%chk=000169083.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000169083

1 1
 S    1.718100      -1.879600      9.9999997E-05
 O   -4.052700      0.7915000      9.9999997E-05
 O   -3.695300      -1.374400     -3.9999999E-04
 N    2.235600      0.5745000     -9.9999997E-05
 N   -3.275000     -0.1926000       0.000000    
 C   0.8603000      0.5145000       0.000000    
 C   0.3790000     -0.7889000      9.9999997E-05
 C    2.842700     -0.5920000     -3.0000001E-04
 C  -1.8500000E-02   1.607100      9.9999997E-05
 C  -0.9977000      -1.053200       0.000000    
 C    2.970900       1.819200     -3.0000001E-04
 C   -1.873000      3.8699999E-02  9.9999997E-05
 C   -1.392600       1.348000      9.9999997E-05
 C    4.298200     -0.8128000      3.0000001E-04
 H   0.3343000       2.633500      1.9999999E-04
 H   -1.347000      -2.081400       0.000000    
 H    2.708700       2.394000      0.8941000    
 H    4.054400       1.685200     -2.4999999E-03
 H    2.705500       2.395700     -0.8926000    
 H   -2.063000       2.204600      9.9999997E-05
 H    4.758300     -0.3712000     -0.8896000    
 H    4.757800     -0.3698000      0.8897000    
 H    4.553600      -1.877900      1.3000000E-03


%chk=000169083-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000169083

1 1
S 1.733395 -1.975620 0.000142
O -4.122477 0.817379 0.000012
O -3.738306 -1.437654 -0.000001
N 2.274086 0.587070 -0.000021
N -3.352651 -0.211120 -0.000027
C 0.850947 0.543697 -0.000014
C 0.358931 -0.789465 0.000048
C 2.886697 -0.622716 0.000112
C -0.034056 1.644877 -0.000017
C -1.014618 -1.073539 0.000051
C 2.998269 1.885299 -0.000064
C -1.873754 0.041474 0.000008
C -1.414174 1.381513 -0.000013
C 4.361379 -0.850352 0.000141
H 0.329366 2.675652 0.000012
H -1.432702 -2.084006 0.000073
H 2.726841 2.456625 0.902564
H 4.082189 1.714542 -0.001330
H 2.724984 2.457530 -0.901547
H -2.149687 2.190416 -0.000018
H 4.837293 -0.406888 -0.894613
H 4.837479 -0.405774 0.894230
H 4.593168 -1.926242 0.000772


