%chk=000183191.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183191

0 1
Cl 4.959820 2.235197 -0.109147
O -4.871462 0.818470 1.688549
C -3.610444 -0.511038 0.096749
C -4.096013 -0.706369 -1.356208
C -2.478488 0.488111 0.125028
C -5.205042 -1.760916 -1.435998
C -6.391000 -1.391644 -0.535994
C -1.127582 0.036545 0.078148
C -4.810772 -0.156873 0.978796
C -5.950185 -1.157816 0.912399
C -0.072256 0.985837 0.057722
C 1.304684 0.544847 0.001415
C -0.374627 2.381769 0.091488
C 1.606328 -0.826212 -0.031755
C -2.743380 1.853511 0.155184
C 2.368031 1.526528 -0.021151
C -0.777607 -1.364015 0.049537
C -1.703228 2.796226 0.143064
C 0.517676 -1.772786 -0.002959
C 2.978956 -1.265481 -0.091087
C 0.722158 3.340054 0.071918
C 2.010126 2.939670 0.018744
C 4.024526 -0.304358 -0.115411
C 3.673719 1.082760 -0.078749
C 3.322434 -2.653060 -0.126575
C 5.381906 -0.751230 -0.174733
C 4.633418 -3.057582 -0.183353
C 5.677373 -2.092497 -0.207845
H -3.232162 -1.500955 0.479425
H -3.238905 -1.000539 -1.993275
H -4.453412 0.260400 -1.762726
H -4.807700 -2.753945 -1.150743
H -5.547303 -1.863978 -2.484123
H -7.156229 -2.191061 -0.567385
H -6.889177 -0.480226 -0.923876
H -5.636586 -2.108778 1.385420
H -6.802579 -0.790118 1.520625
H -3.776100 2.208737 0.215983
H -1.590443 -2.093806 0.076597
H -1.947898 3.857670 0.177934
H 0.764733 -2.836765 -0.022885
H 0.459559 4.398342 0.103497
H 2.816777 3.675023 0.005752
H 2.517919 -3.390755 -0.107059
H 6.191366 -0.020092 -0.193576
H 4.891713 -4.115295 -0.209975
H 6.710656 -2.434306 -0.252788


%chk=000183191-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000183191

0 1
Cl 5.077333 2.341847 -0.024798
O -4.730172 0.669953 1.874549
C -3.653702 -0.536659 -0.008552
C -4.332475 -0.588779 -1.427787
C -2.482992 0.434287 0.018054
C -5.481967 -1.618724 -1.484886
C -6.549582 -1.333151 -0.406274
C -1.114865 -0.012997 -0.001441
C -4.752760 -0.280601 1.051500
C -5.909546 -1.280411 1.010957
C -0.039483 0.957177 -0.008592
C 1.340899 0.529356 -0.022255
C -0.353518 2.364231 0.001226
C 1.668860 -0.865501 -0.038166
C -2.748097 1.821828 0.016526
C 2.402134 1.533165 -0.019400
C -0.742296 -1.406381 -0.024829
C -1.708512 2.771419 0.008436
C 0.582844 -1.809719 -0.042062
C 3.058009 -1.289230 -0.050219
C 0.722859 3.330876 0.002885
C 2.042425 2.936997 -0.005400
C 4.114437 -0.292843 -0.045332
C 3.735546 1.086238 -0.030289
C 3.442212 -2.669699 -0.066202
C 5.484836 -0.719563 -0.055710
C 4.783134 -3.060302 -0.076649
C 5.815240 -2.073830 -0.071102
H -3.306227 -1.568589 0.197138
H -3.553776 -0.827633 -2.175932
H -4.715233 0.420585 -1.676831
H -5.071399 -2.638832 -1.335865
H -5.943867 -1.605264 -2.490591
H -7.339648 -2.106926 -0.424189
H -7.042883 -0.363724 -0.618134
H -5.519595 -2.288261 1.262849
H -6.647764 -0.995857 1.779907
H -3.784933 2.167392 0.047657
H -1.518601 -2.177114 -0.030168
H -1.944662 3.841647 0.018250
H 0.798578 -2.881172 -0.058392
H 0.463883 4.395846 0.013864
H 2.845124 3.678462 -0.001254
H 2.672130 -3.445770 -0.069610
H 6.271076 0.039673 -0.051023
H 5.044234 -4.123964 -0.088614
H 6.866060 -2.382282 -0.078653


