%chk=000036106.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000036106

0 1
 S    1.007000      8.5100003E-02  -2.396300    
 P    1.144600      3.3000000E-03 -0.4525000    
 O    2.436400     -0.7948000      0.1360000    
 O    1.263400       1.415200      0.3473000    
 O  -6.3000001E-02 -0.7335000      0.3394000    
 C   -1.398800     -0.4563000      0.2267000    
 C    2.543100      -2.196600     -4.6999998E-02
 C    2.232500       2.370300     -4.9800001E-02
 C   -1.811300      0.8357000     -8.2599998E-02
 C   -2.332100      -1.468800      0.4231000    
 C    3.827500      -2.680800      0.5918000    
 C    2.129800       3.581500      0.8524000    
 C   -3.172500       1.118300     -0.1967000    
 C   -3.693200      -1.186100      0.3090000    
 C   -4.113300      0.1075000     -8.9999998E-04
 H    1.685100      -2.692100      0.4172000    
 H    2.548200      -2.427900      -1.116100    
 H    3.229700       1.925200      2.3000000E-02
 H    2.052600       2.672200      -1.085400    
 H   -1.110800       1.648400     -0.2336000    
 H   -2.009000      -2.477500      0.6645000    
 H    3.941800      -3.761500      0.4692000    
 H    4.692900      -2.180700      0.1445000    
 H    3.839900      -2.442900       1.660600    
 H    2.865500       4.340700      0.5730000    
 H    1.128400       4.021000      0.7950000    
 H    2.293400       3.298400       1.897400    
 H   -3.500200       2.125700     -0.4362000    
 H   -4.426000      -1.973100      0.4614000    
 H   -5.173200      0.3276000     -8.9299999E-02


%chk=000036106-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000036106

0 1
S 1.010245 -0.157705 -2.375669
P 1.122808 -0.104631 -0.317505
O 2.409338 -0.967323 0.433512
O 1.297644 1.431395 0.445663
O -0.208612 -0.744235 0.607633
C -1.565625 -0.394365 0.346185
C 2.726570 -2.346518 -0.050301
C 2.370871 2.348830 -0.053395
C -1.978040 0.954510 0.274152
C -2.486693 -1.457014 0.238104
C 4.053813 -2.727189 0.597508
C 2.110257 3.701716 0.600924
C -3.349135 1.235668 0.084307
C -3.856295 -1.158872 0.061675
C -4.290769 0.185013 -0.020305
H 1.907166 -3.019575 0.263056
H 2.788247 -2.333118 -1.155707
H 3.348437 1.927402 0.244461
H 2.312572 2.401577 -1.157923
H -1.238527 1.755404 0.376095
H -2.125962 -2.488325 0.295693
H 4.334703 -3.753211 0.295795
H 4.855271 -2.037482 0.283177
H 3.973845 -2.695912 1.697118
H 2.891701 4.420788 0.292873
H 1.127844 4.101465 0.297437
H 2.130493 3.613338 1.700152
H -3.681117 2.277988 0.024362
H -4.580044 -1.977192 -0.019389
H -5.352607 0.411071 -0.164589


