%chk=000138968.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000138968

0 1
 S    3.671500     -0.3826000      0.4306000    
 C   -2.350600      9.2299998E-02 -8.8500001E-02
 C  -0.8234000     -2.8300000E-02  4.3800000E-02
 C   -3.035600     -0.8024000      0.9672000    
 C   -2.787600     -0.3605000      -1.498500    
 C   -2.884300       1.528500      0.1151000    
 C  -0.2512000      -1.264500     -0.1212000    
 C  -0.1023000       1.106200      0.3198000    
 C    1.134200      -1.373800     -2.0000001E-03
 C    1.283200      0.9971000      0.4390000    
 C    1.901600     -0.2430000      0.2780000    
 C    4.244500      0.7310000     -0.8834000    
 H   -4.126400     -0.7010000      0.9220000    
 H   -2.809600      -1.864800      0.8252000    
 H   -2.718000     -0.5305000       1.980900    
 H   -2.556800      -1.414100      -1.689700    
 H   -3.869300     -0.2428000      -1.633000    
 H   -2.289500      0.2320000      -2.275200    
 H   -3.976100       1.555900      9.7000003E-03
 H   -2.657900       1.912500       1.116800    
 H   -2.481400       2.225600     -0.6291000    
 H  -0.8276000      -2.157000     -0.3394000    
 H  -0.5293000       2.091400      0.4557000    
 H    1.598500      -2.348500     -0.1309000    
 H    1.860700       1.890100      0.6647000    
 H    3.809700      0.4412000      -1.843800    
 H    5.333100      0.6651000     -0.9585000    
 H    3.974900       1.766100     -0.6591000    


%chk=000138968-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000138968

0 1
S 3.786658 -0.010546 0.672498
C -2.426628 0.109511 -0.089497
C -0.890287 0.114620 0.095397
C -3.056757 -0.934910 0.881618
C -2.768368 -0.281994 -1.559218
C -3.062075 1.492496 0.205483
C -0.146456 -1.074483 -0.145354
C -0.168394 1.263478 0.509478
C 1.253726 -1.116758 0.016957
C 1.236943 1.232585 0.672213
C 1.954869 0.043375 0.422605
C 4.347144 0.348921 -1.100671
H -4.155935 -0.956106 0.758244
H -2.674420 -1.953598 0.690375
H -2.830477 -0.680438 1.933234
H -2.376317 -1.281984 -1.816920
H -3.864997 -0.299790 -1.704087
H -2.335909 0.445328 -2.270518
H -4.156077 1.435329 0.057433
H -2.882393 1.812358 1.248537
H -2.673397 2.275469 -0.471852
H -0.664608 -1.988115 -0.459295
H -0.695743 2.200042 0.712926
H 1.804909 -2.046674 -0.159980
H 1.775599 2.129003 0.997954
H 3.967990 -0.429595 -1.780171
H 5.448658 0.332920 -1.086741
H 3.987743 1.340756 -1.414448


