%chk=000113254.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000113254

0 1
Cl -6.211964 -1.929445 -2.607970
O 5.476396 2.931416 0.221566
O 4.136044 -0.691538 -2.287056
O 1.810219 2.639475 0.363435
O -8.453608 -0.759674 -1.585691
O -8.678181 -0.257347 0.501862
N 4.959568 0.926096 -0.830457
N 3.956025 -1.540715 0.996677
N -0.022260 1.277569 0.726412
N -1.609934 -1.290710 0.305535
N -2.373601 -0.290014 0.421301
N -8.001714 -0.528152 -0.480970
C 5.697213 0.035218 0.085228
C 4.838046 -0.386468 1.297734
C 3.931465 2.882682 -1.702686
C 3.493614 1.673752 -2.542801
C 4.867954 2.346929 -0.638234
C 4.176644 0.460219 -1.934199
C 4.635159 -2.865922 0.931783
C 2.601563 -1.406547 0.777961
C 1.974204 -0.132726 0.799397
C 4.602780 -3.573816 2.283815
C 1.784975 -2.565962 0.553657
C 0.594938 -0.001251 0.662694
C 0.428513 -2.435843 0.407653
C -0.228952 -1.167108 0.471721
C 0.621817 2.532193 0.600859
C -0.301275 3.703221 0.768742
C -3.778169 -0.492681 0.190380
C -4.273479 -1.117922 -0.966377
C -4.665694 0.090624 1.123969
C -6.540265 -0.549759 -0.286159
C -5.650225 -1.140448 -1.197800
C -6.030118 0.054661 0.885364
H 6.602387 0.578631 0.450522
H 6.044975 -0.855205 -0.489562
H 5.506135 -0.659140 2.147451
H 4.230192 0.482821 1.655653
H 3.060530 3.370718 -1.201163
H 4.421797 3.668904 -2.303689
H 2.393402 1.534063 -2.519497
H 3.766196 1.777736 -3.609706
H 5.686331 -2.719888 0.593843
H 4.150080 -3.495212 0.147106
H 2.591034 0.764995 0.925109
H 5.074612 -4.561917 2.221439
H 3.574969 -3.722629 2.642268
H 5.129446 -3.006018 3.060081
H 2.243459 -3.550477 0.490137
H -0.192030 -3.324596 0.239727
H -1.053760 1.283584 0.836355
H -0.785429 3.719717 1.756391
H -1.097157 3.728954 0.010299
H 0.262158 4.647465 0.676515
H -3.584900 -1.588803 -1.673106
H -4.271293 0.558643 2.026840
H -6.735835 0.493149 1.603539


%chk=000113254-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000113254

0 1
Cl -6.528590 -3.359175 -0.280913
O 5.415028 2.968385 0.890346
O 4.535312 -0.322248 -2.317528
O 1.635911 2.653016 0.366079
O -8.660952 -1.420092 -0.845702
O -8.679057 0.543606 0.316739
N 5.029511 1.110757 -0.507975
N 3.931481 -1.638817 0.822766
N -0.147839 1.128356 0.500248
N -1.675996 -1.365104 0.207001
N -2.365807 -0.222547 0.273853
N -8.065895 -0.474496 -0.203662
C 5.711892 0.136494 0.346938
C 4.783101 -0.563363 1.374053
C 4.204840 3.203176 -1.295694
C 3.895900 2.106074 -2.344628
C 4.939961 2.489642 -0.166156
C 4.492677 0.812820 -1.783594
C 4.631400 -2.924725 0.579531
C 2.564442 -1.511187 0.626508
C 1.923614 -0.229891 0.660447
C 4.651922 -3.861446 1.809167
C 1.750550 -2.680030 0.387302
C 0.532059 -0.106113 0.503751
C 0.374556 -2.558393 0.254444
C -0.294340 -1.295240 0.325551
C 0.389255 2.407996 0.444250
C -0.640681 3.530627 0.480851
C -3.770279 -0.375938 0.158377
C -4.418853 -1.632168 -0.011917
C -4.554705 0.809533 0.230854
C -6.595011 -0.512080 -0.068209
C -5.813088 -1.700080 -0.131596
C -5.948500 0.735838 0.127157
H 6.488514 0.686025 0.909427
H 6.194915 -0.609233 -0.309162
H 5.437603 -1.019997 2.142993
H 4.166057 0.187004 1.892359
H 3.289965 3.648054 -0.870536
H 4.838269 4.017704 -1.686145
H 2.811677 1.956943 -2.487011
H 4.333700 2.305696 -3.337440
H 5.668406 -2.684563 0.283111
H 4.177901 -3.422099 -0.293934
H 2.497595 0.690676 0.762747
H 5.210102 -4.784944 1.571091
H 3.632209 -4.144175 2.121920
H 5.148181 -3.380161 2.671220
H 2.200174 -3.673328 0.340422
H -0.255562 -3.440618 0.104382
H -1.199751 0.981149 0.453116
H -0.521268 4.099234 1.420368
H -1.679542 3.165645 0.417644
H -0.448718 4.229848 -0.350410
H -3.809025 -2.538083 -0.043496
H -4.054715 1.772741 0.370475
H -6.575510 1.628796 0.192112


