%chk=000198541.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198541

0 1
Cl 4.937082 1.564427 -1.416808
O -4.554284 0.224076 -0.084552
O 0.558214 0.738325 -1.095919
O 3.093848 -1.398964 1.916518
N -1.749948 -0.008929 0.365940
N -0.520264 -0.763232 0.343626
N 1.909814 -0.498264 0.305756
N 2.015026 -1.092680 1.517100
C -2.301101 0.083102 -1.036644
C -2.740755 -0.726230 1.250343
C -3.618900 0.867227 -0.975360
C -4.036936 0.104307 1.251741
C 0.591291 -0.060186 -0.185157
C 3.085562 -0.181806 -0.568794
C 3.458955 1.294250 -0.447409
H -2.457512 -0.910395 -1.507101
H -1.559811 0.633181 -1.667693
H -2.333442 -0.785510 2.282130
H -2.959455 -1.762829 0.911044
H -3.463474 1.910174 -0.645326
H -4.156419 0.846640 -1.940663
H -4.855301 -0.413114 1.784281
H -3.876911 1.112202 1.675811
H -0.358242 -1.290095 1.220868
H 2.832026 -0.433102 -1.625580
H 3.940466 -0.836112 -0.271302
H 2.657373 1.951401 -0.848699
H 3.673999 1.594036 0.595049


%chk=000198541-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000198541

0 1
Cl 5.310333 1.858416 -0.023456
O -4.680475 -0.014568 0.299238
O 0.557214 1.497881 -0.740482
O 2.960431 -2.279875 0.339050
N -1.819806 0.034413 -0.017914
N -0.501681 -0.485690 0.005658
N 1.851314 -0.401693 -0.251066
N 1.819865 -1.716658 0.231548
C -2.677047 -0.679149 -1.007141
C -2.428720 0.057188 1.342428
C -4.060317 -0.004245 -1.035381
C -3.819380 0.710648 1.246919
C 0.568573 0.305207 -0.356244
C 3.104431 0.282253 -0.645018
C 3.701427 1.058077 0.540828
H -2.795472 -1.757755 -0.742170
H -2.200200 -0.607099 -2.000116
H -1.777694 0.649817 2.008519
H -2.530670 -0.973141 1.761594
H -3.954665 1.040860 -1.394733
H -4.751825 -0.556207 -1.692014
H -4.339028 0.667934 2.217580
H -3.710201 1.767720 0.925486
H -0.311464 -1.456708 0.301263
H 2.866956 0.974458 -1.466827
H 3.810586 -0.493488 -0.986470
H 3.048927 1.882236 0.861644
H 3.969491 0.401067 1.380478


