%chk=000093895.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093895

0 1
 I   0.1983000      -3.195800      0.5788000    
 I    2.707200       2.353000      0.1704000    
 I   -3.362500       1.726200     -3.8800001E-02
 Cl -0.4600000       3.889300      -1.635100    
 O    4.310400      -1.705600     -0.6144000    
 O   -3.024300      -1.638700       1.367700    
 O  -0.5420000       3.817000      0.9887000    
 N    2.392900     -0.8418000      0.4547000    
 N   -2.941200      -1.837300     -0.9410000    
 C    1.116400     -0.2720000      0.3429000    
 C   -1.285600     -0.5201000      0.2616000    
 C  -1.5600000E-02  -1.086800      0.3697000    
 C   0.9781000       1.109500      0.2079000    
 C  -0.2920000       1.676000      9.9699996E-02
 C   -1.423800      0.8613000      0.1266000    
 C    3.016500     -0.9139000       1.808600    
 C    3.157000      -1.272900     -0.6795000    
 C   -2.473500      -1.375100      0.2898000    
 C  -0.4366000       3.125800     -4.0700000E-02
 C    2.495000      -1.228500      -2.037700    
 C   -4.114700      -2.669500      -1.080000    
 H    3.218300      -1.965200       2.033900    
 H    2.355100     -0.4871000       2.567700    
 H    3.970400     -0.3791000       1.786700    
 H    2.100400     -0.2318000      -2.247000    
 H    1.692100      -1.965400      -2.095900    
 H    3.234000      -1.464000      -2.809900    
 H   -2.457900      -1.554400      -1.788700    
 H   -4.977400      -2.020100      -1.247700    
 H   -4.273100      -3.266000     -0.1782000    
 H   -3.973800      -3.324500      -1.942700    


%chk=000093895-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000093895

0 1
I 0.220791 -3.219457 0.474025
I 2.725136 2.375745 0.256007
I -3.391218 1.763941 -0.035561
Cl -0.411349 3.728688 -1.848325
O 4.378804 -1.748291 -0.497479
O -3.069836 -1.703342 1.435673
O -0.569715 4.036542 0.865123
N 2.455563 -0.860820 0.431361
N -3.040381 -1.862658 -0.898241
C 1.154079 -0.283978 0.309988
C -1.318456 -0.535843 0.209984
C -0.018479 -1.092769 0.307071
C 0.987680 1.126615 0.215327
C -0.299382 1.707890 0.098296
C -1.443770 0.871021 0.102616
C 3.029176 -1.079567 1.784428
C 3.235752 -1.240909 -0.679393
C -2.556956 -1.420981 0.314153
C -0.445114 3.197489 -0.015505
C 2.634109 -1.011192 -2.060279
C -4.225574 -2.723072 -1.007838
H 3.178124 -2.157708 1.966747
H 2.341040 -0.666931 2.538923
H 4.009241 -0.579377 1.860117
H 2.403619 0.055710 -2.231499
H 1.701724 -1.589372 -2.192653
H 3.368266 -1.342812 -2.808709
H -2.556345 -1.573058 -1.750348
H -5.030721 -2.218173 -1.572003
H -4.582160 -2.933993 0.012477
H -3.975545 -3.676840 -1.506384


