%chk=000029292.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029292

0 1
 Cl -0.3624000       5.125900     -7.6499999E-02
 S   0.8994000      7.1599998E-02  -1.585000    
 N   -3.215200      6.0000001E-03  0.4548000    
 N    5.730400     -0.4800000      0.2551000    
 C  -0.5300000      -3.474200     -9.7099997E-02
 C  -0.8221000      -2.447500      -1.191600    
 C   -1.759500      -4.254400      0.3661000    
 C   -1.427300      -1.177200     -0.6606000    
 C   -2.826300      -3.415400       1.068500    
 C   -3.494600      -2.384200      0.1608000    
 C   -2.667500      -1.140700     -2.9100001E-02
 C  -0.7445000      3.4800000E-02 -0.7932000    
 C   -1.290800       1.227100     -0.3025000    
 C   -2.546800       1.165500      0.3243000    
 C    1.959000     -0.2194000     -0.1506000    
 C    3.430000     -0.2350000     -0.5598000    
 C  -0.6172000       2.455000     -0.4244000    
 C    4.327500     -0.4877000      0.6522000    
 C   -3.095000       2.347700      0.8146000    
 C   -1.186100       3.623100      7.4400000E-02
 C   -2.427600       3.569000      0.6950000    
 C    6.596200     -0.6880000       1.417200    
 C    6.070400      0.7778000     -0.4124000    
 H   0.1851000      -4.203800     -0.4984000    
 H  -4.1200001E-02  -2.998900      0.7621000    
 H   -1.516900      -2.874300      -1.927800    
 H   9.8200001E-02  -2.308000      -1.759500    
 H   -2.206800      -4.777700     -0.4883000    
 H   -1.425900      -5.033800       1.062500    
 H   -2.400300      -2.933300       1.957000    
 H   -3.601400      -4.104800       1.426600    
 H   -4.450100      -2.096700      0.6188000    
 H   -3.745500      -2.816600     -0.8152000    
 H    1.784500      0.5677000      0.5908000    
 H    1.689900      -1.176900      0.3067000    
 H    3.640300      0.7374000      -1.018100    
 H    3.605500      -1.010100      -1.317200    
 H   0.3527000       2.546400     -0.9041000    
 H    4.072700      -1.463700       1.083800    
 H    4.130100      0.2702000       1.422100    
 H   -4.066800       2.330500       1.304800    
 H   -2.893200       4.467300       1.092300    
 H    6.359800      -1.639100       1.907400    
 H    6.497100      0.1155000       2.156200    
 H    7.646400     -0.7479000       1.110100    
 H    5.669300      0.8221000      -1.429700    
 H    7.157100      0.8583000     -0.5415000    
 H    5.741200       1.657700      0.1525000    


%chk=000029292-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000029292

0 1
Cl -0.091890 5.075570 0.031833
S 0.929338 -0.165415 -1.696432
N -3.260650 -0.028436 0.457012
N 5.888698 -0.200402 0.292911
C -0.800067 -3.706901 -0.140242
C -1.057529 -2.647657 -1.255844
C -2.071547 -4.413659 0.384709
C -1.506921 -1.293619 -0.735592
C -3.116954 -3.487064 1.047021
C -3.696085 -2.391288 0.106408
C -2.795041 -1.180444 -0.066082
C -0.721519 -0.131786 -0.847620
C -1.198483 1.122352 -0.313561
C -2.486778 1.115719 0.347476
C 2.050110 -0.258347 -0.148646
C 3.519059 -0.116610 -0.576208
C -0.473600 2.353622 -0.406201
C 4.453777 -0.127763 0.656266
C -2.997970 2.328931 0.908096
C -1.016097 3.505280 0.155126
C -2.274842 3.520509 0.821729
C 6.732603 -0.503742 1.468187
C 6.371549 0.995857 -0.428218
H -0.120629 -4.477677 -0.554383
H -0.257920 -3.228429 0.700341
H -1.820074 -3.051513 -1.953258
H -0.131596 -2.506236 -1.838661
H -2.555008 -4.943045 -0.463489
H -1.773124 -5.196178 1.110978
H -2.684171 -3.002511 1.944585
H -3.959238 -4.111823 1.403330
H -4.646285 -2.013430 0.520211
H -3.919874 -2.849083 -0.879214
H 1.739563 0.556027 0.529066
H 1.856637 -1.229456 0.338572
H 3.642212 0.823369 -1.146246
H 3.810143 -0.950066 -1.242586
H 0.483011 2.371959 -0.936790
H 4.223297 -1.021950 1.268532
H 4.230503 0.769897 1.294169
H -3.973107 2.288006 1.402046
H -2.659824 4.451289 1.247616
H 6.398892 -1.448767 1.933018
H 6.708320 0.295962 2.252409
H 7.781730 -0.633178 1.147563
H 5.823405 1.123548 -1.376531
H 7.439999 0.865888 -0.675738
H 6.265779 1.939990 0.166432


