%chk=000036970.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000036970

0 1
 S   -2.921800      0.7191000       1.193500    
 F    1.948600      0.3838000      -2.344600    
 F    2.696800       1.820300     -0.8891000    
 F    3.149600     -0.2905000     -0.6622000    
 F    2.056700     -7.2200000E-02   1.860400    
 F    1.709000       2.027400       1.391000    
 F   5.3500000E-02  0.7671000       2.004300    
 O  -2.8899999E-02   1.352100     -0.6601000    
 O   -1.649600      -2.510000      0.2256000    
 C   0.2870000      -1.061400     -0.2933000    
 C   0.9178000      0.3838000     -0.1859000    
 C   -1.095500      -1.207800      0.4414000    
 C    1.260600      -2.184500      0.1665000    
 C    2.180100      0.5813000      -1.029200    
 C    1.193800      0.7876000       1.272700    
 C   -2.181100     -0.2459000      1.1500000E-02
 C   0.6864000      -3.586000     -1.7500000E-02
 C   -2.656900     -4.8599999E-02  -1.243900    
 C   -3.681100      0.9419000      -1.250600    
 C   -3.925100       1.442400      9.3999999E-03
 H   9.0400003E-02  -1.239400      -1.361200    
 H  -0.9293000      -1.154600       1.522000    
 H    1.538500      -2.075000       1.217300    
 H    2.176000      -2.150400     -0.4277000    
 H   4.0800001E-02  -3.886700      0.8119000    
 H   0.1822000      -3.709700     -0.9803000    
 H    1.514200      -4.306200     -6.3999998E-03
 H  -0.1464000       1.205200      -1.614500    
 H   -1.787400      -2.627700     -0.7301000    
 H   -2.308100     -0.5715000      -2.125000    
 H   -4.211800       1.270700      -2.134500    
 H   -4.644400       2.198400      0.2911000    


%chk=000036970-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000036970

0 1
S -3.536092 0.701880 0.901938
F 1.022244 0.682205 -2.369803
F 2.721782 1.648893 -1.220644
F 2.689230 -0.593362 -1.529489
F 3.120322 -0.139146 1.242398
F 2.215879 1.894085 1.577311
F 1.221496 0.078238 2.471165
O 0.142705 1.552052 0.079780
O -1.697177 -2.226314 1.068952
C 0.226349 -0.997643 -0.019846
C 1.002297 0.383643 0.044240
C -1.150367 -0.892446 0.738357
C 1.054558 -2.234848 0.456730
C 1.881103 0.531485 -1.249608
C 1.892739 0.560843 1.323315
C -2.190985 -0.089913 -0.018662
C 0.802949 -3.486456 -0.411166
C -2.406390 0.036891 -1.394988
C -3.602864 0.764271 -1.736898
C -4.319915 1.188906 -0.629465
H 0.009005 -1.155978 -1.094800
H -0.969926 -0.450917 1.732393
H 0.803796 -2.452003 1.509430
H 2.132674 -2.011727 0.416119
H -0.255078 -3.799057 -0.382932
H 1.090756 -3.305482 -1.464153
H 1.406724 -4.334676 -0.041509
H -0.756434 1.318753 -0.292592
H -2.155204 -2.589072 0.267145
H -1.728742 -0.365883 -2.152758
H -3.910026 0.970391 -2.764399
H -5.242806 1.765387 -0.593060


