%chk=000086065.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086065

0 1
 I    4.197200     -0.3923000      0.4770000    
 Cl  -4.411600      9.2900001E-02 -0.6459000    
 O   -2.179700     -0.7144000       1.382000    
 O    2.461600       2.253500      4.9400002E-02
 O   0.3096000       2.382700     -0.3868000    
 N   0.1036000     -0.3794000     -0.3493000    
 N    1.628000      -1.932400      1.6000000E-03
 N    1.346200       1.697800     -0.1580000    
 C   -1.203400      0.2153000     -0.6351000    
 C   -2.003500      0.4937000      0.6426000    
 C   0.3594000      -1.709000     -0.2608000    
 C    1.257400      0.2995000     -0.1346000    
 C   -3.376100       1.116100      0.3832000    
 C    2.193300     -0.6843000      8.2099997E-02
 C  -0.6819000      -2.739700     -0.4476000    
 H   -1.113300       1.065700      -1.311600    
 H   -1.734300     -0.5279000      -1.239400    
 H   -1.446200       1.180500       1.290700    
 H   -3.276100       2.086800     -0.1114000    
 H   -3.915900       1.254800       1.324900    
 H   -1.401200      -2.761100      0.3719000    
 H   -1.213800      -2.619300      -1.395700    
 H  -0.2133000      -3.730200     -0.4780000    
 H   -1.341000     -0.9077000       1.834400    


%chk=000086065-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000086065

0 1
I 4.308953 -0.577967 0.473346
Cl -4.450653 -0.177013 -0.627284
O -2.098509 -0.550775 1.574886
O 2.627551 2.218140 -0.001045
O 0.349092 2.456661 -0.072403
N 0.065505 -0.357486 -0.371259
N 1.654544 -1.955410 -0.062548
N 1.435530 1.724301 -0.069730
C -1.270569 0.213775 -0.647521
C -2.021954 0.592378 0.653785
C 0.335915 -1.722136 -0.324626
C 1.295686 0.304721 -0.127702
C -3.446383 1.066861 0.382069
C 2.255368 -0.720843 0.051542
C -0.679194 -2.794657 -0.556396
H -1.166123 1.102325 -1.287530
H -1.851028 -0.553483 -1.183694
H -1.492546 1.446882 1.126924
H -3.456531 1.997483 -0.204705
H -3.996363 1.183959 1.325708
H -1.575092 -2.648032 0.071515
H -1.007062 -2.826802 -1.612798
H -0.215223 -3.762535 -0.315228
H -1.255915 -0.618745 2.090294


