%chk=000026547.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026547

0 1
 S   -1.968100      -1.222900     -0.8020000    
 O  -0.1550000       1.841700     -0.1878000    
 O   -1.218100       2.039300      -2.220100    
 N    4.563800       2.424600      0.7358000    
 C    3.545100       2.468100     -0.3061000    
 C    2.174300       2.145900      0.2799000    
 C    1.091200       2.162300     -0.7903000    
 C    4.558200       1.124400       1.408800    
 C    5.887700       2.699500      0.1745000    
 C   -2.468100       1.470400     -0.2710000    
 C   -2.876200      0.1596000     -0.1197000    
 C   -1.233000       1.814700      -1.019800    
 C  -0.8405000      -1.623300      0.5610000    
 C   5.7300001E-02  -2.784200      0.2323000    
 C   -3.185000       2.524800      0.2644000    
 C   -4.044700     -0.1086000      0.5936000    
 C   -4.353500       2.256500      0.9775000    
 C   -4.783200      0.9399000       1.142000    
 C    1.285900      -2.550500     -0.3716000    
 C  -0.3530000      -4.075400      0.5371000    
 C    2.118800      -3.627000     -0.6764000    
 C   0.4800000      -5.152000      0.2323000    
 C    1.715900      -4.927700     -0.3744000    
 H    3.776000       1.762100      -1.115000    
 H    3.514100       3.471300     -0.7491000    
 H    2.135200       1.149200      0.7330000    
 H    1.913900       2.856000       1.075400    
 H    1.319600       1.423200      -1.567600    
 H    1.030500       3.157000      -1.247400    
 H    3.704300       1.017700       2.085100    
 H    4.576700      0.2846000      0.7043000    
 H    5.437500       1.028000       2.057900    
 H    5.903000       3.681600     -0.3114000    
 H    6.190000       1.945400     -0.5613000    
 H    6.643700       2.731900      0.9670000    
 H  -0.2337000     -0.7445000      0.8063000    
 H   -1.427400      -1.850700       1.458900    
 H   -2.857400       3.553100      0.1412000    
 H   -4.397800      -1.127400      0.7344000    
 H   -4.928600       3.072700       1.404700    
 H   -5.692900      0.7312000       1.697400    
 H    1.609500      -1.541200     -0.6114000    
 H   -1.313800      -4.261900       1.008700    
 H    3.081100      -3.452300      -1.148800    
 H   0.1664000      -6.165000      0.4671000    
 H    2.364400      -5.766000     -0.6118000    


%chk=000026547-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000026547

0 1
S -1.844797 -1.024143 -0.798560
O -0.266416 1.672477 -0.233075
O -1.364853 3.330826 -1.440906
N 4.609280 1.730494 0.667108
C 3.527218 2.124482 -0.264583
C 2.128628 1.678618 0.216768
C 1.037480 2.242575 -0.694438
C 4.804129 0.267899 0.753279
C 5.875083 2.429050 0.358462
C -2.684875 1.690806 -0.218019
C -2.964028 0.295348 -0.141282
C -1.410953 2.302930 -0.721045
C -0.730752 -1.326895 0.747942
C 0.245950 -2.439352 0.456112
C -3.690489 2.622087 0.161137
C -4.226670 -0.129865 0.340468
C -4.937224 2.187278 0.651916
C -5.205464 0.803097 0.748508
C 1.290218 -2.257336 -0.490443
C 0.145715 -3.685499 1.126209
C 2.216202 -3.290156 -0.749714
C 1.074302 -4.720580 0.871311
C 2.113692 -4.525547 -0.066668
H 3.706385 1.725532 -1.300390
H 3.543569 3.229688 -0.341907
H 2.056684 0.576255 0.227836
H 1.978247 2.032753 1.252405
H 1.177232 1.947859 -1.751951
H 0.975394 3.344830 -0.647655
H 3.888810 -0.227791 1.116899
H 5.083425 -0.195549 -0.228863
H 5.610877 0.049569 1.475078
H 5.714112 3.521708 0.382568
H 6.297973 2.162735 -0.644346
H 6.631898 2.178840 1.123204
H -0.239659 -0.359035 0.929702
H -1.403113 -1.575575 1.584169
H -3.473230 3.689947 0.055460
H -4.437071 -1.203571 0.373230
H -5.694535 2.920977 0.947466
H -6.173092 0.449935 1.121189
H 1.358583 -1.309053 -1.036942
H -0.662082 -3.843163 1.851095
H 3.014388 -3.135964 -1.484772
H 0.984992 -5.675875 1.400685
H 2.832935 -5.327547 -0.267048


