%chk=000080431.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080431

0 1
 S    2.038900     -9.9999997E-05  0.5673000    
 C  -0.5461000     -9.9999997E-05 -0.3968000    
 C   0.8799000       0.000000     -0.8344000    
 C   -1.212600       1.207900     -0.1920000    
 C   -1.212800      -1.208000     -0.1920000    
 C    3.582200      9.9999997E-05 -0.3724000    
 C   -2.546100       1.208000      0.2173000    
 C   -2.546300      -1.207900      0.2173000    
 C   -3.213000      9.9999997E-05  0.4219000    
 C    4.775900       0.000000      0.5636000    
 H    1.077500     -0.8788000      -1.459300    
 H    1.077400      0.8790000      -1.459100    
 H    3.617900     -0.8880000      -1.011200    
 H    3.617800      0.8883000      -1.010900    
 H  -0.7047000       2.156300     -0.3467000    
 H  -0.7051000      -2.156300     -0.3468000    
 H   -3.065200       2.148600      0.3771000    
 H   -3.065500      -2.148400      0.3770000    
 H    4.786100      0.8892000       1.203200    
 H    4.786100     -0.8894000       1.203000    
 H    5.704600       0.000000     -1.6899999E-02
 H   -4.251300      9.9999997E-05  0.7408000    


%chk=000080431-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000080431

0 1
S 2.045519 -0.000009 0.563532
C -0.580893 0.000104 -0.451310
C 0.852300 0.000132 -0.932404
C -1.264277 1.221281 -0.214398
C -1.264239 -1.221110 -0.214481
C 3.686689 -0.000060 -0.393131
C -2.600896 1.222946 0.242724
C -2.600858 -1.222850 0.242641
C -3.274359 0.000030 0.471522
C 4.856025 -0.000089 0.604354
H 1.079091 -0.900615 -1.529075
H 1.079111 0.900969 -1.528930
H 3.708345 -0.899088 -1.035577
H 3.708399 0.898970 -1.035580
H -0.741262 2.170345 -0.384883
H -0.741193 -2.170153 -0.385020
H -3.115940 2.174203 0.419173
H -3.115874 -2.174134 0.419031
H 4.825780 0.894124 1.252317
H 4.825730 -0.894288 1.252331
H 5.820485 -0.000115 0.063048
H -4.312083 0.000007 0.824115


