%chk=000001704.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001704

0 1
 S   -1.464000      -1.168200       1.005600    
 P    5.157600      0.4511000     -0.2548000    
 O    5.076000      7.9999998E-04  -1.798300    
 O    6.429000     -0.3531000      0.3187000    
 O    5.135700       1.916700      4.3000001E-03
 O   -1.431700      -2.567300      0.4715000    
 O   -2.952200       1.353500       1.876300    
 C    2.406700      2.9200001E-02 -1.4400000E-02
 C    1.255700     -0.7044000      0.6819000    
 C    3.768900     -0.4368000      0.4844000    
 C  -0.1172000     -0.2569000      0.1913000    
 C   -2.827400     -0.3347000      0.1688000    
 C   -3.398100      0.8155000      0.7058000    
 C   -3.301500     -0.8643000      -1.028100    
 C   -4.451900       1.441800      4.0100001E-02
 C   -4.355200     -0.2380000      -1.693600    
 C   -4.930400      0.9149000      -1.159500    
 H    2.344400     -0.1253000      -1.097800    
 H    2.310400       1.108400      0.1530000    
 H    1.369500      -1.783800      0.5196000    
 H    1.326100     -0.5447000       1.765400    
 H    3.892700      -1.506000      0.2786000    
 H    3.831500     -0.3060000       1.570500    
 H  -0.2008000     -0.4125000     -0.8897000    
 H  -0.2550000      0.8096000      0.3985000    
 H   -2.868200      -1.757300      -1.469900    
 H    5.719700      0.3713000      -2.439000    
 H    7.331900     -5.0400000E-02  8.3200000E-02
 H   -4.904800       2.340300      0.4502000    
 H   -4.727100     -0.6470000      -2.628600    
 H   -5.750600       1.402800      -1.678000    
 H   -2.225700      0.8327000       2.250600    


%chk=000001704-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001704

0 1
S -1.481505 -1.117492 1.201350
P 5.241304 0.333853 -0.323586
O 4.897370 0.185232 -2.020300
O 6.514482 -0.799857 0.000877
O 5.570255 1.829184 0.128471
O -1.208604 -2.578638 0.426462
O -3.176127 1.552667 1.814819
C 2.452533 0.120439 0.103037
C 1.290534 -0.626815 0.804417
C 3.796572 -0.583252 0.384584
C -0.055851 0.025653 0.489185
C -2.886445 -0.311341 0.193060
C -3.522773 0.871238 0.630768
C -3.272568 -0.973946 -0.982532
C -4.543692 1.433563 -0.170259
C -4.298173 -0.415127 -1.776886
C -4.919634 0.791334 -1.369373
H 2.276345 0.146611 -0.988613
H 2.495645 1.170470 0.452904
H 1.257118 -1.679125 0.459026
H 1.466096 -0.642263 1.898732
H 3.824343 -1.595728 -0.053260
H 3.992944 -0.671080 1.467772
H -0.266324 0.067990 -0.592043
H -0.206046 1.015182 0.954506
H -2.760319 -1.911562 -1.237922
H 5.341531 0.865719 -2.587127
H 7.420786 -0.399918 0.027331
H -5.029291 2.353489 0.168806
H -4.611979 -0.914315 -2.698937
H -5.714709 1.229621 -1.982340
H -2.689818 0.960114 2.443669


