%chk=000072019.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072019

0 1
 S   -2.610900      0.2947000      0.8849000    
 F   -8.191800      0.1598000     -0.9452000    
 O   -1.775600     -0.4402000     -0.3165000    
 O   -2.250200       1.698700      0.9291000    
 O   -2.541900     -0.5489000       2.063600    
 O    7.474900       1.176000      3.3399999E-02
 O    6.683100     -0.9631000     -9.7599998E-02
 N    2.871700       1.088500     -0.1023000    
 N    3.710800     -0.9680000     -0.1841000    
 N    5.238300      0.8904000     -4.4700000E-02
 C    1.786800      0.2531000     -0.1772000    
 C    2.336700      -1.024700     -0.2271000    
 C  -0.4238000     -0.6193000     -0.2871000    
 C   0.4134000      0.4981000     -0.2047000    
 C    1.480700      -2.135900     -0.3096000    
 C    3.997200      0.3125000     -0.1095000    
 C   9.8200001E-02  -1.913800     -0.3385000    
 C   -4.289400      0.2541000      0.3341000    
 C   -5.084900     -0.8283000      0.6691000    
 C   -4.778400       1.305200     -0.4223000    
 C   -6.410000     -0.8604000      0.2344000    
 C   -6.103500       1.273100     -0.8569000    
 C   -6.919200      0.1903000     -0.5285000    
 C    6.474700      0.2425000     -4.2399999E-02
 C    8.813300      0.6654000      4.5600001E-02
 H   3.2400001E-02   1.511800     -0.1855000    
 H    2.844500       2.098100     -5.1100001E-02
 H    1.876600      -3.145600     -0.3499000    
 H  -0.5733000      -2.767000     -0.4015000    
 H   -4.705800      -1.660000       1.254700    
 H   -4.158600       2.153000     -0.6973000    
 H    5.258600       1.905800      7.7000000E-03
 H   -7.045000      -1.704000      0.4884000    
 H   -6.500100       2.090000      -1.452600    
 H    8.965800      2.5000000E-02  0.9195000    
 H    9.499700       1.514100      0.1083000    
 H    9.017100      0.1162000     -0.8785000    


%chk=000072019-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000072019

0 1
S -2.781135 -0.002045 1.284727
F -8.153348 0.607519 -1.363339
O -1.748030 -0.715863 -0.441169
O -2.176959 1.488526 1.593296
O -2.938224 -1.092674 2.492811
O 7.490053 1.340154 -0.125174
O 6.818417 -0.918291 -0.012611
N 2.884415 1.059760 -0.330091
N 3.797741 -1.031319 -0.066597
N 5.289578 0.910645 -0.189479
C 1.793206 0.168766 -0.290957
C 2.398583 -1.132723 -0.123745
C -0.397973 -0.819864 -0.302963
C 0.414133 0.359222 -0.384127
C 1.580444 -2.288964 -0.029034
C 4.047721 0.284382 -0.190332
C 0.192210 -2.120813 -0.099055
C -4.455387 0.193783 0.461363
C -5.385354 -0.850808 0.604422
C -4.706570 1.368925 -0.268316
C -6.646558 -0.708362 -0.013538
C -5.967650 1.511762 -0.886328
C -6.900129 0.466690 -0.745380
C 6.548172 0.290453 -0.097797
C 8.900404 0.902510 -0.036090
H -0.069279 1.332977 -0.501147
H 2.823031 2.071864 -0.427738
H 2.039217 -3.272310 0.104497
H -0.488865 -2.973364 -0.017868
H -5.136819 -1.736984 1.196167
H -3.949213 2.155544 -0.333018
H 5.327618 1.929897 -0.254897
H -7.414109 -1.482737 0.065542
H -6.225939 2.403973 -1.462861
H 9.076483 0.374714 0.916088
H 9.485966 1.830795 -0.087060
H 9.146251 0.231462 -0.876000


