%chk=000022251.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000022251

0 1
 S   0.2922000       1.214400      0.2358000    
 C  -0.6377000     -0.1976000     -0.4676000    
 C  -7.7600002E-02  -1.518900      6.5399997E-02
 C    1.327000      -1.783700     -0.4706000    
 C    2.331800     -0.7018000     -0.1673000    
 C   -2.122900     -3.1500001E-02 -0.2062000    
 C    1.978000      0.6253000      0.1278000    
 C    3.695200      -1.044200     -0.2354000    
 C    2.989600       1.568200      0.3782000    
 C   -2.905900      0.7127000      -1.087600    
 C   -2.702700     -0.6230000      0.9152000    
 C    4.689300     -9.8600000E-02  9.6000005E-03
 C    4.335800       1.208300      0.3195000    
 C   -4.271400      0.8658000     -0.8471000    
 C   -4.068200     -0.4700000       1.155700    
 C   -4.852500      0.2744000      0.2746000    
 H  -0.4863000     -0.1781000      -1.555200    
 H  -0.7185000      -2.354900     -0.2443000    
 H  -4.4399999E-02  -1.533500       1.162900    
 H    1.284700      -1.916300      -1.559200    
 H    1.676100      -2.732200     -4.2800002E-02
 H    3.990200      -2.062200     -0.4813000    
 H    2.742200       2.600300      0.6193000    
 H   -2.465800       1.179100      -1.965000    
 H   -2.127400      -1.194800       1.635300    
 H    5.735900     -0.3831000     -4.3000001E-02
 H    5.105400       1.949800      0.5128000    
 H   -4.882100       1.445800      -1.532900    
 H   -4.520600     -0.9268000       2.031200    
 H   -5.915400      0.3945000      0.4624000    


%chk=000022251-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000022251

0 1
S 0.323562 1.292131 0.142573
C -0.687114 -0.116082 -0.687661
C -0.077895 -1.487680 -0.328181
C 1.353283 -1.659756 -0.877211
C 2.376377 -0.692446 -0.292833
C -2.139775 0.034397 -0.269195
C 2.031249 0.608013 0.163331
C 3.736494 -1.087445 -0.209396
C 3.025349 1.474436 0.686470
C -3.143879 0.214024 -1.253536
C -2.524458 -0.039848 1.095475
C 4.733168 -0.230670 0.302598
C 4.370914 1.059874 0.754743
C -4.506877 0.302937 -0.887960
C -3.883875 0.050366 1.462597
C -4.880888 0.219324 0.472037
H -0.593821 0.046632 -1.776294
H -0.732553 -2.268589 -0.762827
H -0.091045 -1.624198 0.769423
H 1.322286 -1.540083 -1.981307
H 1.693017 -2.695697 -0.690338
H 4.009395 -2.092712 -0.555451
H 2.742999 2.474226 1.036114
H -2.856895 0.284806 -2.310128
H -1.753309 -0.144422 1.867228
H 5.775150 -0.564247 0.352737
H 5.128267 1.740503 1.159054
H -5.271296 0.442017 -1.660652
H -4.167951 -0.004380 2.519620
H -5.935877 0.291969 0.759170


