%chk=000294780.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294780

0 1
Cl -4.316106 2.075970 1.625134
S -1.288351 -0.613541 -2.031521
O -0.418975 -0.984674 -3.126393
O -2.522117 0.087450 -2.298966
O 4.685501 2.163614 0.651046
O 2.127491 0.426842 2.103994
O 4.096083 0.294879 -0.492932
N -0.282473 0.431641 -1.039205
C 1.697560 1.987168 -1.115027
C 1.120331 0.624658 -1.512279
C 2.395063 1.913877 0.248061
C -0.736249 1.022847 0.155043
C 0.109974 1.319495 1.252809
C 1.580795 1.110877 1.270976
C 3.779739 1.312382 0.073236
C -1.575730 -1.948959 -1.002122
C -2.126687 1.291438 0.284265
C -0.442444 1.790415 2.460032
C -2.620280 1.770120 1.484846
C -1.805358 2.021440 2.596134
C -2.757882 -2.026786 -0.253779
C -0.627488 -2.978317 -0.910090
C -2.988008 -3.114071 0.587230
C -0.851603 -4.067209 -0.071809
C -2.034377 -4.142437 0.688030
C 6.101561 1.786956 0.631786
C -2.260964 -5.301205 1.597301
C 6.685263 2.040165 -0.741618
H 2.412900 2.329429 -1.891765
H 0.903432 2.763252 -1.093818
H 1.131667 0.525033 -2.628668
H 1.768675 -0.201400 -1.125136
H 2.503722 2.952879 0.670028
H -2.807497 1.179098 -0.573480
H 0.223291 1.970810 3.310237
H -2.227242 2.385993 3.529950
H -3.510512 -1.232229 -0.330480
H 0.292691 -2.932397 -1.504297
H -3.907891 -3.163522 1.168257
H -0.108468 -4.860463 -0.001162
H 6.502533 2.460812 1.411007
H 6.184166 0.730490 0.943943
H -1.625776 -5.223736 2.495029
H -3.299591 -5.377351 1.947774
H -2.014673 -6.259099 1.115383
H 7.773037 1.900683 -0.746140
H 6.262772 1.348408 -1.486596
H 6.477796 3.059975 -1.089150


%chk=000294780-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000294780

0 1
Cl -4.699023 2.367124 1.558341
S -1.683556 -0.416388 -2.217177
O -0.829483 -0.769294 -3.554528
O -3.232301 0.061182 -2.303093
O 4.568938 1.778770 0.753033
O 1.849902 0.682612 2.172387
O 3.716719 0.046836 -0.558528
N -0.619905 1.088256 -1.362590
C 1.630929 2.080834 -1.283867
C 0.804061 0.833459 -1.675067
C 2.254252 1.922157 0.121816
C -1.027709 1.400622 -0.049249
C -0.162754 1.438586 1.108204
C 1.326314 1.249763 1.168517
C 3.563763 1.129795 0.053914
C -1.564945 -1.860633 -1.017229
C -2.416480 1.715866 0.116494
C -0.751616 1.708541 2.379756
C -2.928938 1.978497 1.388197
C -2.118910 1.972313 2.546049
C -2.569633 -2.003460 -0.045378
C -0.471947 -2.734762 -1.143410
C -2.454452 -3.083404 0.856153
C -0.385120 -3.805924 -0.228382
C -1.362927 -3.990207 0.785950
C 5.896002 1.082701 0.826282
C -1.234827 -5.123445 1.785648
C 6.762440 1.439134 -0.384130
H 2.435276 2.230205 -2.024718
H 0.986682 2.976755 -1.325708
H 0.862810 0.641295 -2.758186
H 1.216494 -0.056204 -1.149284
H 2.494811 2.916802 0.545792
H -3.060840 1.737705 -0.765572
H -0.086749 1.707109 3.249427
H -2.540232 2.184954 3.531750
H -3.418507 -1.313705 -0.011669
H 0.264179 -2.600655 -1.942487
H -3.226204 -3.223379 1.621385
H 0.453573 -4.506704 -0.305798
H 6.324775 1.452779 1.770695
H 5.712869 -0.003883 0.889073
H -0.662406 -4.794721 2.674562
H -2.221939 -5.467083 2.139762
H -0.702365 -5.988417 1.354424
H 7.765111 0.987508 -0.267957
H 6.316832 1.049636 -1.314680
H 6.886336 2.532176 -0.473829


