%chk=000086440.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086440

0 1
 Cl  -1.378700      0.9119000      -2.554800    
 S  -0.4420000      -1.901200      -1.263000    
 F   -5.787000      0.4512000       1.993300    
 F   -4.900800       2.339100       1.398000    
 F   -6.189100       1.262200      1.6100001E-02
 O  -0.2495000      -1.527200      -2.657200    
 O  -0.7185000      -3.289700     -0.9180000    
 O    3.211100       2.418200     -0.2881000    
 O    4.583900       1.094500      -1.577200    
 O    4.735900     -0.7277000       2.723800    
 O    5.111300      0.8300000       1.223200    
 N    4.430400     -0.1233000       1.669000    
 C   0.9874000      -1.374400     -0.4103000    
 C   -1.832400     -0.9905000     -0.6464000    
 C    1.744800     -0.3133000     -0.9063000    
 C    1.372000      -2.015100      0.7675000    
 C   -2.215600      0.2113000      -1.216500    
 C   -2.519200      -1.532500      0.4281000    
 C    2.886800      0.1071000     -0.2245000    
 C   -4.019800      0.3604000      0.3834000    
 C    3.271300     -0.5336000      0.9533000    
 C   -3.317200      0.8918000     -0.6981000    
 C   -3.620700     -0.8518000      0.9464000    
 C    2.513900      -1.594600       1.449500    
 C   -5.197600       1.087600      0.9380000    
 C    3.653000       1.219200     -0.7735000    
 C    3.886400       3.590700     -0.7560000    
 H    1.461600      0.1941000      -1.823900    
 H   0.7931000      -2.839400       1.174400    
 H   -2.223600      -2.467600      0.8936000    
 H   -3.634000       1.837800      -1.131800    
 H   -4.153700      -1.280200       1.790800    
 H    2.778500      -2.118700       2.364200    
 H    4.943600       3.554100     -0.4770000    
 H    3.426500       4.460900     -0.2805000    
 H    3.775700       3.681600      -1.840600    


%chk=000086440-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000086440

0 1
Cl -1.220506 1.391926 -1.803694
S -0.488882 -1.952531 -1.198229
F -6.694541 -0.168088 1.136694
F -5.421962 1.288194 2.315543
F -6.109306 1.829907 0.225783
O -0.317563 -1.697113 -2.793626
O -0.671407 -3.453167 -0.571780
O 4.019188 2.385481 -0.279049
O 3.942723 1.301503 -2.348166
O 4.534668 0.289641 2.856994
O 5.582280 0.349080 0.827566
N 4.546648 0.184679 1.573071
C 1.015998 -1.196380 -0.314755
C -2.028342 -0.995099 -0.524964
C 1.788957 -0.260557 -1.011960
C 1.327985 -1.676032 0.967140
C -2.321499 0.346724 -0.818803
C -2.902466 -1.788931 0.237399
C 2.941251 0.266967 -0.381044
C -4.387611 0.130291 0.446924
C 3.273805 -0.216049 0.909671
C -3.509621 0.922137 -0.325585
C -4.093709 -1.222692 0.732925
C 2.484351 -1.165923 1.591041
C -5.635887 0.757929 1.013173
C 3.706617 1.331594 -1.121308
C 4.844367 3.469967 -0.870865
H 1.522868 0.051103 -2.027062
H 0.713478 -2.446713 1.442483
H -2.636982 -2.837507 0.415308
H -3.747608 1.965310 -0.551482
H -4.790180 -1.827708 1.319671
H 2.791633 -1.504813 2.583795
H 5.855077 3.083144 -1.080864
H 4.871426 4.251633 -0.100238
H 4.382552 3.834996 -1.802806


