%chk=000014159.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014159

0 1
 S   -2.819700       1.380500       1.507900    
 O   -1.783500      -3.271300      -1.462500    
 O   2.9500000E-02  -3.579800     -0.1315000    
 C  -0.8205000      -1.307900     -0.4942000    
 C   0.3201000     -0.7923000      0.3283000    
 C   -2.218100     -0.8700000      2.8899999E-02
 C    1.316200      3.4899998E-02 -0.2156000    
 C    2.368800      0.4887000      0.6147000    
 C   0.3611000      -1.166800       1.671600    
 C   -2.400600      0.6300000      4.4799998E-02
 C  -0.7903000      -2.832200     -0.6450000    
 C    1.290800      0.4218000      -1.565400    
 C    2.394200      0.1014000       1.964400    
 C    1.396200     -0.7210000       2.488100    
 C    3.364900       1.316100      7.0699997E-02
 C   -2.268700       1.488600     -0.9991000    
 C    2.288800       1.243900      -2.089200    
 C    3.323800       1.690300      -1.272800    
 C   -2.520900       2.830500     -0.5917000    
 C   -2.832200       2.914700      0.7475000    
 H  -0.7729000     -0.9705000      -1.528900    
 H   -2.407800      -1.305400       1.018500    
 H   -3.004500      -1.280900     -0.6189000    
 H  -0.3999000      -1.810300       2.104900    
 H   0.5304000      0.1235000      -2.275400    
 H    3.193800      0.4379000       2.621100    
 H    1.428400      -1.013800       3.533500    
 H    4.183200       1.676700      0.6903000    
 H   -2.011800       1.196200      -2.008800    
 H    2.259000       1.536200      -3.134900    
 H    4.100400       2.330400      -1.681300    
 H   -2.477100       3.690000      -1.247700    
 H   -3.066400       3.803900       1.315800    
 H   -1.760400      -4.245600      -1.574300    


%chk=000014159-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000014159

0 1
S -1.738381 1.827918 1.243029
O -0.380122 -3.358218 -1.678784
O -1.522684 -3.611944 0.325110
C -0.930491 -1.335070 -0.476703
C 0.300645 -0.910430 0.343738
C -2.277127 -0.781406 0.108947
C 1.286086 0.011391 -0.177882
C 2.413373 0.373806 0.666450
C 0.449152 -1.422796 1.641244
C -2.415496 0.712255 -0.013245
C -0.997363 -2.858083 -0.525166
C 1.212020 0.604159 -1.484439
C 2.522343 -0.176890 1.984398
C 1.554869 -1.058394 2.464951
C 3.404121 1.285793 0.171548
C -3.025556 1.442703 -1.025522
C 2.190782 1.491116 -1.937748
C 3.301296 1.836090 -1.105866
C -2.972351 2.873886 -0.840921
C -2.322700 3.251983 0.322473
H -0.831773 -0.988369 -1.515962
H -2.367900 -1.117946 1.156600
H -3.112675 -1.251880 -0.443667
H -0.293907 -2.129794 2.028980
H 0.371117 0.371094 -2.144310
H 3.378157 0.107809 2.607953
H 1.637729 -1.478969 3.472762
H 4.247665 1.545557 0.822552
H -3.513247 0.963756 -1.879703
H 2.107202 1.929593 -2.938193
H 4.062972 2.532072 -1.473891
H -3.405151 3.591606 -1.542138
H -2.136429 4.250216 0.714400
H -0.401877 -4.354215 -1.657190


