%chk=000084077.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000084077

0 1
 S    2.539200      -4.995200     -0.5251000    
 F    3.605300       3.528100       1.459500    
 F    5.383300       2.581000      0.6030000    
 F    4.211900       3.979600     -0.5781000    
 O   -2.760100      -1.638400       1.281500    
 O   -5.006800     -8.3999999E-02   1.106000    
 O   -5.114600       2.009100     -0.6963000    
 O    3.614100       1.252100      -1.211400    
 O    2.456100      -3.151100       1.886900    
 N    2.107800       1.536800      0.5450000    
 C   0.8808000      0.9891000      1.6000000E-03
 C   0.6663000       1.575200      -1.412000    
 C  -0.5421000       1.060400      -2.205300    
 C   0.8377000     -0.5474000      9.4499998E-02
 C   -1.736900      0.7480000      -1.339500    
 C  -0.4397000      -1.150000     -0.3398000    
 C   -1.681300     -0.3281000     -0.4272000    
 C   -2.782500     -0.5968000      0.3987000    
 C   -2.897900       1.526800      -1.416300    
 C    1.843700      -1.254100      0.6468000    
 C  -0.5866000      -2.405900     -0.8054000    
 C    2.106200       1.777100       1.987600    
 C   -3.932500      0.1874000      0.3102000    
 C   -3.990500       1.244900     -0.5958000    
 C    3.262500       1.843700     -0.1868000    
 C    1.933900      -2.721000      0.8611000    
 C   0.4177000      -3.424300     -0.9808000    
 C    1.514700      -3.620900     -0.2414000    
 C    4.112800       2.972500      0.3301000    
 C   -2.267500      -1.363500       2.589500    
 C   -6.230400     -0.4093000      0.4511000    
 C   -5.193900       3.158300      0.1444000    
 C    3.669200      -4.279900      -1.736300    
 H   7.9000004E-02   1.388500      0.6398000    
 H   0.5650000       2.665200      -1.308300    
 H    1.525600       1.420900      -2.069500    
 H  -0.8067000       1.801000      -2.970800    
 H  -0.2672000      0.1580000      -2.767000    
 H   -2.952100       2.357700      -2.115700    
 H    2.722200     -0.7550000       1.045300    
 H   -1.563400      -2.732700      -1.165700    
 H    3.111000       1.693800       2.411800    
 H    1.492800       1.019800       2.488100    
 H    1.658000       2.754500       2.189400    
 H   0.1717000      -4.136200      -1.768400    
 H   -2.260700      -2.298800       3.155900    
 H   -1.246300     -0.9720000       2.552700    
 H   -2.921100     -0.6507000       3.102200    
 H   -6.751400      -1.152500       1.062000    
 H   -6.866900      0.4773000      0.3833000    
 H   -6.068000     -0.8396000     -0.5433000    
 H   -6.151200       3.652900     -4.1299999E-02
 H   -5.148200       2.869200       1.199100    
 H   -4.386200       3.859400     -8.8399999E-02
 H    4.408900      -5.030400      -2.027300    
 H    3.126500      -3.963400      -2.631400    
 H    4.195900      -3.420600      -1.311700    


%chk=000084077-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000084077

0 1
S 2.313830 -5.275098 -0.764785
F 3.613440 4.013925 1.408250
F 4.908288 2.160798 1.722620
F 5.241769 3.496074 -0.069568
O -2.673795 -1.521879 1.237990
O -4.980317 0.116718 1.206735
O -5.086318 2.337683 -0.657794
O 3.564655 1.859622 -1.333280
O 3.772710 -2.710827 0.159230
N 2.088987 1.696663 0.496822
C 0.927326 1.132864 -0.260026
C 0.680328 1.825852 -1.629918
C -0.559566 1.218119 -2.346503
C 0.919055 -0.413219 -0.358039
C -1.717894 0.945665 -1.401034
C -0.401540 -1.021551 -0.462165
C -1.618723 -0.139813 -0.472734
C -2.723160 -0.393739 0.398239
C -2.865804 1.764042 -1.416774
C 2.144966 -1.066205 -0.294600
C -0.630403 -2.399211 -0.594789
C 1.865781 1.750113 1.963405
C -3.887109 0.423661 0.358966
C -3.942311 1.524770 -0.536553
C 3.249071 2.090437 -0.132902
C 2.569776 -2.471647 -0.229637
C 0.267462 -3.500872 -0.709409
C 1.658985 -3.580663 -0.604620
C 4.249163 2.935381 0.727230
C -2.807112 -1.275165 2.693082
C -6.114183 -0.516241 0.485764
C -5.522631 3.038859 0.573792
C 4.059158 -5.087761 -1.457730
H 0.055664 1.402519 0.368969
H 0.519226 2.904275 -1.436659
H 1.562768 1.727202 -2.279648
H -0.874076 1.907692 -3.149379
H -0.253425 0.273316 -2.834337
H -2.947528 2.600592 -2.117790
H 3.027846 -0.426196 -0.180792
H -1.684943 -2.686389 -0.667153
H 2.798563 1.921490 2.514623
H 1.461765 0.774229 2.286551
H 1.144164 2.546446 2.219527
H -0.234408 -4.454895 -0.926388
H -2.760433 -2.272091 3.156391
H -1.961613 -0.656218 3.049943
H -3.768777 -0.784660 2.916490
H -6.894001 -0.679611 1.245099
H -6.485587 0.154774 -0.310131
H -5.795418 -1.482602 0.054397
H -6.439292 3.576466 0.288622
H -5.725816 2.321778 1.387595
H -4.746125 3.761025 0.889504
H 4.436666 -6.119531 -1.535199
H 4.014331 -4.621556 -2.453052
H 4.653668 -4.478906 -0.765649


