%chk=000184583.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184583

0 1
Cl 4.740554 2.307463 -1.667627
S 1.786372 -1.950094 1.734840
O -1.844925 -1.425673 -1.042713
N -2.693702 0.740234 -1.106596
N -0.439060 0.351417 -0.471569
N 0.309650 -1.344849 1.058355
C -4.866060 0.029406 -0.026758
C -4.080829 0.242458 -1.327385
C -5.287546 1.344583 0.639965
C 1.997908 0.004973 0.056906
C 0.567013 -0.364919 0.208612
C -6.092118 1.094051 1.913107
C 2.804046 -0.816785 0.878408
C -1.701051 -0.241261 -0.850754
C 2.589174 0.983716 -0.750223
C 4.192342 -0.679483 0.924306
C 3.975134 1.109496 -0.692212
C 4.782917 0.299325 0.128593
H -4.269527 -0.584485 0.679646
H -5.764105 -0.583082 -0.246012
H -4.587678 0.981880 -1.987202
H -4.027966 -0.717843 -1.896763
H -5.887757 1.950880 -0.067111
H -4.394958 1.953168 0.882055
H -2.650960 1.614257 -0.580565
H -5.515829 0.521227 2.649787
H -6.386462 2.036212 2.389221
H -7.009652 0.529992 1.708852
H -0.193055 1.281923 -0.807037
H 1.995302 1.617839 -1.406217
H 4.799715 -1.320091 1.563261
H 5.865213 0.441066 0.134332


%chk=000184583-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000184583

0 1
Cl 4.689387 2.204925 -2.092698
S 1.951588 -1.892418 1.989028
O -1.874955 -1.465755 -0.694089
N -2.633650 0.744562 -0.849258
N -0.407507 0.349059 -0.247917
N 0.373736 -1.242638 1.348833
C -4.978939 0.074851 -0.168684
C -3.980383 0.361469 -1.314515
C -5.297060 1.303107 0.714110
C 2.043124 -0.005963 0.125102
C 0.637873 -0.319871 0.407780
C -6.343093 0.990955 1.806247
C 2.919827 -0.780252 0.940971
C -1.673715 -0.229441 -0.587689
C 2.577339 0.909935 -0.817387
C 4.321891 -0.646432 0.844470
C 3.970856 1.035062 -0.893235
C 4.850928 0.278365 -0.078520
H -4.575268 -0.746734 0.453394
H -5.919355 -0.300506 -0.621733
H -4.363045 1.172502 -1.964127
H -3.858951 -0.545578 -1.931126
H -5.667161 2.131259 0.073618
H -4.367158 1.665594 1.198795
H -2.494624 1.692954 -0.497415
H -5.986383 0.185648 2.475098
H -6.557074 1.878868 2.428955
H -7.296076 0.654729 1.356167
H -0.210175 1.292291 -0.586858
H 1.931868 1.488747 -1.485718
H 4.995986 -1.242129 1.467074
H 5.932270 0.409834 -0.175168


