%chk=000125878.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125878

0 1
 Cl  -5.409700      -1.382200       1.721700    
 S   -5.420600     -0.3257000     -2.8700000E-02
 O   -5.400700      -1.303000      -1.096000    
 O   -6.482200      0.6470000      0.1186000    
 N    4.729800      0.2497000     -0.3032000    
 N    1.028800      0.5281000     -0.1651000    
 C    4.916800     -0.7496000      0.7580000    
 C    5.805800       1.250600     -0.2860000    
 C    6.255900      -1.472800      0.6055000    
 C    7.173900      0.5929000     -0.4725000    
 C    7.418100     -0.4868000      0.5757000    
 C    3.425500      0.8986000     -0.1711000    
 C    2.307400     -0.1270000     -0.3058000    
 C  -0.1858000     -0.1376000     -0.2108000    
 C   -1.431600      0.5307000     -6.8400003E-02
 C   -2.643700     -0.1977000     -0.1220000    
 C  -0.1895000      -1.533800     -0.4052000    
 C   -3.862300      0.4855000      2.1400001E-02
 C   -1.473700       1.920900      0.1271000    
 C   -2.601500      -1.587900     -0.3177000    
 C   -1.381600      -2.250200     -0.4581000    
 C   -3.885600       1.867100      0.2152000    
 C   -2.693500       2.583400      0.2677000    
 H    4.170000      -1.545800      0.7147000    
 H    4.855800     -0.2869000       1.751800    
 H    5.796000       1.818700      0.6536000    
 H    5.659300       1.968400      -1.102300    
 H    6.393000      -2.178500       1.432700    
 H    6.253300      -2.061900     -0.3206000    
 H    7.235000      0.1496000      -1.474700    
 H    7.961400       1.352600     -0.4108000    
 H    7.528100     -2.0600000E-02   1.562500    
 H    8.354000      -1.014200      0.3619000    
 H    3.341200       1.429600      0.7869000    
 H    3.305400       1.651000     -0.9618000    
 H    2.379000     -0.6240000      -1.281100    
 H    2.362500     -0.8785000      0.4847000    
 H    1.038500       1.530900     -3.8899999E-02
 H   0.7291000      -2.102400     -0.5217000    
 H  -0.5822000       2.537700      0.1784000    
 H   -3.473300      -2.227500     -0.3375000    
 H   -1.362100      -3.326800     -0.6017000    
 H   -4.813900       2.418400      0.3302000    
 H   -2.712400       3.658900      0.4189000    


%chk=000125878-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000125878

0 1
Cl -5.689572 -1.644612 1.771265
S -5.628660 -0.187494 -0.211063
O -5.719833 -1.170668 -1.499102
O -6.727551 0.992206 -0.021294
N 4.769983 0.166658 -0.110775
N 1.002272 0.392097 -0.006407
C 5.167516 -0.513246 1.151368
C 5.820978 1.115673 -0.568867
C 6.486376 -1.291622 0.971544
C 7.159987 0.387851 -0.801131
C 7.611219 -0.353632 0.477595
C 3.434557 0.789866 -0.033305
C 2.306763 -0.249001 -0.217878
C -0.214546 -0.237448 -0.216622
C -1.466112 0.491763 -0.025874
C -2.728850 -0.207418 -0.251216
C -0.266135 -1.588091 -0.635555
C -3.910637 0.569759 -0.014829
C -1.492573 1.862015 0.371434
C -2.729804 -1.572762 -0.668198
C -1.507756 -2.231044 -0.855489
C -3.933667 1.894800 0.413773
C -2.689267 2.558330 0.582741
H 4.362187 -1.206014 1.456255
H 5.290845 0.235234 1.979306
H 5.977104 1.937155 0.179957
H 5.477980 1.585549 -1.509537
H 6.765457 -1.764707 1.932386
H 6.325534 -2.100141 0.232831
H 7.030916 -0.339338 -1.625836
H 7.924731 1.122536 -1.117985
H 7.846795 0.387225 1.269746
H 8.537586 -0.926849 0.286421
H 3.278421 1.334887 0.937398
H 3.351606 1.541941 -0.840737
H 2.370922 -0.662927 -1.242025
H 2.444770 -1.094715 0.487836
H 1.015778 1.317034 0.421099
H 0.659217 -2.150233 -0.782806
H -0.558379 2.417180 0.512841
H -3.669783 -2.097568 -0.846723
H -1.508899 -3.278640 -1.174899
H -4.884987 2.405601 0.590861
H -2.674790 3.611712 0.876997


