%chk=000279350.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279350

0 1
Cl 1.596383 0.330210 -1.353031
S -6.579305 0.930327 -0.425554
F -6.331402 2.440894 -0.835963
O -0.353830 -1.722636 -0.959751
O -7.031996 0.329277 -1.644236
O -7.404029 1.041810 0.741698
O 7.434729 1.398588 0.577669
O 6.165887 2.746696 -0.545250
N 1.020418 -1.873830 0.892398
N -1.131791 -0.862559 1.065635
N 6.392127 1.690892 0.018125
C 2.179396 -2.283087 0.060804
C 3.272743 -1.242942 0.057604
C -2.431606 -0.462539 0.656531
C 3.087721 -0.003129 -0.580678
C 4.500250 -1.503610 0.683649
C -5.006391 0.404896 -0.016424
C -3.272827 0.093615 1.652122
C -2.888924 -0.587546 -0.669980
C -0.161967 -1.481474 0.216118
C 5.307481 0.675052 0.028703
C -4.548866 0.520349 1.304226
C -4.169644 -0.154449 -0.994016
C 4.092625 0.965096 -0.606478
C 5.521854 -0.552105 0.672053
H 1.838767 -2.490056 -0.992410
H 2.545733 -3.260376 0.459213
H 1.263652 -1.462695 1.790922
H 4.666150 -2.460906 1.182828
H -0.920754 -0.753313 2.060993
H -2.934969 0.189963 2.681184
H -2.244832 -1.026931 -1.442956
H -5.205301 0.945221 2.075351
H -4.528096 -0.259977 -2.026952
H 3.943784 1.929207 -1.111125
H 6.484727 -0.752834 1.157579


%chk=000279350-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000279350

0 1
Cl 2.167563 0.968687 -1.578523
S -7.110662 0.431824 -0.129153
F -7.004374 2.075639 -1.001349
O -0.501133 -1.621984 -1.181539
O -7.715018 -0.593151 -1.209040
O -7.835692 0.737585 1.273267
O 8.016121 0.712504 1.011293
O 7.079464 2.411965 -0.190536
N 1.002034 -1.266942 0.568190
N -1.203597 -0.503805 0.782553
N 7.041630 1.243568 0.353881
C 2.130084 -1.862662 -0.165083
C 3.400389 -1.034136 -0.044318
C -2.574471 -0.307628 0.511244
C 3.536947 0.256474 -0.620993
C 4.516638 -1.553346 0.662942
C -5.296874 0.140960 0.122324
C -3.336368 0.395709 1.490921
C -3.208199 -0.783160 -0.673840
C -0.253760 -1.164738 -0.029125
C 5.788586 0.452863 0.217252
C -4.707007 0.631520 1.301129
C -4.581801 -0.551931 -0.869615
C 4.713424 1.013997 -0.503591
C 5.715113 -0.827080 0.803317
H 1.796539 -1.942867 -1.216289
H 2.329735 -2.889225 0.197934
H 1.158965 -0.970861 1.532763
H 4.437061 -2.551817 1.107322
H -0.868774 -0.093300 1.657070
H -2.852839 0.762636 2.404210
H -2.616699 -1.313237 -1.421544
H -5.301003 1.166261 2.048190
H -5.084542 -0.914398 -1.771658
H 4.814549 2.003879 -0.955013
H 6.575868 -1.224702 1.346010


