%chk=000228940.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228940

0 1
Cl 7.685885 3.103074 -0.393731
Cl 6.356317 -3.862114 -0.068476
O -3.189466 -1.873098 0.749303
N 5.202497 0.014559 0.295062
N -1.264622 -0.018707 0.047462
N -2.605902 0.217111 -0.090931
N -8.936874 0.843803 -0.358652
C 6.169095 0.878811 -0.436000
C 5.713422 -1.340517 0.615765
C 3.810071 0.188688 0.063170
C 3.322976 1.357898 -0.564595
C 2.881779 -0.762826 0.547770
C 6.548044 2.038787 0.491294
C 5.672058 -2.293720 -0.584093
C 1.029742 0.620775 -0.212241
C 1.952150 1.564731 -0.694345
C 1.515574 -0.543656 0.412364
C -0.410821 0.877168 -0.373689
C -4.940319 -0.340197 0.153981
C -5.794073 -1.090099 -0.671726
C -5.434684 0.776498 0.844137
C -3.529469 -0.794968 0.328932
C -7.618458 0.415059 -0.143239
C -7.124005 -0.720178 -0.829762
C -6.763457 1.159870 0.704717
H 5.745408 1.267286 -1.392102
H 7.081208 0.308307 -0.723302
H 5.114498 -1.760121 1.461539
H 6.754072 -1.246706 1.005140
H 4.006553 2.111186 -0.949430
H 3.222917 -1.668054 1.047372
H 5.669443 2.642911 0.788323
H 7.048768 1.689291 1.413249
H 4.637738 -2.470440 -0.940026
H 6.268303 -1.926586 -1.438877
H 1.598243 2.474642 -1.179978
H 0.805713 -1.286091 0.794093
H -0.666086 1.833763 -0.852060
H -5.407093 -1.972768 -1.187693
H -4.775318 1.342692 1.505373
H -7.776684 -1.297815 -1.478663
H -7.139943 2.027021 1.239772
H -2.959803 1.080776 -0.519169
H -9.346676 1.476585 0.310095
H -9.592920 0.185666 -0.749030


%chk=000228940-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228940

0 1
Cl 7.639137 3.351904 0.265923
Cl 6.686025 -3.952127 0.026275
O -3.324881 -2.049326 0.300110
N 5.271570 -0.049285 0.020076
N -1.277333 -0.163773 -0.051953
N -2.618856 0.142691 -0.160841
N -9.099519 0.866389 -0.098484
C 6.224982 1.008265 -0.356509
C 5.836124 -1.321689 0.503834
C 3.876447 0.151508 -0.076031
C 3.333176 1.405010 -0.494654
C 2.951979 -0.896278 0.242850
C 6.444038 1.990068 0.810618
C 5.942264 -2.346901 -0.641494
C 1.028349 0.554929 -0.263390
C 1.943000 1.592293 -0.586916
C 1.568373 -0.695686 0.154014
C -0.412854 0.783847 -0.360968
C -5.014107 -0.325164 0.035097
C -6.050512 -1.277960 -0.162142
C -5.384977 1.036842 0.212223
C -3.607612 -0.837577 0.084273
C -7.764249 0.477665 -0.050806
C -7.397298 -0.893213 -0.211540
C -6.731743 1.436847 0.171425
H 5.875697 1.555493 -1.249850
H 7.191289 0.547426 -0.626921
H 5.229060 -1.736460 1.327300
H 6.843570 -1.137049 0.916822
H 3.988076 2.243856 -0.747342
H 3.312036 -1.879601 0.559413
H 5.518344 2.502475 1.108752
H 6.914809 1.507514 1.679931
H 4.961515 -2.618166 -1.057354
H 6.620295 -2.010529 -1.439932
H 1.560947 2.568674 -0.911800
H 0.873903 -1.505268 0.401111
H -0.734433 1.790870 -0.703526
H -5.763466 -2.329351 -0.269204
H -4.628755 1.800723 0.433843
H -8.177645 -1.647152 -0.371605
H -6.995155 2.490119 0.326917
H -2.913526 1.075619 -0.485353
H -9.366230 1.838958 0.024221
H -9.836055 0.180864 -0.239309


