%chk=000254929.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000254929

0 1
Cl 5.302903 3.208206 -1.002010
O 0.583820 -2.222974 2.273323
O -5.915432 0.461387 -0.521518
O -6.137019 -0.217314 1.617490
N 3.137124 -1.001110 0.528621
N 0.086228 -1.444645 0.147802
N 4.569717 0.724109 1.036990
N 2.468738 -0.259179 -1.776003
N 3.601951 1.804358 -2.435068
C 2.372268 -2.238258 0.667140
C 3.149330 -0.162085 -0.588921
C 4.063662 0.913722 -0.257864
C 0.927171 -1.963040 1.141103
C 4.012508 -0.401659 1.494274
C -1.294148 -1.107164 0.317234
C -1.982592 -1.322532 1.523698
C -1.955683 -0.547040 -0.799195
C -3.995308 -0.424372 0.505283
C 4.254291 1.895918 -1.257045
C -3.329846 -0.979930 1.611157
C -3.301350 -0.209713 -0.697418
C 2.741257 0.743776 -2.645997
C -5.424388 -0.078246 0.646651
C -7.333898 0.853413 -0.516643
C -7.557081 1.417606 -1.902703
H 2.857653 -2.907303 1.423035
H 2.373616 -2.805900 -0.297549
H 4.171370 -0.846648 2.471179
H 0.489377 -1.230853 -0.779087
H -1.470250 -1.753507 2.391582
H -1.425511 -0.376117 -1.734049
H -3.880163 -1.141792 2.544825
H -3.829415 0.225511 -1.552117
H 2.231796 0.726139 -3.625732
H -7.473966 1.592335 0.291234
H -7.928606 -0.051734 -0.304545
H -7.344443 0.670499 -2.679604
H -6.897332 2.274150 -2.098411
H -8.593249 1.753285 -2.031241


%chk=000254929-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000254929

0 1
Cl 5.229517 3.215228 -1.365527
O 0.627521 -2.425170 2.426239
O -5.857037 0.507274 -0.648248
O -6.159348 -0.360525 1.495805
N 3.208054 -0.992435 0.568601
N 0.181965 -1.445650 0.321727
N 4.794275 0.665687 0.801828
N 2.131052 -0.225955 -1.522054
N 3.172938 1.792630 -2.412343
C 2.460264 -2.240248 0.815935
C 3.047592 -0.140794 -0.520139
C 4.045236 0.883158 -0.365597
C 0.992628 -2.033416 1.279690
C 4.267210 -0.453909 1.325845
C -1.202021 -1.134701 0.419709
C -1.991590 -1.431972 1.565080
C -1.799971 -0.498348 -0.704876
C -3.956222 -0.455220 0.449495
C 4.048603 1.854245 -1.391700
C -3.355731 -1.089863 1.566593
C -3.162478 -0.161629 -0.690382
C 2.256080 0.775338 -2.442300
C -5.404908 -0.121200 0.518511
C -7.302962 0.881382 -0.663685
C -7.564973 1.574266 -1.997115
H 2.969605 -2.797832 1.615914
H 2.479562 -2.844742 -0.110022
H 4.604164 -0.925986 2.246963
H 0.651676 -1.150736 -0.558026
H -1.531834 -1.919926 2.425645
H -1.189523 -0.271459 -1.587293
H -3.980828 -1.310210 2.438169
H -3.624437 0.327891 -1.551720
H 1.558324 0.773513 -3.282676
H -7.501789 1.538108 0.202565
H -7.901230 -0.039415 -0.538749
H -7.344763 0.900354 -2.842770
H -6.942505 2.479593 -2.099785
H -8.627017 1.873973 -2.059407


