%chk=000094121.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094121

0 1
 Cl  -3.742600       2.483300      -1.761800    
 S    3.560200      0.1346000      -1.709500    
 S    3.883600      0.7198000       1.254700    
 S   -3.471800       2.054100      0.2203000    
 S   -3.858000      -1.555700     -0.4278000    
 O   -2.972100     -0.8324000      0.7402000    
 O    4.439200       1.272400      -1.901700    
 O    2.427500     -7.5099997E-02  -2.591500    
 O    4.748200       1.790200      0.7949000    
 O    2.978200      0.9343000       2.367600    
 O   -3.331100       3.329000      0.8954000    
 O   -4.525200       1.114800      0.5517000    
 O   -4.482400     -0.5476000      -1.260900    
 O   -3.114400      -2.667300     -0.9858000    
 N    3.048700      3.8199998E-02 -7.7100001E-02
 C    1.832600     -0.6701000      0.1952000    
 C   0.5857000     -2.3900000E-02  0.1998000    
 C  -0.5821000     -0.7749000      0.4739000    
 C   -1.829000     -0.1285000      0.4785000    
 C    1.926700      -2.037200      0.4571000    
 C   0.4722000       1.351400     -6.1600000E-02
 C   -1.923100       1.238600      0.2167000    
 C  -0.4687000      -2.150000      0.7353000    
 C  -0.7746000       1.977100     -5.2999999E-02
 C   0.7783000      -2.775800      0.7265000    
 C    4.560000      -1.332500      -1.802900    
 C    4.940400     -0.6441000       1.683200    
 C   -5.106400      -2.222500      0.6426000    
 H    2.884600      -2.548000      0.4578000    
 H    1.342700       1.966100     -0.2772000    
 H   -1.336700      -2.758500      0.9746000    
 H  -0.8289000       3.042400     -0.2609000    
 H   0.8529000      -3.839000      0.9359000    
 H    4.896400      -1.426300      -2.839300    
 H    5.434200      -1.230400      -1.164800    
 H    3.968600      -2.210600      -1.548700    
 H    5.644200     -0.8415000      0.8786000    
 H    5.504000     -0.3470000       2.572200    
 H    4.343100      -1.521100       1.927600    
 H   -5.609600      -1.405300       1.161900    
 H   -5.823600      -2.769600      2.7200000E-02
 H   -4.633900      -2.901200       1.355300    


%chk=000094121-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000094121

0 1
Cl -2.829870 4.027950 -0.771794
S 3.299221 -0.049392 -2.220884
S 4.041894 0.688443 0.937745
S -3.320973 2.004635 0.494692
S -3.904545 -2.214615 0.025093
O -2.846606 -0.837779 1.272867
O 2.984844 1.541172 -2.375035
O 2.401926 -1.146002 -3.012410
O 5.428598 1.107056 0.194650
O 3.026831 1.827528 1.503713
O -3.556163 2.445828 2.028738
O -4.510918 1.249179 -0.297332
O -3.440386 -1.985525 -1.511012
O -3.740162 -3.667432 0.732380
N 3.229526 -0.716654 -0.278658
C 1.938811 -1.183561 0.115758
C 0.719927 -0.392856 0.181894
C -0.483281 -1.045268 0.653464
C -1.728260 -0.294515 0.739636
C 1.907894 -2.551935 0.466308
C 0.669237 0.983003 -0.207189
C -1.688763 1.053043 0.306779
C -0.468081 -2.423781 1.024382
C -0.530667 1.709289 -0.138652
C 0.713205 -3.168394 0.920294
C 5.147921 -0.355485 -2.551365
C 4.470387 -0.480658 2.384626
C -5.645744 -1.517528 0.358530
H 2.835077 -3.125810 0.372854
H 1.557065 1.500050 -0.579135
H -1.388130 -2.891458 1.388459
H -0.562875 2.760993 -0.437791
H 0.717822 -4.229285 1.187763
H 5.308673 -0.040136 -3.592163
H 5.673250 0.265637 -1.810592
H 5.300917 -1.432323 -2.402748
H 5.095461 -1.275323 1.958737
H 5.013000 0.150115 3.103126
H 3.519250 -0.851473 2.788556
H -5.589074 -0.464330 0.043802
H -6.334507 -2.132071 -0.238750
H -5.793732 -1.630134 1.440861


