%chk=000042051.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000042051

0 1
 Cl  -7.198000      -3.415500       2.141500    
 S   -5.626300      -2.268800      2.8899999E-02
 S    4.209400       2.241000       1.389800    
 O   -6.843800      -1.811600     -0.6291000    
 O   -5.056000      -3.562900     -0.3218000    
 O    4.115500       1.990400       2.870400    
 O   -5.348600       2.851800     -0.9317000    
 O   -3.235800       3.436000      -1.047800    
 O    6.485800      -2.961000      -2.168400    
 O    5.867300      -4.015600     -0.3451000    
 N   -1.372000       1.815600     -0.7508000    
 N   -4.128100       2.571600     -0.8832000    
 N    5.995500      -2.961200      -1.013300    
 C   -4.383700      -1.063800     -0.2006000    
 C   -2.393700      0.8635000     -0.5684000    
 C   -3.742100       1.225000     -0.6318000    
 C   -4.735300      0.2630000     -0.4483000    
 C  -5.8499999E-02   1.915400     -0.2472000    
 C   -3.038900      -1.428800     -0.1365000    
 C   -2.045800     -0.4667000     -0.3202000    
 C    2.539700       2.113600      0.7494000    
 C   0.2506000       1.384500       1.005100    
 C   0.9316000       2.545400      -1.001300    
 C    1.549600       1.483700       1.503400    
 C    2.230700       2.644400     -0.5030000    
 C   -5.924300      -2.244700       1.784600    
 C    4.748200      0.6731000      0.6655000    
 C    5.291500      0.6632000     -0.6104000    
 C    4.610100     -0.4974000       1.396000    
 C    5.573400      -1.730600     -0.4447000    
 C    5.706600     -0.5459000      -1.168700    
 C    5.025200      -1.706400      0.8376000    
 H   -5.788200      0.5303000     -0.4868000    
 H   -1.590600       2.525500      -1.443300    
 H   -2.741800      -2.455600      5.7100002E-02
 H   -1.008100     -0.7877000     -0.2874000    
 H  -0.5051000      0.9088000       1.624200    
 H   0.7036000       2.962700      -1.978800    
 H    1.762200       1.063200       2.482500    
 H    2.990300       3.139700      -1.102400    
 H   -5.009900      -2.529100       2.309300    
 H   -6.256400      -1.247200       2.079500    
 H    5.402400       1.579300      -1.183900    
 H    4.182800     -0.5059000       2.394400    
 H    6.129300     -0.5265000      -2.169900    
 H    4.905100      -2.609800       1.430200    


%chk=000042051-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000042051

0 1
Cl -7.903644 -3.183810 2.286164
S -5.925725 -2.297316 0.025166
S 4.260236 2.034843 1.580462
O -7.075719 -1.922161 -1.068778
O -5.173081 -3.744744 0.079627
O 4.059370 1.401744 3.113478
O -5.491731 2.762291 -1.521867
O -3.302366 3.376898 -1.636760
O 7.072878 -2.688084 -2.556738
O 6.888952 -3.891747 -0.627472
N -1.484947 1.850361 -0.556331
N -4.244177 2.508432 -1.336381
N 6.735981 -2.812936 -1.317275
C -4.568757 -0.986198 -0.097468
C -2.487274 0.913548 -0.395437
C -3.853674 1.214893 -0.774536
C -4.889312 0.260326 -0.623390
C -0.150152 1.820611 -0.067095
C -3.245910 -1.352723 0.244165
C -2.226056 -0.409941 0.098893
C 2.495461 1.938876 0.842384
C 0.192848 1.277473 1.201939
C 0.849195 2.454221 -0.856004
C 1.524910 1.335915 1.656810
C 2.180871 2.522986 -0.397336
C -6.670627 -1.923894 1.828833
C 4.996498 0.548333 0.606973
C 5.383023 0.672677 -0.740586
C 5.180426 -0.627295 1.352408
C 6.128852 -1.634545 -0.640506
C 5.958269 -0.444130 -1.382153
C 5.753809 -1.747560 0.716484
H -5.903704 0.509379 -0.952144
H -1.800002 2.686753 -1.088043
H -3.031285 -2.376160 0.571048
H -1.195647 -0.696853 0.318837
H -0.580935 0.859043 1.851904
H 0.579666 2.886154 -1.825838
H 1.827845 0.951303 2.639420
H 2.940755 3.026609 -1.005117
H -5.810242 -1.964670 2.509579
H -7.142465 -0.937286 1.732943
H 5.252481 1.611173 -1.289982
H 4.877146 -0.634401 2.407379
H 6.275459 -0.409884 -2.427502
H 5.917901 -2.690504 1.244442


