%chk=000193816.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193816

0 1
Cl 5.776166 -0.860049 1.802838
S 5.380851 -0.610542 -0.274291
O 6.212981 0.490650 -0.653183
O 5.566032 -1.917996 -0.824302
N -0.298396 0.926165 0.022237
N -1.325766 0.003602 -0.044742
C -0.815466 2.338616 0.167244
C -2.344076 2.136295 0.169431
C -2.486888 0.620482 0.036420
C 1.040777 0.551023 -0.058460
C -3.781939 -0.064142 0.017007
C 2.049914 1.549398 0.008863
C 1.409932 -0.815124 -0.204409
C 3.752141 -0.173154 -0.200407
C 3.383549 1.175021 -0.060648
C 2.746493 -1.159425 -0.270569
C -4.954976 0.641699 -0.304510
C -3.858464 -1.435271 0.322059
C -6.185386 -0.018279 -0.317495
C -5.093649 -2.087295 0.307347
C -6.257827 -1.381564 -0.011082
H -0.469684 2.962971 -0.680583
H -0.443392 2.785121 1.111288
H -2.835655 2.661243 -0.668946
H -2.816529 2.497400 1.100873
H 1.794721 2.598960 0.117399
H 0.634569 -1.582093 -0.261007
H 4.161809 1.948186 -0.010105
H 3.029777 -2.214181 -0.384291
H -4.912390 1.700895 -0.550600
H -2.950380 -1.989893 0.568114
H -7.092154 0.530890 -0.568672
H -5.147487 -3.149723 0.544293
H -7.220008 -1.892286 -0.021810


%chk=000193816-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000193816

0 1
Cl 5.984364 -0.778973 2.237199
S 5.478884 -0.677952 -0.165870
O 6.372972 0.535609 -0.766093
O 5.606709 -2.192464 -0.732037
N -0.315812 0.967437 -0.035182
N -1.343123 0.017931 -0.033975
C -0.818982 2.375942 0.006807
C -2.359385 2.180226 0.036858
C -2.509304 0.654749 0.003450
C 1.016783 0.581540 -0.063979
C -3.789223 -0.056274 0.009967
C 2.045695 1.575599 -0.071576
C 1.369475 -0.805695 -0.088115
C 3.702114 -0.178193 -0.138420
C 3.395718 1.195447 -0.095453
C 2.716183 -1.187827 -0.111361
C -5.013017 0.670304 0.057427
C -3.836858 -1.481680 -0.031083
C -6.249893 -0.007974 0.063766
C -5.072780 -2.153011 -0.024660
C -6.285920 -1.420590 0.022701
H -0.476271 2.929493 -0.886135
H -0.436743 2.889942 0.907047
H -2.856533 2.648224 -0.830999
H -2.815538 2.605227 0.948331
H 1.794304 2.639687 -0.059715
H 0.573986 -1.553050 -0.088370
H 4.193593 1.944266 -0.105268
H 3.002482 -2.243827 -0.134086
H -5.000962 1.765543 0.089923
H -2.896549 -2.040445 -0.067689
H -7.183921 0.563029 0.100758
H -5.096757 -3.247671 -0.056474
H -7.246492 -1.946966 0.027608


