 2.975022 -0.458697
C -3.568439 -1.289058 2.145934
C -5.327799 -1.214854 0.427258
C -4.806686 -0.815953 1.672522
C -4.446006 3.340352 0.241726
H 0.719372 -1.611516 -2.933450
H -0.356804 -0.318691 -2.297784
H -2.191595 -1.892138 -2.291713
H -1.291201 -3.387811 -2.670163
H 0.212671 -2.817194 -0.795317
H -1.847240 -4.173370 -0.246945
H -3.166373 -4.141550 -1.436761
H 4.965733 1.728752 1.236693
H 4.823711 -2.789767 -0.967975
H 1.102351 3.142777 -1.630305
H -0.887140 -0.092680 0.471378
H 6.915300 -2.050114 0.222065
H -1.859278 -2.545166 1.690608
H -4.970668 -2.421241 -1.336713
H -1.016234 4.502934 -1.526184
H -2.973136 1.253333 0.609679
H -3.187728 -0.971670 3.121190
H -6.300416 -0.847106 0.087203
H -4.243992 3.131368 1.309133
H -4.848435 2.428623 -0.240462
H -5.172017 4.161244 0.152020


