%chk=000205923.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000205923

0 1
Cl -3.075802 -2.025275 -0.199766
S 1.866005 -0.084032 0.743101
O 2.396985 1.132991 1.327693
O 1.989916 -1.360769 1.418272
N 2.637486 -0.266317 -0.791603
N -3.852135 0.869401 -0.528141
C 0.192018 0.182684 0.388598
C -0.679312 -0.902130 0.258416
C -0.298148 1.490614 0.269683
C 2.294865 -1.500951 -1.533035
C 2.678526 0.952462 -1.630733
C -2.020717 -0.678782 -0.030704
C -1.636008 1.730008 -0.013411
C -2.531085 0.640346 -0.179240
H -0.314423 -1.929203 0.394923
H 0.383395 2.339618 0.413483
H 2.386066 -2.371729 -0.853566
H 3.027904 -1.660361 -2.344022
H 1.289149 -1.496663 -1.982109
H 3.047974 1.801363 -1.021950
H 1.711754 1.224780 -2.082639
H 3.408474 0.813891 -2.448353
H -1.999680 2.750120 -0.105362
H -4.529109 0.122586 -0.498834
H -4.229799 1.800047 -0.466402


%chk=000205923-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000205923

0 1
Cl -3.266258 -2.070307 -0.092218
S 1.921932 -0.107617 0.760361
O 2.511907 1.259589 1.415690
O 2.015227 -1.568028 1.471563
N 2.860185 -0.306913 -0.887062
N -3.970156 0.870493 -0.408770
C 0.104296 0.203077 0.387006
C -0.755914 -0.907896 0.297990
C -0.349166 1.527425 0.236891
C 2.377519 -1.506130 -1.610435
C 2.823025 0.957419 -1.657555
C -2.106165 -0.659909 0.027711
C -1.710605 1.748490 -0.029252
C -2.629598 0.658994 -0.146957
H -0.380516 -1.921479 0.470224
H 0.346797 2.363067 0.361606
H 2.329177 -2.351945 -0.904805
H 3.130800 -1.748420 -2.381933
H 1.390786 -1.369638 -2.108921
H 3.074418 1.792523 -0.982836
H 1.848770 1.154345 -2.160452
H 3.611098 0.893540 -2.429731
H -2.086626 2.771725 -0.139784
H -4.609433 0.080631 -0.469229
H -4.337201 1.811662 -0.514804


