%chk=000106192.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000106192

0 1
 S  -4.2700000E-02 -6.8499997E-02  0.2706000    
 P   -5.430500     -0.4404000      0.6173000    
 F   0.7277000      0.2374000      -2.182500    
 F    1.684500       1.571200     -0.7623000    
 F    3.297200     -0.2637000      -1.862400    
 F    1.994700      -1.895200      -1.261500    
 F    4.209400      -1.731600      0.1598000    
 F    2.443700      -1.364300       1.367200    
 F    4.543400      0.1440000       2.090900    
 F    4.779000      0.9286000      7.0000000E-02
 F    2.988500       1.394200       1.226800    
 O   0.3087000      0.5780000       1.521200    
 O  -0.3010000      -1.495700      0.2356000    
 O   -4.136400      0.1787000     -0.1284000    
 O   -6.205100      -1.198700     -0.5828000    
 O   -4.824400      -1.655900       1.495100    
 O   -6.259500      0.5509000       1.380200    
 N   -1.386200      0.7592000     -0.4068000    
 C    1.244600      0.2960000     -0.9218000    
 C    2.429000     -0.6587000     -0.8845000    
 C   -2.156800      8.8699996E-02  -1.482000    
 C   -1.302300       2.226700     -0.6043000    
 C    3.224100     -0.8181000      0.4018000    
 C   -3.301400     -0.6997000     -0.8721000    
 C    3.882600      0.4259000      0.9450000    
 C   -2.410800       2.911200      0.1698000    
 H   -2.570900      0.8260000      -2.179300    
 H   -1.513100     -0.5730000      -2.069500    
 H  -0.3514000       2.603700     -0.2151000    
 H   -1.328600       2.499200      -1.664300    
 H   -2.924900      -1.484000     -0.2092000    
 H   -3.885400      -1.170400      -1.669000    
 H   -3.392300       2.675400     -0.2514000    
 H   -2.409700       2.605100       1.221200    
 H   -2.285800       3.997900      0.1296000    
 H   -7.087700      -1.588600     -0.4062000    
 H   -5.421600      -2.152300       2.094300    


%chk=000106192-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000106192

0 1
S -0.058848 0.037091 0.521181
P -5.924989 -0.399104 0.243068
F 0.865340 0.646720 -2.095753
F 2.060985 1.736108 -0.487136
F 3.557577 -0.105170 -2.113522
F 2.081296 -1.744380 -1.519975
F 4.480997 -1.916256 -0.271656
F 2.744812 -1.491599 1.159876
F 5.400480 -0.384925 1.681000
F 5.085005 1.009264 -0.079587
F 3.626195 1.019945 1.663818
O 0.338448 0.865978 1.847439
O -0.312667 -1.560579 0.499813
O -4.460323 0.120195 -0.461056
O -6.247483 -1.749123 -0.761369
O -5.521797 -1.254308 1.695212
O -6.988387 0.757246 0.401700
N -1.520130 0.801780 -0.227194
C 1.556799 0.487575 -0.874381
C 2.687457 -0.546636 -1.070866
C -2.187204 -0.026701 -1.264210
C -1.474702 2.287875 -0.341704
C 3.580491 -0.923148 0.170629
C -3.356498 -0.846894 -0.718612
C 4.432153 0.206234 0.864110
C -2.844327 2.901383 0.002817
H -2.545637 0.651465 -2.059812
H -1.472199 -0.734680 -1.726264
H -0.717822 2.654710 0.375514
H -1.155146 2.579455 -1.363300
H -3.079084 -1.368045 0.213958
H -3.697951 -1.578225 -1.473460
H -3.647712 2.495413 -0.632593
H -3.108534 2.694250 1.052736
H -2.792601 3.995978 -0.143080
H -6.959399 -2.362505 -0.451456
H -5.595992 -0.717189 2.525115


