%chk=000081132.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081132

0 1
 S   -1.190400      -2.145300       1.155000    
 O   -1.417000       3.062300      0.2986000    
 O    5.107900     -0.5806000     -0.6962000    
 N  -0.7118000      0.8112000      0.2998000    
 C   0.4326000     -6.7699999E-02  0.2804000    
 C   -1.970400      0.2189000     -0.1025000    
 C   0.3430000      -1.424500      0.6304000    
 C   -2.290400      -1.116100      0.2110000    
 C    1.678300      0.4120000     -0.1668000    
 C    2.806100     -0.4108000     -0.2067000    
 C    1.480600      -2.246600      0.5979000    
 C   -2.922200      0.9597000     -0.8282000    
 C  -0.6351000       2.176400      0.6565000    
 C    2.709300      -1.738800      0.1856000    
 C   -3.525800      -1.666800     -0.1678000    
 C   -4.147200      0.4043000      -1.209600    
 C   -4.451400     -0.9076000     -0.8754000    
 C    4.084700      0.1200000     -0.6534000    
 C   0.4182000       2.568300       1.676100    
 C    4.201200       1.571600      -1.084700    
 H    1.739900       1.442400     -0.5053000    
 H    1.420200      -3.293600      0.8875000    
 H   -2.726600       1.970900      -1.168900    
 H    3.570100      -2.401600      0.1691000    
 H   -3.780700      -2.693500      8.6300001E-02
 H   -4.857300      0.9989000      -1.777200    
 H   -5.402700      -1.340500      -1.169200    
 H    1.270200       3.027600       1.169200    
 H   0.7484000       1.715600       2.274000    
 H  -1.4500000E-02   3.300700       2.365300    
 H    3.944600       2.236000     -0.2554000    
 H    3.566500       1.760800      -1.954200    
 H    5.236800       1.779600      -1.372700    


%chk=000081132-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000081132

0 1
S -1.261988 -2.015383 1.398479
O -1.769269 2.855210 0.947639
O 5.110704 -0.645683 -0.758222
N -0.760893 0.813279 0.407305
C 0.411267 -0.026203 0.339926
C -1.993749 0.255422 -0.114404
C 0.332766 -1.372834 0.782541
C -2.351256 -1.064164 0.256570
C 1.623786 0.451815 -0.203722
C 2.782385 -0.365003 -0.220276
C 1.477638 -2.202799 0.753921
C -2.839814 0.986934 -0.979719
C -0.765324 2.094839 1.029090
C 2.697912 -1.695582 0.275970
C -3.541626 -1.652794 -0.218567
C -4.042783 0.408810 -1.438708
C -4.396953 -0.906461 -1.059437
C 4.099956 0.117105 -0.761681
C 0.466489 2.496662 1.834739
C 4.198945 1.535494 -1.313719
H 1.652871 1.469860 -0.603310
H 1.401977 -3.240057 1.095425
H -2.566626 2.005966 -1.258759
H 3.600374 -2.314375 0.249606
H -3.793678 -2.679962 0.064152
H -4.702131 0.987019 -2.094169
H -5.328086 -1.354918 -1.421034
H 1.173989 3.074293 1.212646
H 1.006369 1.640914 2.269469
H 0.116029 3.164609 2.637178
H 3.949007 2.284255 -0.538565
H 3.499974 1.684605 -2.157966
H 5.226838 1.712328 -1.663899


