%chk=000083280.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083280

0 1
 S  -0.1000000      -1.981600     -0.8496000    
 O  -0.5994000      -1.790100      -2.195000    
 O   0.4211000      -3.263900     -0.4247000    
 N   -1.292900      -1.462000      0.2730000    
 C   -1.774800     -0.1139000      3.9400000E-02
 C   -1.053600      -1.847500       1.701600    
 C   -1.461100      0.9037000      0.9554000    
 C    1.148000     -0.7664000     -0.5604000    
 C  -0.5509000     -0.7001000       2.524100    
 C  -0.7265000      0.5814000       2.178400    
 C   -2.473800      0.1883000      -1.134200    
 C   -1.856500       2.218400      0.6857000    
 C    2.117800      -1.006000      0.3989000    
 C    1.136800      0.4051000      -1.299100    
 C   -2.871000       1.500400      -1.389100    
 C   -2.561600       2.513200     -0.4824000    
 C    3.107600       1.138600     -0.1095000    
 C    3.104700     -4.6700001E-02  0.6259000    
 C    2.123600       1.364400      -1.072000    
 C    4.162300       2.164700      0.1335000    
 H  -0.3481000      -2.679400       1.778500    
 H   -1.998700      -2.212400       2.121300    
 H  -3.0300001E-02 -0.9326000       3.448600    
 H  -0.3586000       1.386000       2.804600    
 H   -2.747300     -0.5859000      -1.844700    
 H   -1.624600       3.022800       1.379600    
 H    2.132800      -1.920700      0.9833000    
 H   0.3890000      0.5998000      -2.060900    
 H   -3.423400       1.733700      -2.294800    
 H   -2.870300       3.534700     -0.6851000    
 H    3.866400     -0.2347000       1.377900    
 H    2.117100       2.282400      -1.653700    
 H    4.504500       2.141300       1.173700    
 H    5.020100       1.984300     -0.5220000    
 H    3.781800       3.174300     -5.5599999E-02


%chk=000083280-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000083280

0 1
S 0.121364 -2.038416 -0.709468
O -0.197819 -2.237772 -2.302208
O 0.651829 -3.289007 0.232584
N -1.812791 -1.497584 0.300530
C -1.987419 -0.107701 0.199234
C -1.657646 -2.081829 1.649642
C -1.836397 0.779798 1.327506
C 1.444805 -0.685393 -0.608148
C -1.304449 -1.137606 2.769194
C -1.408731 0.216758 2.605769
C -2.346553 0.422245 -1.077372
C -2.087429 2.164990 1.148448
C 2.229456 -0.593934 0.553169
C 1.593012 0.179459 -1.705226
C -2.576960 1.799205 -1.228976
C -2.454769 2.673359 -0.112543
C 3.402717 1.319123 -0.473700
C 3.213461 0.417351 0.607907
C 2.581795 1.184841 -1.624546
C 4.483942 2.382876 -0.415487
H -0.898366 -2.901531 1.559086
H -2.609560 -2.616763 1.866637
H -0.971078 -1.572986 3.718812
H -1.172744 0.904995 3.425907
H -2.446175 -0.274204 -1.916314
H -1.984230 2.841552 2.005659
H 2.091732 -1.304367 1.374904
H 0.970058 0.050037 -2.595974
H -2.863316 2.200029 -2.207154
H -2.647540 3.744612 -0.235557
H 3.845013 0.503436 1.499834
H 2.717584 1.871347 -2.468352
H 4.691872 2.695685 0.622436
H 5.432719 2.001647 -0.840435
H 4.202816 3.279347 -0.995198


