%chk=000091396.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091396

0 1
 S    5.048700      -3.028900     -0.2455000    
 S   -5.057000      -3.015800     -0.2458000    
 O   7.9999998E-04  0.9856000       1.713300    
 O  -3.3000000E-03  -2.414700     -0.5336000    
 O   3.5000001E-03   3.123900       2.600200    
 C   3.0000001E-04  0.3559000      0.3926000    
 C   2.3000001E-03   1.548400     -0.5088000    
 C    1.257900     -0.4812000      0.2676000    
 C   -1.259600     -0.4776000      0.2669000    
 C   3.7000000E-03   2.707000      0.2469000    
 C    1.178200      -1.797500     -0.2010000    
 C   -1.183200      -1.794400     -0.2012000    
 C   2.4999999E-03   2.356200       1.658900    
 C   2.9000000E-03   1.619400      -1.893100    
 C    2.525900      3.8699999E-02  0.5826000    
 C   -2.526300      4.5899998E-02  0.5811000    
 C   6.0000001E-03   3.968900     -0.3185000    
 C    2.332400      -2.571400     -0.3617000    
 C   -2.339500      -2.565400     -0.3615000    
 C   5.2000000E-03   2.881600      -2.494000    
 C    3.677000     -0.7359000      0.4290000    
 C   -3.679500     -0.7258000      0.4277000    
 C   6.8999999E-03   4.048600      -1.711300    
 C    3.580300      -2.040400     -4.5100000E-02
 C   -3.586100      -2.031000     -4.5499999E-02
 H   1.7000000E-03  0.7220000      -2.502700    
 H    2.631800       1.057600      0.9464000    
 H   -2.629700       1.065300      0.9444000    
 H   7.3000002E-03   4.867000      0.2885000    
 H    2.238900      -3.590400     -0.7318000    
 H   -2.253000      -3.585400     -0.7308000    
 H   5.7000001E-03   2.962600      -3.577600    
 H    4.640600     -0.3002000      0.6816000    
 H   -4.639800     -0.2836000      0.6810000    
 H   8.7000001E-03   5.020600      -2.197000    
 H    4.453700      -4.129900     -0.7277000    
 H   -5.941100      -2.093700      0.1631000    


%chk=000091396-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000091396

0 1
S 5.180960 -3.052076 -0.267091
S -5.123822 -3.150566 -0.111379
O 0.028422 0.801368 1.763707
O -0.010812 -2.656149 0.123932
O 0.047285 2.857232 2.878624
C 0.004280 0.306324 0.279202
C -0.002495 1.628251 -0.487524
C 1.253372 -0.526353 0.076853
C -1.257824 -0.515923 0.115913
C 0.013277 2.717948 0.404695
C 1.198724 -1.939917 0.057428
C -1.216527 -1.931198 0.092560
C 0.031719 2.220583 1.809112
C -0.020642 1.841633 -1.877709
C 2.535983 0.072785 -0.018757
C -2.536222 0.094028 0.063311
C 0.011270 4.052357 -0.048952
C 2.357218 -2.738138 -0.044544
C -2.383569 -2.718602 0.028221
C -0.022820 3.177656 -2.347353
C 3.705755 -0.695797 -0.120900
C -3.716113 -0.664658 -0.005277
C -0.007109 4.274245 -1.444185
C 3.615759 -2.114642 -0.128827
C -3.639711 -2.082792 -0.017418
H -0.032054 1.000456 -2.578587
H 2.615680 1.164862 0.000909
H -2.605309 1.186803 0.086767
H 0.024274 4.878316 0.669478
H 2.236073 -3.825601 -0.056802
H -2.283054 -3.807456 0.018668
H -0.036206 3.370260 -3.425782
H 4.681727 -0.204928 -0.183918
H -4.686034 -0.157447 -0.042079
H -0.008680 5.296767 -1.836404
H 4.628020 -4.316116 -0.160935
H -6.055994 -2.131514 -0.027358


