%chk=000055320.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000055320

0 1
 S    4.328700      0.7806000      -1.148100    
 S    4.335100      -1.681000      0.4972000    
 F   -1.154300     -2.2800000E-02  -1.172200    
 O  -0.6089000       2.613700     -0.5448000    
 O   -6.044600     -0.1554000      -1.544700    
 C    2.015400      4.0399998E-02  0.4098000    
 C    1.073000      -1.189100      0.4280000    
 C  -0.3749000     -0.8951000      0.8846000    
 C   -1.055000      0.3091000      0.1584000    
 C    3.232800     -0.5076000     -0.4278000    
 C    1.298100       1.226900     -0.2893000    
 C  -0.1095000       1.533400      0.2398000    
 C    1.232500      -1.832400     -0.9635000    
 C   -2.541400      0.5422000      0.6687000    
 C    2.546200      -1.302500      -1.554300    
 C   -1.226700      -2.174600      0.8055000    
 C    2.397600      0.4740000       1.841500    
 C   -2.632000      -1.951100       1.344000    
 C   -3.276500     -0.8056000      0.6091000    
 C   -2.577300       1.069000       2.123000    
 C   -3.279900       1.587900     -0.1589000    
 C   -4.398400      -1.020300     -9.6600004E-02
 C   -4.395500       1.380500     -0.8652000    
 C    4.933100       1.475900      0.4031000    
 C    5.385800      -2.139900     -0.8929000    
 C   -5.028600      5.1800001E-02 -0.8904000    
 C    5.925300       2.591800      0.1361000    
 H    1.474100      -1.916000       1.150700    
 H  -0.3107000     -0.6339000       1.948500    
 H    1.210800       1.051300      -1.369200    
 H    1.901300       2.141100     -0.2112000    
 H  -3.9000001E-02   1.882100       1.275700    
 H   0.4074000      -1.601600      -1.642600    
 H    1.269300      -2.923900     -0.8669000    
 H    3.101300      -2.113900      -2.022900    
 H    2.278700     -0.6365000      -2.386700    
 H  -0.7486000      -2.976200       1.381600    
 H   -1.293700      -2.527300     -0.2311000    
 H    1.617100      0.1871000       2.555100    
 H    3.316600      3.7900001E-02   2.233600    
 H    2.467800       1.560900       1.947200    
 H   -2.603300      -1.742600       2.419300    
 H   -3.207000      -2.878200       1.229700    
 H   -3.607100       1.122900       2.499600    
 H   -2.017200      0.4379000       2.819000    
 H   -2.157900       2.079200       2.198600    
 H   -2.908400       2.608500     -0.1404000    
 H  -2.4400000E-02   3.377700     -0.4031000    
 H   -4.875200      -1.994500     -0.1298000    
 H   -4.872300       2.184000      -1.414700    
 H    4.121300       1.956400      0.9375000    
 H    5.421600      0.7405000       1.043900    
 H    6.213500      -2.719600     -0.4674000    
 H    5.862000      -1.318300      -1.427500    
 H    4.897600      -2.820200      -1.592300    
 H    6.809200       2.222700     -0.3952000    
 H    5.477600       3.399800     -0.4531000    
 H    6.266500       3.025000       1.082600    


%chk=000055320-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000055320

0 1
S 4.282626 1.087791 -1.112904
S 4.266337 -1.503421 0.693913
F -1.286210 0.055951 -1.294702
O -0.773590 2.699837 -0.464599
O -6.349655 -0.046416 -1.326739
C 1.945544 0.115897 0.455326
C 1.052750 -1.166808 0.347133
C -0.419579 -0.945897 0.793708
C -1.131790 0.292852 0.177898
C 3.206181 -0.314714 -0.391096
C 1.207785 1.281429 -0.263429
C -0.219213 1.549572 0.265932
C 1.274607 -1.712753 -1.101806
C -2.625206 0.468834 0.717941
C 2.606914 -1.077452 -1.605246
C -1.250031 -2.238330 0.619823
C 2.254812 0.507452 1.919031
C -2.666444 -2.079042 1.221262
C -3.352703 -0.879711 0.602503
C -2.592922 0.905070 2.229666
C -3.368409 1.586387 -0.005551
C -4.545757 -1.010532 -0.052273
C -4.561734 1.424878 -0.642234
C 5.186959 1.803348 0.396963
C 5.498671 -2.128820 -0.581270
C -5.234840 0.110460 -0.724967
C 6.556770 2.346366 -0.037328
H 1.469094 -1.914451 1.051249
H -0.376625 -0.732233 1.883999
H 1.128871 1.072578 -1.346197
H 1.782977 2.218153 -0.164583
H -0.183704 1.892271 1.313723
H 0.440525 -1.436513 -1.766737
H 1.338675 -2.814262 -1.091404
H 3.313119 -1.823641 -2.001904
H 2.413460 -0.362194 -2.427186
H -0.720026 -3.076115 1.111925
H -1.334443 -2.483443 -0.454320
H 1.325374 0.707641 2.483524
H 2.795271 -0.293738 2.452439
H 2.869586 1.422669 1.966354
H -2.577151 -1.954796 2.320657
H -3.265810 -2.989983 1.046981
H -3.625415 0.937637 2.616914
H -2.013898 0.208354 2.860032
H -2.162798 1.915952 2.335053
H -2.906124 2.575967 0.061557
H -0.913618 2.414259 -1.405224
H -5.046761 -1.985020 -0.111228
H -5.079317 2.271318 -1.108744
H 4.559724 2.598067 0.835090
H 5.287806 0.969362 1.114313
H 6.388835 -2.451531 -0.018839
H 5.761466 -1.291887 -1.250337
H 5.088833 -2.976159 -1.151633
H 7.190304 1.539859 -0.446197
H 6.460260 3.131380 -0.809014
H 7.078635 2.790372 0.831379


