%chk=000090984.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090984

0 1
 S   -2.676900      0.5320000     -0.9226000    
 C    1.300800     -0.3307000     -7.1000002E-02
 C  -1.3000000E-03 -0.1598000     -0.9290000    
 C    1.036700       1.149900      0.3530000    
 C   0.4904000       1.319900      -1.089100    
 C   -1.293400     -0.3505000     -0.1052000    
 C  -7.1599998E-02   1.347900       1.393700    
 C   -1.079400      0.1913000       1.328100    
 C    2.553100     -0.5038000     -0.9279000    
 C    1.403800      -1.357600       1.033300    
 C   -1.662200      -1.838800     -6.3299999E-02
 H  -1.3500000E-02 -0.7142000      -1.875800    
 H    1.921800       1.757100      0.5700000    
 H  -0.2774000       2.091100      -1.209100    
 H    1.224800       1.520900      -1.874600    
 H  -0.5750000       2.308000       1.229600    
 H   0.3603000       1.386900       2.400300    
 H  -0.8528000     -0.6013000       2.042300    
 H   -2.030300      0.5639000       1.737500    
 H    2.586400      9.2900001E-02  -1.842000    
 H    3.454900     -0.2523000     -0.3567000    
 H    2.651300      -1.546900      -1.254100    
 H    1.159100      -2.361000      0.6729000    
 H    2.445500      -1.425200       1.379900    
 H   0.8749000      -1.164300       1.958000    
 H   -1.760400      -2.257400      -1.072400    
 H  -0.9209000      -2.448300      0.4547000    
 H   -2.611100      -2.000400      0.4628000    
 H   -3.627900      0.1946000     -3.9000001E-02


%chk=000090984-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000090984

0 1
S -2.668765 0.491499 -1.188469
C 1.354892 -0.345728 -0.059513
C 0.018080 -0.180110 -0.926150
C 1.111884 1.164020 0.345616
C 0.359092 1.353323 -1.013383
C -1.277634 -0.363980 -0.097102
C 0.074606 1.291076 1.485290
C -1.170721 0.349058 1.297750
C 2.577185 -0.508248 -0.997782
C 1.494984 -1.396827 1.059843
C -1.685277 -1.846133 0.038221
H -0.039189 -0.755551 -1.867022
H 2.005412 1.783569 0.542598
H -0.493582 2.051509 -1.011210
H 1.022333 1.597309 -1.857690
H -0.255109 2.346952 1.529142
H 0.553032 1.067698 2.458754
H -1.143775 -0.441372 2.072086
H -2.095301 0.920629 1.485789
H 2.573340 0.205658 -1.838559
H 3.517020 -0.357291 -0.432502
H 2.602186 -1.529137 -1.424880
H 1.503827 -2.421925 0.641695
H 2.461193 -1.249489 1.581257
H 0.701276 -1.346639 1.821372
H -1.838241 -2.300904 -0.956036
H -0.901949 -2.418009 0.566775
H -2.624379 -1.952091 0.613657
H -3.726719 -0.064964 -0.485247


