%chk=000047472.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000047472

0 1
 Cl  0.6117000       1.797300      -2.414200    
 Cl  -3.358600       2.166700       1.389900    
 Cl   7.170600     -0.6812000     -7.6600000E-02
 S   -2.030700      0.4845000      -1.052100    
 N   -3.091500      -2.247200     -6.7800000E-02
 N   -5.187500      -2.819100     -0.4229000    
 C   -1.120900     -0.6958000      1.4500000E-02
 C   0.4021000     -0.5822000     -0.2053000    
 C   -1.653000      -2.106800     -0.2948000    
 C    1.271600      -1.493300      0.6773000    
 C    2.754000      -1.288200      0.4866000    
 C   -1.349500       2.038400     -0.4938000    
 C   -3.767400      -1.790700       1.013300    
 C   -3.965500      -2.855300     -0.9060000    
 C    3.427000      -2.035200     -0.4679000    
 C    3.418200     -0.3573000       1.270400    
 C   -5.071000      -2.156200      0.7731000    
 C    4.798000      -1.846400     -0.6430000    
 C    4.789100     -0.1685000       1.095200    
 C  -0.2061000       2.579900      -1.102500    
 C   -1.947900       2.741200      0.5640000    
 C    5.479100     -0.9130000      0.1386000    
 C   0.3250000       3.793200     -0.6648000    
 C   -1.416700       3.954400       1.001600    
 C  -0.2801000       4.480500      0.3872000    
 H   -1.331700     -0.4368000       1.058100    
 H   0.6428000     -0.7950000      -1.254200    
 H   0.7347000      0.4319000      2.6200000E-02
 H   -1.189100      -2.853200      0.3597000    
 H   -1.444400      -2.395800      -1.332300    
 H    1.015800      -1.332100       1.732800    
 H    1.037500      -2.546000      0.4779000    
 H   -3.304800      -1.278600       1.844900    
 H   -3.674000      -3.306200      -1.844900    
 H    2.904900      -2.762700      -1.082700    
 H    2.888900      0.2288000       2.016300    
 H   -5.930700      -1.979500       1.402800    
 H    5.322500      -2.433400      -1.392600    
 H    5.306500      0.5626000       1.711000    
 H    1.210300       4.218800      -1.130700    
 H   -1.873600       4.504800       1.820400    
 H   0.1336000       5.425000      0.7282000    


%chk=000047472-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000047472

0 1
Cl 0.630491 2.675024 -2.737924
Cl -3.341989 1.556240 1.098755
Cl 7.397914 -1.366707 0.125070
S -1.686870 0.603765 -1.612507
N -2.988861 -2.135358 -0.110888
N -5.257009 -2.088465 -0.013914
C -0.953591 -0.643610 -0.339092
C 0.583353 -0.690623 -0.450026
C -1.622041 -2.009598 -0.631500
C 1.259724 -1.382195 0.773174
C 2.775892 -1.394057 0.644089
C -1.327328 2.187281 -0.766363
C -3.341629 -2.434768 1.214920
C -4.180606 -1.929904 -0.807657
C 3.457188 -2.529077 0.135872
C 3.540360 -0.249956 0.990671
C -4.736813 -2.404249 1.253685
C 4.861289 -2.532030 -0.026779
C 4.944262 -0.230626 0.837168
C -0.355733 3.096163 -1.268073
C -2.047997 2.614584 0.383268
C 5.583606 -1.377066 0.327118
C -0.107151 4.349340 -0.671799
C -1.815879 3.854982 1.009475
C -0.840834 4.723461 0.473689
H -1.271230 -0.280787 0.654287
H 0.879554 -1.203860 -1.385785
H 0.973659 0.340387 -0.529430
H -1.003228 -2.806882 -0.180332
H -1.639615 -2.195878 -1.721785
H 0.958607 -0.840951 1.691757
H 0.888937 -2.420024 0.875309
H -2.597047 -2.646144 1.978751
H -4.204042 -1.660077 -1.860670
H 2.889578 -3.427736 -0.134352
H 3.037483 0.638583 1.391414
H -5.393544 -2.592340 2.099875
H 5.380144 -3.412873 -0.415897
H 5.527588 0.653481 1.110396
H 0.647869 5.014400 -1.099210
H -2.398341 4.136832 1.890606
H -0.656922 5.693618 0.945536


