%chk=000005469.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005469

0 1
 Cl  -2.496500       4.177300      3.9600000E-02
 S   -4.421000      -1.762300     -2.0000000E-02
 O  -0.4672000      -1.166900      -1.411800    
 O    7.336600       1.638800      0.6351000    
 O   -2.384900      -3.306900      0.6473000    
 N    4.286900     -0.1993000     -0.3164000    
 N    1.542300      -1.018700     -0.2564000    
 N   -1.991400     -0.9812000      0.5749000    
 C    3.438700      0.1241000      0.8403000    
 C    3.487600     -0.2204000      -1.550100    
 C    2.304500     -0.8916000      0.9893000    
 C    2.359800      -1.246500      -1.447000    
 C    5.384900      0.7596000     -0.4321000    
 C   0.1519000      -1.059300     -0.3502000    
 C  -0.6144000     -0.9582000      0.9445000    
 C    6.276600      0.7057000      0.7981000    
 C   -2.726500      0.2057000      0.2853000    
 C   -4.058400     -2.9899999E-02 -5.5500001E-02
 C   -2.753600      -2.156800      0.4597000    
 C   -2.227100       1.502200      0.3201000    
 C   -4.919200       1.010800     -0.3675000    
 C   -3.086100       2.559000      7.1999999E-03
 C   -4.423400       2.314900     -0.3344000    
 H    3.017400       1.133500      0.7430000    
 H    3.991800      8.0399998E-02   1.782000    
 H    4.121200     -0.4883000      -2.404000    
 H    3.062900      0.7721000      -1.751600    
 H    1.669200     -0.6028000       1.828300    
 H    2.708500      -1.885700       1.218100    
 H    2.768800      -2.261500      -1.368800    
 H    1.744400      -1.212800      -2.351900    
 H    5.015500       1.782700     -0.5842000    
 H    5.999600      0.5267000      -1.311300    
 H  -0.3677000     -5.7000000E-02   1.508200    
 H  -0.3879000      -1.840300       1.553000    
 H    6.716500     -0.2883000      0.9285000    
 H    5.773500      0.9880000       1.724900    
 H   -1.192400       1.708700      0.5729000    
 H   -5.955400      0.8276000     -0.6327000    
 H    6.940700       2.523100      0.5518000    
 H   -5.090200       3.138700     -0.5778000    


%chk=000005469-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000005469

0 1
Cl -2.650690 4.135717 -0.755033
S -4.579351 -1.841764 0.506177
O -0.448869 -0.936219 -1.508622
O 7.743440 1.256261 0.581952
O -2.274622 -3.210004 1.277452
N 4.259789 -0.014981 -0.261278
N 1.538345 -0.946239 -0.291107
N -2.076186 -0.917163 0.719080
C 3.406384 0.118142 0.942319
C 3.440256 0.086335 -1.496907
C 2.325240 -0.984230 0.958980
C 2.366081 -1.015546 -1.517692
C 5.430739 0.892194 -0.255449
C 0.156905 -0.927413 -0.396186
C -0.631452 -0.887170 0.943848
C 6.571773 0.370460 0.643915
C -2.829997 0.184854 0.270207
C -4.213003 -0.107908 0.114387
C -2.767052 -2.128082 0.898067
C -2.336951 1.479726 0.004495
C -5.118108 0.880898 -0.304729
C -3.264986 2.453891 -0.405522
C -4.640019 2.187158 -0.565950
H 2.905368 1.120933 0.981209
H 4.028976 0.016096 1.848933
H 4.102393 -0.041444 -2.371893
H 2.940918 1.084173 -1.584444
H 1.674135 -0.849678 1.836347
H 2.823683 -1.970605 1.044935
H 2.858413 -2.006793 -1.564718
H 1.693604 -0.907029 -2.383554
H 5.154036 1.933595 0.058220
H 5.825609 0.964542 -1.284998
H -0.372170 0.015464 1.528614
H -0.385947 -1.775834 1.552499
H 6.927293 -0.601436 0.269209
H 6.232394 0.238537 1.693186
H -1.274168 1.719474 0.080736
H -6.180969 0.654179 -0.428735
H 7.498417 2.146280 0.941983
H -5.323150 2.975529 -0.891533


