%chk=000198658.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198658

0 1
Cl -6.548261 -0.684506 -0.056357
O 1.036448 -0.734752 1.052763
O -0.555909 1.074802 1.777866
C -0.720818 0.791275 0.377627
C 0.132325 -0.393954 0.010206
C -0.318290 2.046578 -0.435451
C -2.198351 0.440679 0.242418
C 0.269648 -1.214872 -1.077602
C 1.328536 -2.160348 -0.748773
C 1.105138 2.465268 -0.193932
C 1.763847 -1.821880 0.562476
C -0.488292 -1.185496 -2.343836
C -2.850353 -0.146781 1.339442
C -2.904634 0.678450 -0.944181
C 1.944653 -3.234323 -1.402173
C 2.775828 -2.495260 1.248536
C 1.399982 3.403622 0.807194
C 2.144374 1.925851 -0.967483
C -4.199592 -0.496043 1.255569
C -4.255157 0.330509 -1.043104
C 2.957730 -3.919624 -0.735754
C 3.366147 -3.556329 0.567026
C -4.880335 -0.252084 0.060681
C 2.721396 3.801617 1.026307
C 3.463770 2.326952 -0.742993
C 3.755191 3.265970 0.251847
H -1.011682 2.870978 -0.157411
H -0.486411 1.865498 -1.516280
H 0.402805 1.163159 2.004655
H -0.357839 -0.232840 -2.876747
H -0.172962 -1.984994 -3.029936
H -1.567924 -1.324964 -2.166614
H -2.290297 -0.318947 2.265297
H -2.411837 1.138432 -1.800717
H 1.634685 -3.522179 -2.403984
H 3.075170 -2.203095 2.249951
H 0.598198 3.821730 1.414818
H 1.925818 1.185076 -1.735132
H -4.710224 -0.949357 2.104992
H -4.809706 0.513879 -1.962488
H 3.451239 -4.758582 -1.223752
H 4.163304 -4.124466 1.047076
H 2.945318 4.531361 1.802948
H 4.267614 1.904039 -1.343791
H 4.783311 3.577454 0.423492


%chk=000198658-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000198658

0 1
Cl -6.719415 -0.601779 -0.348991
O 1.218135 -0.542061 0.970181
O -0.645086 1.179647 1.797932
C -0.748757 0.835344 0.363387
C 0.107689 -0.395378 0.080453
C -0.254674 2.051200 -0.503123
C -2.238681 0.517498 0.142181
C 0.116524 -1.379619 -0.895693
C 1.289289 -2.210427 -0.627582
C 1.177780 2.466680 -0.214342
C 1.934003 -1.666665 0.519110
C -0.861457 -1.586962 -2.026494
C -2.858633 -0.394412 1.034340
C -3.013144 1.086471 -0.894672
C 1.852998 -3.358182 -1.240624
C 3.099142 -2.190892 1.093275
C 1.470980 3.336703 0.869002
C 2.250563 1.986828 -1.008885
C -4.218163 -0.740402 0.895734
C -4.378488 0.752202 -1.051391
C 3.027976 -3.907793 -0.684769
C 3.643840 -3.334426 0.464908
C -4.959441 -0.160135 -0.153425
C 2.804138 3.709731 1.154705
C 3.583653 2.358168 -0.726748
C 3.865450 3.220122 0.358793
H -0.941833 2.890828 -0.289234
H -0.357548 1.785005 -1.572046
H 0.311959 1.110887 2.058961
H -0.870567 -0.735014 -2.731791
H -0.597111 -2.488691 -2.604729
H -1.894368 -1.712994 -1.657314
H -2.270236 -0.817564 1.853862
H -2.573355 1.800503 -1.596724
H 1.391810 -3.813001 -2.124093
H 3.559990 -1.737447 1.975148
H 0.648533 3.728308 1.478885
H 2.039765 1.315938 -1.851154
H -4.692415 -1.441495 1.588640
H -4.974040 1.196060 -1.854322
H 3.479165 -4.794329 -1.143669
H 4.555670 -3.786463 0.869592
H 3.013449 4.385194 1.992103
H 4.399619 1.978113 -1.351759
H 4.898892 3.512205 0.577078


