%chk=000002804.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002804

0 1
 Cl   5.178000      0.8149000     -0.5619000    
 S    3.303700      -1.776900     -8.3200000E-02
 O   -1.095200       2.534900      0.8071000    
 O    2.223600      -2.689200     -0.4235000    
 O    4.536100      -1.787200     -0.8549000    
 N   -2.855800      0.5150000      0.1213000    
 N   -1.482400      0.4097000     -3.8699999E-02
 N    3.685800      -1.960600       1.570800    
 C   -3.531600      0.3720000      -1.183700    
 C   -3.367100     -0.4190000       1.145500    
 C   -3.570900      -1.083400      -1.685500    
 C   -3.351600      -1.885500      0.6846000    
 C   -4.095700      -2.057400     -0.6355000    
 C   -4.934200      0.9923000      -1.134900    
 C   -2.641500     -0.2593000       2.487800    
 C  -0.6873000       1.476500      0.3349000    
 C   0.7715000       1.297700      0.1129000    
 C    1.294300      2.1600001E-02  0.1166000    
 C    1.554900       2.414500     -8.9699998E-02
 C    2.663300     -0.1455000     -9.2000000E-02
 C    2.923900       2.247500     -0.2985000    
 C    3.478100      0.9675000     -0.2995000    
 H   -2.980000      0.9637000      -1.928500    
 H   -4.410800     -0.1452000       1.346900    
 H   -4.186100      -1.155200      -2.590400    
 H   -2.559300      -1.393500      -1.977600    
 H   -2.318800      -2.238900      0.5705000    
 H   -3.818700      -2.522100       1.445600    
 H   -5.168200      -1.894100     -0.4774000    
 H   -3.983200      -3.086800     -0.9942000    
 H   -5.613800      0.4545000     -0.4673000    
 H   -5.384900      0.9908000      -2.133600    
 H   -4.885500       2.034200     -0.7991000    
 H   -2.656800      0.7843000       2.820800    
 H   -1.598900     -0.5910000       2.436600    
 H   -3.137800     -0.8570000       3.260500    
 H   -1.124100     -0.4289000     -0.4829000    
 H   0.6792000     -0.8476000      0.3240000    
 H    1.138100       3.417200     -9.7099997E-02
 H    3.544400       3.125400     -0.4598000    
 H    3.099600      -2.593300       2.128700    
 H    4.679100      -1.975400       1.832500    


%chk=000002804-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000002804

0 1
Cl 5.359277 0.854682 -0.253659
S 3.373138 -1.906904 -0.026412
O -1.170393 2.664554 0.667158
O 2.077339 -2.846262 0.284736
O 4.283891 -2.155950 -1.344963
N -2.969081 0.529292 0.085101
N -1.554474 0.451474 -0.029419
N 4.377116 -1.972367 1.497210
C -3.632279 0.362968 -1.260511
C -3.515428 -0.388568 1.151469
C -3.621413 -1.125660 -1.725235
C -3.477716 -1.878955 0.712457
C -4.194913 -2.078058 -0.645984
C -5.046864 0.978709 -1.232295
C -2.816472 -0.134433 2.495781
C -0.745076 1.536630 0.288250
C 0.743902 1.284806 0.129519
C 1.334299 -0.002680 0.136135
C 1.582106 2.422069 0.012039
C 2.725827 -0.119193 -0.001697
C 2.978744 2.291117 -0.115580
C 3.557269 1.004125 -0.125256
H -3.022154 0.965607 -1.958869
H -4.576539 -0.085535 1.253100
H -4.193270 -1.219776 -2.668124
H -2.580257 -1.432273 -1.961758
H -2.422967 -2.221085 0.641553
H -3.952821 -2.501570 1.494893
H -5.279798 -1.890727 -0.517301
H -4.095460 -3.127618 -0.981315
H -5.756836 0.394237 -0.621271
H -5.454101 1.027990 -2.258553
H -4.997684 2.001660 -0.822753
H -2.810577 0.944955 2.724813
H -1.770679 -0.491304 2.482550
H -3.345664 -0.668422 3.305400
H -1.125776 -0.399467 -0.418028
H 0.763393 -0.928419 0.277669
H 1.111088 3.409604 0.041095
H 3.620273 3.172642 -0.201110
H 4.182727 -2.867680 1.973753
H 5.371704 -1.813016 1.273612


