%chk=000271245.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271245

0 1
Cl 5.736415 -0.725410 -0.000183
O 1.896380 3.035191 -0.000247
O -5.160369 -1.200547 0.000068
O -5.008917 0.958481 -0.000195
N -0.089932 1.963268 -0.000067
N -4.525286 -0.160590 -0.000089
C -0.242830 -0.483729 0.000056
C 1.220484 -0.562855 0.000034
C -0.870636 0.792050 -0.000033
C 1.980288 0.625550 -0.000012
C 1.334512 1.958087 0.000073
C -1.057661 -1.633273 0.000091
C -2.280380 0.900063 -0.000086
C 1.900070 -1.801703 0.000007
C 3.386677 0.583209 -0.000089
C -3.037857 -0.265179 -0.000038
C -2.443843 -1.538687 0.000056
C 3.288370 -1.853244 -0.000058
C 4.019968 -0.653916 -0.000105
H -0.558911 2.875641 -0.000195
H -0.589280 -2.622361 0.000138
H -2.774202 1.878169 -0.000152
H 1.328430 -2.732323 0.000025
H 3.958447 1.519457 -0.000105
H -3.073823 -2.434339 0.000089
H 3.810985 -2.812711 -0.000082


%chk=000271245-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000271245

0 1
Cl 5.866674 -0.683010 0.000424
O 1.942790 3.064639 0.000418
O -5.248913 -1.211309 0.000541
O -5.043297 1.061166 0.000019
N -0.081183 1.928234 -0.000349
N -4.544002 -0.130166 0.000079
C -0.252320 -0.516618 -0.000351
C 1.216490 -0.586786 -0.000313
C -0.877574 0.775184 -0.000229
C 1.979134 0.625095 -0.000383
C 1.323135 1.960415 -0.000956
C -1.094908 -1.662931 -0.000242
C -2.286743 0.901180 0.000034
C 1.931441 -1.820229 -0.000072
C 3.395176 0.602926 -0.000106
C -3.066435 -0.265548 0.000145
C -2.492257 -1.558431 -0.000042
C 3.334847 -1.850846 0.000153
C 4.052374 -0.631278 0.000144
H -0.534798 2.847524 -0.000060
H -0.649286 -2.661179 -0.000277
H -2.780686 1.877490 0.000145
H 1.395160 -2.772988 -0.000006
H 3.931997 1.556146 -0.000196
H -3.141233 -2.436674 0.000024
H 3.871518 -2.803706 0.000358


