%chk=000131116.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000131116

0 1
Cl 2.110092 -3.194966 -3.268005
S -1.879486 -2.711490 -1.663718
S 4.673202 1.440658 -0.007078
O -0.644804 -2.167977 -2.703750
O -3.105601 -2.440957 -2.389220
O -1.520020 -4.077885 -1.383846
O 6.097867 1.474604 -0.273443
O 3.862351 2.638303 -0.129653
N 4.532581 0.891904 1.610659
C -0.637128 -0.772585 1.477838
C 0.335496 -0.504887 2.572300
C -1.786198 0.081505 1.142785
C 1.500305 0.341139 2.031031
C -2.413905 -0.531622 -0.046002
C -1.670939 -1.662927 -0.378644
C 2.548851 0.657889 3.100744
C -0.586969 -1.802832 0.572591
C 3.639042 1.602599 2.558382
C -2.155688 1.209751 1.813156
C -4.194383 2.030667 0.567750
C -3.571667 -0.056424 -0.725734
C -5.239318 3.151440 0.559292
C -3.240163 2.086982 1.549873
C -4.329977 1.039872 -0.458660
C -5.149201 3.956287 -0.740874
C -6.642722 2.578041 0.778683
C 3.959828 0.169562 -0.937696
C 2.607870 0.233436 -1.295042
C 4.744202 -0.921866 -1.328292
C 2.022002 -0.809445 -2.016524
C 4.177172 -1.969433 -2.057896
C 2.818811 -1.896259 -2.383269
H -0.153099 0.005468 3.425552
H 0.721202 -1.460402 2.986264
H 1.106970 1.279550 1.593227
H 1.985608 -0.205445 1.195740
H 3.009917 -0.280529 3.466176
H 2.072177 1.128104 3.981810
H 0.130290 -2.608369 0.541141
H 3.163946 2.483433 2.059509
H 4.227439 2.012841 3.409510
H -1.533720 1.496347 2.680541
H -3.887551 -0.684006 -1.595137
H -5.024603 3.854472 1.407898
H -3.302353 2.933850 2.253982
H -5.189429 1.203668 -1.135078
H 5.352552 0.480967 2.064333
H -5.425574 3.363483 -1.620520
H -4.134039 4.335753 -0.909083
H -5.822616 4.821591 -0.714486
H -6.691700 1.973441 1.692124
H -6.969376 1.941629 -0.051991
H -7.383675 3.380869 0.875869
H -0.512913 -2.682782 -3.510341
H 2.003759 1.105218 -1.016389
H 5.809747 -0.955554 -1.073119
H 0.956211 -0.790254 -2.285220
H 4.778830 -2.824024 -2.366747


%chk=000131116-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000131116

0 1
Cl 2.469317 -3.117925 -3.960387
S -1.939887 -2.902374 -1.533717
S 4.720832 1.389257 0.073235
O -0.702894 -2.149213 -2.740776
O -3.412983 -2.801510 -2.204885
O -1.336955 -4.346930 -1.112083
O 6.325010 1.511885 -0.198411
O 3.714235 2.672508 0.026132
N 4.497957 0.577604 1.772766
C -0.738093 -0.714036 1.633718
C 0.253200 -0.429585 2.739086
C -1.853994 0.105430 1.233039
C 1.484998 0.367211 2.223058
C -2.499266 -0.525188 0.039688
C -1.729277 -1.700617 -0.197301
C 2.531926 0.659594 3.315234
C -0.669659 -1.812585 0.744376
C 3.756972 1.420502 2.758919
C -2.260047 1.297689 1.863527
C -4.303464 2.099677 0.526776
C -3.622909 -0.069505 -0.679899
C -5.347302 3.229893 0.480679
C -3.327622 2.170223 1.559071
C -4.406877 1.082162 -0.461903
C -5.259581 4.040656 -0.841225
C -6.785393 2.688964 0.708654
C 4.050149 0.085014 -1.105903
C 2.670311 0.055270 -1.367443
C 4.973219 -0.800389 -1.685619
C 2.175814 -0.935783 -2.245330
C 4.480796 -1.784164 -2.572358
C 3.094285 -1.835425 -2.823767
H -0.226449 0.129802 3.566616
H 0.606405 -1.383823 3.175510
H 1.144999 1.320965 1.770187
H 1.970831 -0.214758 1.417659
H 2.865271 -0.288554 3.781126
H 2.084539 1.278523 4.121029
H 0.056627 -2.626558 0.773567
H 3.416019 2.346565 2.250092
H 4.435070 1.727722 3.578196
H -1.651669 1.596641 2.729156
H -3.929205 -0.707301 -1.520549
H -5.120098 3.926461 1.311075
H -3.417738 3.039506 2.225066
H -5.232598 1.205214 -1.174980
H 5.476368 0.373246 2.050576
H -5.507416 3.414720 -1.717850
H -4.246683 4.453947 -0.994390
H -5.976367 4.881563 -0.816689
H -6.862268 2.139196 1.663749
H -7.094108 2.004498 -0.102590
H -7.505351 3.527208 0.732779
H -0.442868 -2.866689 -3.389249
H 1.996831 0.791824 -0.919506
H 6.042497 -0.709806 -1.470787
H 1.102604 -1.023267 -2.451678
H 5.161440 -2.492751 -3.051767


