%chk=000055372.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000055372

0 1
 S   1.1800000E-02   1.017000       2.582200    
 P   4.0300000E-02  0.5001000      0.6762000    
 O   -1.262500       2.659800      6.4700000E-02
 O    1.242900       1.074000      -1.561000    
 C   -1.363300       1.269400     -0.2315000    
 C    1.502800       1.233500     -0.1736000    
 C   -2.758600      0.7802000      0.1611000    
 C    2.832700      0.5722000      0.1957000    
 C   6.1900001E-02  -1.252000      0.2640000    
 C   -3.863300       1.560300     -0.5579000    
 C    4.056700       1.139000     -0.5307000    
 C  -0.3984000      -1.647900     -0.9731000    
 C   0.5378000      -2.147200       1.197400    
 C   -5.244600       1.089400     -0.1298000    
 C    4.336900       2.596900     -0.2023000    
 C  -0.3820000      -3.005600      -1.292400    
 C   0.5544000      -3.504900      0.8780000    
 C   9.4499998E-02  -3.934200     -0.3669000    
 H   -1.237500       1.158400      -1.312500    
 H    1.521600       2.303600      5.4600000E-02
 H   -2.853800     -0.2897000     -5.2000001E-02
 H   -2.896900      0.9021000       1.241800    
 H    2.988500      0.6366000       1.278300    
 H    2.782400     -0.4946000     -5.0600000E-02
 H   -3.758600       1.435500      -1.641900    
 H   -3.778500       2.631700     -0.3440000    
 H    4.932200      0.5452000     -0.2408000    
 H    3.948600       1.020600      -1.614400    
 H  -0.7608000     -0.9449000      -1.712400    
 H   0.9120000      -1.831700       2.164300    
 H  -0.4948000       3.009100     -0.4172000    
 H    1.851600       1.656800      -2.045100    
 H   -5.384500      2.7799999E-02 -0.3568000    
 H   -6.018500       1.654700     -0.6584000    
 H   -5.392800       1.233700      0.9452000    
 H    5.277100       2.912600     -0.6660000    
 H    4.425100       2.746600      0.8784000    
 H    3.545800       3.251400     -0.5797000    
 H  -0.7371000      -3.339800      -2.262900    
 H   0.9285000      -4.227600       1.597200    
 H   0.1089000      -4.991200     -0.6163000    


%chk=000055372-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000055372

0 1
S -0.043964 0.558927 2.628867
P -0.039001 0.262127 0.544073
O -1.188379 2.225803 -1.115238
O 1.217668 1.195349 -1.706010
C -1.548105 0.967194 -0.499336
C 1.436587 1.208623 -0.235952
C -2.772019 1.170429 0.393098
C 2.793430 0.624792 0.170247
C 0.150002 -1.533603 0.042975
C -4.017429 1.599909 -0.418013
C 4.009515 1.431880 -0.359784
C 0.148896 -1.915496 -1.322952
C 0.278129 -2.509307 1.058018
C -5.237558 1.857126 0.491506
C 4.067621 2.890562 0.144571
C 0.276680 -3.281231 -1.665259
C 0.402674 -3.873002 0.708686
C 0.401460 -4.260597 -0.651813
H -1.737363 0.179448 -1.260868
H 1.309185 2.243708 0.131630
H -2.980443 0.230477 0.941034
H -2.528073 1.929729 1.159693
H 2.822637 0.602369 1.277182
H 2.859884 -0.425306 -0.177221
H -4.264872 0.811212 -1.158398
H -3.770686 2.511196 -0.992891
H 4.927088 0.896788 -0.048618
H 4.034350 1.421961 -1.473088
H 0.064600 -1.158984 -2.110675
H 0.271264 -2.182597 2.105886
H -0.396036 2.073718 -1.710684
H 2.088819 1.206087 -2.175973
H -5.510458 0.949590 1.062868
H -6.120636 2.164005 -0.098639
H -5.022624 2.659564 1.221749
H 4.997970 3.385964 -0.186303
H 4.038407 2.923715 1.249144
H 3.219571 3.492475 -0.229394
H 0.276687 -3.579863 -2.719592
H 0.498144 -4.629145 1.495729
H 0.494877 -5.318699 -0.921357


