%chk=000092172.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000092172

0 1
 S  -0.5948000      -2.730900      0.7857000    
 S   0.3809000      -1.609300      -2.381900    
 P  -9.5299996E-02  -1.144500     -0.5387000    
 O   -1.285300     -2.7600000E-02 -0.4652000    
 O    1.121300     -0.3006000      0.1407000    
 C   -2.867500       1.449700      0.5178000    
 C    3.336000      0.1782000      0.8931000    
 C   -4.073400      0.8490000     -0.2270000    
 C    3.582300       1.419500      1.6600000E-02
 C   -1.700500      0.4921000      0.7869000    
 C    2.413100     -0.8915000      0.2971000    
 C   -4.736000     -0.2231000      0.6429000    
 C   -3.684100      0.2493000      -1.578300    
 C    2.273000       2.193300     -0.1626000    
 C    4.161300       1.060900      -1.352100    
 C  -0.5066000       1.164100       1.451100    
 C    2.275600      -2.128500       1.174000    
 H   -2.495600       2.288900     -8.6099997E-02
 H   -3.207800       1.881000       1.467800    
 H    2.926000      0.5108000       1.856100    
 H    4.309100     -0.2804000       1.111900    
 H   -4.796400       1.656200     -0.3983000    
 H    4.299100       2.065200      0.5391000    
 H   -2.051500     -0.3195000       1.429700    
 H    2.803300      -1.199100     -0.6768000    
 H   -4.995600      0.1771000       1.628600    
 H   -5.662400     -0.5715000      0.1731000    
 H   -4.093400      -1.097600      0.7859000    
 H   -3.241600     -0.7479000      -1.496000    
 H   -3.015700      0.9104000      -2.139200    
 H   -4.587500      0.1221000      -2.187500    
 H    1.854700       2.442100      0.8140000    
 H    2.496500       3.154800     -0.6430000    
 H    1.551600       1.706500     -0.8197000    
 H    3.442200      0.5265000      -1.980500    
 H    5.055600      0.4383000      -1.245400    
 H    4.451000       1.969800      -1.890800    
 H   0.1885000      0.4668000       1.918600    
 H  -0.8638000       1.784800       2.282700    
 H  -3.6400001E-02   1.839800      0.7467000    
 H    3.265600      -2.412000       1.553800    
 H    1.955500      -2.998100      0.5975000    
 H    1.650800      -1.950800       2.053200    
 H   -1.683300      -3.168500      0.1364000    


%chk=000092172-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000092172

0 1
S -1.013132 -2.667547 1.143276
S 0.366858 -1.737182 -2.213219
P -0.051046 -1.096360 -0.299915
O -1.104321 0.262902 -0.282235
O 1.263741 -0.546831 0.686697
C -3.050205 1.551460 0.389480
C 3.623756 0.075316 0.799864
C -4.176375 0.819096 -0.396818
C 3.678232 1.314756 -0.141720
C -1.877550 0.716479 0.934139
C 2.660375 -1.067889 0.438286
C -4.747427 -0.392868 0.380049
C -3.767693 0.419225 -1.835553
C 2.465836 2.265231 0.013777
C 3.886975 0.923052 -1.625410
C -0.961195 1.518696 1.868495
C 2.870947 -2.327044 1.289911
H -2.629702 2.363890 -0.235621
H -3.505064 2.039343 1.277276
H 3.399092 0.402900 1.834666
H 4.634113 -0.384478 0.827981
H -4.996790 1.563661 -0.489245
H 4.577753 1.883765 0.179468
H -2.242810 -0.196183 1.444879
H 2.730749 -1.316410 -0.638869
H -5.039314 -0.117021 1.411669
H -5.643935 -0.791206 -0.129891
H -4.011702 -1.216873 0.443704
H -2.966261 -0.338115 -1.834845
H -3.389771 1.292465 -2.398719
H -4.637668 0.009494 -2.383277
H 2.318146 2.551957 1.072179
H 2.627064 3.190074 -0.571971
H 1.533045 1.792881 -0.337451
H 2.990189 0.429216 -2.044637
H 4.747424 0.237766 -1.750301
H 4.081514 1.822917 -2.237776
H -0.083944 0.924809 2.174159
H -1.523524 1.811920 2.774491
H -0.602017 2.435019 1.367683
H 3.870554 -2.754818 1.089850
H 2.113284 -3.095788 1.058574
H 2.804211 -2.086029 2.365764
H -1.703909 -3.289850 0.113055


