%chk=000116918.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000116918

0 1
 Cl   4.455900     -0.5781000       2.596500    
 Cl   1.371500       2.246600      -2.038100    
 Cl   6.143900      -3.805800     -0.1664000    
 S    6.065600      0.8898000      0.2050000    
 O   -7.518400       2.951600      0.2735000    
 O   -7.272700      -2.274900       1.349500    
 O    6.467400       1.718300     -0.9221000    
 O    6.544500       1.213000       1.540300    
 N   -5.900000     -0.3200000     -0.1437000    
 N    6.456300     -0.7365000     -0.1404000    
 N  -0.3041000     -0.2128000     -0.2856000    
 N   0.1207000      0.7999000      0.3189000    
 C   -6.637400      0.7317000      0.5277000    
 C   -6.629900      -1.392500     -0.7900000    
 C   -4.490200     -0.2929000     -0.1796000    
 C   -6.763200       1.941200     -0.3829000    
 C   -6.662700      -2.615300      0.1109000    
 C   -3.789400      -1.309600     -0.8283000    
 C   -3.796900      0.7507000      0.4336000    
 C    4.315100      0.8461000      0.2682000    
 C   -2.395400      -1.282900     -0.8636000    
 C   -2.402800      0.7773000      0.3984000    
 C   -1.701900     -0.2395000     -0.2502000    
 C    5.960500      -1.364800      -1.373200    
 C    3.627800      0.2100000       1.301900    
 C    3.607700       1.472200     -0.7580000    
 C    1.525400      0.8262000      0.2833000    
 C    2.212900       1.462200     -0.7505000    
 C    2.232900      0.2001000       1.309500    
 C    5.157100      -2.610900      -1.044500    
 H   -7.651400      0.3876000      0.7739000    
 H   -6.221000      0.9933000       1.508000    
 H   -6.245600      -1.627500      -1.788600    
 H   -7.664900      -1.066600     -0.9603000    
 H   -5.793000       2.366200     -0.6548000    
 H   -7.283800       1.673500      -1.309100    
 H   -7.256300      -3.407000     -0.3576000    
 H   -5.666900      -3.013200      0.3232000    
 H   -4.266800      -2.145900      -1.326600    
 H   -4.281900       1.568300      0.9553000    
 H   -1.856400      -2.078500      -1.371600    
 H   -1.923700       1.616900      0.8952000    
 H    6.862800      -1.344000      0.5805000    
 H    6.827200      -1.625600      -1.991300    
 H    5.350800     -0.6722000      -1.960400    
 H    4.125400       1.969700      -1.573700    
 H    1.691400     -0.2934000       2.113900    
 H    4.293500      -2.374900     -0.4160000    
 H    4.798100      -3.088200      -1.960800    
 H   -7.589300       3.700500     -0.3426000    
 H   -7.292200      -3.083200       1.889700    


%chk=000116918-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000116918

0 1
Cl 4.099581 -2.741707 0.893096
Cl 1.520814 3.095848 0.020265
Cl 8.070869 -2.989135 -2.729881
S 6.069048 0.028166 0.723882
O -7.915619 2.650861 -1.730402
O -8.517944 -0.805603 2.015596
O 6.566090 1.546823 0.398843
O 6.521911 -0.696130 2.104170
N -6.377942 -0.280517 -0.005171
N 6.518849 -0.962201 -0.787876
N -0.735785 -0.596115 0.442684
N -0.028691 0.508009 0.280294
C -7.097925 0.994934 -0.214227
C -7.209925 -1.492555 0.121125
C -4.992593 -0.335122 0.110180
C -7.192265 1.373734 -1.705060
C -7.578915 -1.846086 1.571487
C -4.309377 -1.566284 0.404712
C -4.184315 0.847306 -0.066014
C 4.180964 0.061201 0.571245
C -2.915365 -1.606917 0.500960
C -2.795852 0.799437 0.040065
C -2.126558 -0.433957 0.322666
C 7.781142 -0.505974 -1.427678
C 3.371118 -1.085749 0.679119
C 3.622092 1.333444 0.369194
C 1.374025 0.310562 0.392210
C 2.224431 1.448580 0.281269
C 1.982502 -0.966008 0.591832
C 7.855325 -1.105288 -2.827919
H -8.111010 0.891752 0.204687
H -6.610372 1.814261 0.340790
H -6.707266 -2.353634 -0.354338
H -8.152637 -1.325081 -0.429609
H -6.177947 1.473829 -2.144807
H -7.741611 0.584903 -2.262981
H -8.060263 -2.847735 1.588826
H -6.670430 -1.870326 2.206944
H -4.870005 -2.490444 0.565407
H -4.659097 1.805416 -0.292886
H -2.397750 -2.545959 0.723966
H -2.189889 1.700470 -0.096244
H 6.536336 -1.959165 -0.501105
H 8.692929 -0.761452 -0.850864
H 7.729459 0.596310 -1.515382
H 4.281474 2.203406 0.284157
H 1.321192 -1.834309 0.666377
H 6.926166 -0.946375 -3.392319
H 8.735741 -0.741602 -3.377926
H -8.011590 2.965557 -2.663434
H -8.686919 -0.887181 2.986472


