%chk=000174713.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000174713

0 1
 Cl  -4.083600      -5.063600      7.0500001E-02
 S    5.770500     -0.7932000     -0.9517000    
 O    7.102700     -0.4692000      -1.427000    
 O    5.561700      -1.231200      0.4142000    
 N  -0.4421000      0.5546000      0.9021000    
 N    1.837200       1.048400       2.535300    
 N   -4.224500     -6.5300003E-02 -0.7942000    
 N    4.719000      0.5121000      -1.347300    
 C   -1.724300      0.3445000      0.3258000    
 C   0.8489000      0.5478000      0.3579000    
 C   -2.259300     -0.9468000      0.2782000    
 C   -2.440600       1.430600     -0.1874000    
 C    1.976600      0.7894000       1.153500    
 C   -3.530400      -1.108000     -0.2987000    
 C   -3.704600       1.176400     -0.7460000    
 C    3.253100      0.7778000      0.5911000    
 C    3.412700      0.5244000     -0.7713000    
 C    1.019500      0.2943000      -1.009000    
 C    2.295800      0.2827000      -1.571300    
 C   -1.561500      -2.056400      0.7860000    
 C   -1.927000       2.738800     -0.1529000    
 C   -4.068500      -2.391200     -0.3490000    
 C   -4.422500       2.253600      -1.258400    
 C   -2.121800      -3.328900      0.7236000    
 C   -2.664900       3.798500     -0.6720000    
 C    2.466700      0.1810000       3.509300    
 C    1.075100       2.192100       2.992000    
 C   -3.377900      -3.496200      0.1549000    
 C   -3.915200       3.554900      -1.225800    
 C    5.129100      -2.052100      -2.032500    
 H  -0.4663000      0.4781000       1.914100    
 H    4.123700      0.9855000       1.209100    
 H   0.1699000      0.1017000      -1.659000    
 H    2.408700      8.2599998E-02  -2.633700    
 H  -0.5792000      -1.961000       1.241300    
 H  -0.9547000       2.965300      0.2762000    
 H   -5.053200      -2.532900     -0.7931000    
 H   -5.404800       2.088700      -1.697700    
 H    4.743200      0.8088000      -2.332200    
 H   -1.569300      -4.175600       1.121800    
 H   -2.266600       4.808100     -0.6434000    
 H    3.543100      0.3734000       3.562300    
 H    2.310300     -0.8728000       3.254000    
 H    2.048700      0.3413000       4.509100    
 H    1.649500       2.750100       3.739800    
 H   0.1383000       1.874800       3.461300    
 H   0.8430000       2.890800       2.180600    
 H   -4.499400       4.374700      -1.633500    
 H    5.165500      -1.690200      -3.061800    
 H    5.762300      -2.936300      -1.930200    
 H    4.107900      -2.296900      -1.736300    


%chk=000174713-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000174713

0 1
Cl -5.083977 -4.824136 1.123481
S 5.961861 -0.386375 -1.021736
O 7.424224 -0.013550 -1.630133
O 5.786656 -0.933428 0.505557
N -0.405747 0.234103 0.843024
N 1.662962 0.400370 2.577537
N -4.370253 -0.071227 -0.805141
N 4.772029 1.336106 -1.126536
C -1.684611 0.155555 0.258632
C 0.820100 0.613767 0.278006
C -2.453570 -1.039373 0.458496
C -2.276332 1.249524 -0.457403
C 1.938581 0.664479 1.188214
C -3.809407 -1.086283 -0.077683
C -3.621462 1.062501 -0.995995
C 3.227738 0.898140 0.685935
C 3.448257 1.086674 -0.712299
C 1.033217 0.825671 -1.111493
C 2.331555 1.033329 -1.602883
C -1.943145 -2.200519 1.136574
C -1.649711 2.534436 -0.615623
C -4.611502 -2.261823 0.143081
C -4.229631 2.135023 -1.739215
C -2.733113 -3.330958 1.332660
C -2.280195 3.557590 -1.319792
C 2.765799 -0.213037 3.354923
C 1.012532 1.522682 3.313998
C -4.075509 -3.333552 0.837252
C -3.575532 3.351232 -1.905190
C 5.191813 -1.755565 -2.154044
H -0.257759 -0.217374 1.760659
H 4.093593 0.944780 1.350824
H 0.188923 0.773855 -1.804378
H 2.488983 1.160580 -2.681463
H -0.905095 -2.221887 1.485678
H -0.666919 2.714260 -0.171062
H -5.628579 -2.265242 -0.255871
H -5.228719 1.950182 -2.145044
H 4.846917 1.575214 -2.137522
H -2.338725 -4.214306 1.842402
H -1.788555 4.530881 -1.423392
H 3.561620 0.514819 3.629069
H 3.229289 -1.026090 2.773489
H 2.352070 -0.632670 4.288981
H 1.728518 2.349416 3.515910
H 0.623903 1.152235 4.279055
H 0.169864 1.927944 2.730129
H -4.051416 4.162297 -2.466879
H 5.347327 -1.429601 -3.191547
H 5.750682 -2.671045 -1.914858
H 4.130949 -1.831605 -1.877783


