%chk=000178836.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000178836

0 1
 Cl  -4.476000      -1.979700      -1.365200    
 S    3.960400     -0.5239000      0.8313000    
 O    4.053000      7.1999999E-03   2.186900    
 O    4.670100      -1.759800      0.5193000    
 O   -5.281300       1.038800     -0.2919000    
 O   -5.595800     -0.4664000       1.452500    
 N    4.460400      0.7022000     -0.2823000    
 N   -1.789100      -1.306400     -0.4673000    
 N   -2.743100     -0.5832000      0.1484000    
 C    4.330900      0.4077000      -1.732000    
 C    4.095300       2.106500      3.4100000E-02
 C    2.272100     -0.7536000      0.4495000    
 C    5.388000       1.169700      -2.505300    
 C    5.178800       2.737500      0.8849000    
 C    1.895100      -1.696600     -0.5067000    
 C    1.300500      5.7999999E-03   1.101000    
 C   0.5463000      -1.880100     -0.8114000    
 C  -4.8300002E-02 -0.1776000      0.7965000    
 C  -0.4330000      -1.121700     -0.1615000    
 C   -3.958000     -0.8367000     -0.2113000    
 C   -5.058600     -7.0500001E-02  0.4373000    
 C   -6.316500       1.891700      0.2049000    
 C   -6.451100       3.089100     -0.7116000    
 H    3.329000      0.6689000      -2.089200    
 H    4.487100     -0.6615000      -1.908900    
 H    3.934200       2.709900     -0.8637000    
 H    3.143600       2.138400      0.5728000    
 H    5.375800      0.8606000      -3.555800    
 H    6.388100      0.9675000      -2.106800    
 H    5.234300       2.251900      -2.486500    
 H    4.923100       3.777100       1.113100    
 H    6.139000       2.732600      0.3581000    
 H    5.319100       2.212000       1.833300    
 H    2.634200      -2.297200      -1.029100    
 H    1.569700      0.7454000       1.849700    
 H   0.2665000      -2.618000      -1.559300    
 H  -0.7780000      0.4314000       1.323800    
 H   -2.039000      -1.997500      -1.165800    
 H   -6.060400       2.226400       1.216500    
 H   -7.262600       1.339400      0.2343000    
 H   -7.236400       3.764200     -0.3602000    
 H   -5.507300       3.641600     -0.7648000    
 H   -6.690000       2.769000      -1.731200    


%chk=000178836-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000178836

0 1
Cl -4.516899 -2.511307 -1.876734
S 3.736972 -0.031831 1.047649
O 3.569209 0.979670 2.307801
O 4.538148 -1.446526 1.166345
O -4.996809 1.004624 0.116661
O -6.508621 -0.387895 -1.002043
N 4.638092 0.943238 -0.344167
N -1.883840 -1.457536 -0.798638
N -2.944162 -0.667333 -0.525046
C 5.036342 -0.000779 -1.434727
C 3.828010 2.119494 -0.797521
C 1.986854 -0.450760 0.460883
C 6.312208 0.524731 -2.123243
C 3.933837 3.323019 0.153554
C 1.793249 -1.646895 -0.252995
C 0.932318 0.421787 0.788618
C 0.488956 -1.973131 -0.670442
C -0.371546 0.095930 0.370544
C -0.589407 -1.099844 -0.364791
C -4.149877 -0.962420 -0.908379
C -5.344608 -0.119614 -0.624907
C -6.139105 1.914659 0.458645
C -5.557826 3.043716 1.300900
H 4.221389 -0.147307 -2.180362
H 5.257776 -0.973957 -0.960491
H 4.250484 2.392883 -1.783728
H 2.763852 1.845712 -0.986423
H 6.637655 -0.190841 -2.900763
H 7.121390 0.638140 -1.382934
H 6.147878 1.503472 -2.609115
H 3.377319 4.182657 -0.264453
H 4.990906 3.613056 0.279151
H 3.531649 3.084890 1.151589
H 2.634817 -2.321143 -0.440926
H 1.127540 1.317900 1.386844
H 0.309159 -2.904942 -1.219413
H -1.222017 0.739958 0.607318
H -2.032158 -2.331507 -1.325846
H -6.899648 1.324309 1.000725
H -6.587821 2.272802 -0.485561
H -6.362183 3.747294 1.582753
H -5.099793 2.651853 2.224763
H -4.789589 3.601873 0.739306


