%chk=000023815.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023815

0 1
 S    1.620800       1.672500     -2.8600000E-02
 S   -4.502400      -2.659300      3.0099999E-02
 O    1.885000       2.329200      -1.290300    
 O    1.917200       2.323600       1.228900    
 N    2.358400      0.1253000     -3.9700001E-02
 N   -4.096800      8.5299999E-02  3.4699999E-02
 C    2.009900     -0.7382000      -1.206500    
 C    2.292200     -0.6213000       1.251300    
 C    2.976900      -1.915300      -1.279200    
 C    3.264100      -1.796100       1.213200    
 C    2.983300      -2.710200      2.3600001E-02
 C  -8.0100000E-02   1.201100     -9.9999998E-03
 C  -0.7480000       1.021900      -1.210600    
 C  -0.7193000       1.016600       1.205200    
 C   -2.091900      0.6480000      -1.195400    
 C   -2.063000      0.6425000       1.220400    
 C   -2.749200      0.4584000      2.0000000E-02
 C   -4.257400      -1.084100      3.2900002E-02
 H    2.086000     -0.1668000      -2.137000    
 H   0.9908000      -1.125300      -1.108400    
 H    1.277000     -0.9922000       1.425700    
 H    2.574600      3.0900000E-02   2.083600    
 H    3.990000      -1.545000      -1.480600    
 H    2.701500      -2.571700      -2.112200    
 H    3.192100      -2.368300       2.144800    
 H    4.292200      -1.419100       1.143700    
 H    2.012400      -3.202000      0.1591000    
 H    3.740800      -3.500200     -2.5800001E-02
 H  -0.2556000       1.163100      -2.167600    
 H  -0.2029000       1.152000       2.150600    
 H   -2.616900      0.5094000      -2.137100    
 H   -2.565500      0.4991000       2.173600    


%chk=000023815-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000023815

0 1
S 1.511091 1.558355 -0.066883
S -7.022193 -0.927758 0.196479
O 1.752007 2.235791 -1.526711
O 1.816123 2.312123 1.342282
N 2.592019 0.015576 -0.050262
N -4.305817 -0.123375 0.112872
C 2.415885 -0.806862 -1.277174
C 2.454837 -0.752939 1.215971
C 3.567822 -1.841259 -1.298396
C 3.606319 -1.787902 1.245685
C 3.564893 -2.692652 -0.007583
C -0.306068 1.029737 -0.011561
C -0.979310 0.810815 -1.227461
C -0.926716 0.895540 1.243770
C -2.331309 0.420940 -1.185038
C -2.278828 0.505815 1.286112
C -2.983810 0.260246 0.071959
C -5.463532 -0.467165 0.148884
H 2.470301 -0.137398 -2.152350
H 1.435854 -1.342250 -1.283362
H 1.475164 -1.285497 1.276595
H 2.537819 -0.046585 2.059374
H 4.526441 -1.297711 -1.389808
H 3.454284 -2.480511 -2.194621
H 3.518965 -2.388838 2.170889
H 4.567546 -1.242751 1.286010
H 2.648941 -3.318833 0.019045
H 4.426940 -3.385197 -0.005985
H -0.465191 0.975304 -2.180031
H -0.372324 1.124352 2.159789
H -2.892292 0.247478 -2.108074
H -2.799663 0.397209 2.241984


