%chk=000185459.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185459

0 1
Cl -5.093515 1.399804 2.056133
O 1.944221 -0.721090 1.586032
O 4.093979 -1.839413 0.518742
O 1.480559 0.112116 -0.467409
N 5.574453 -0.194726 1.095945
N 7.074399 1.293495 -0.898232
C 5.819858 1.265289 1.235268
C 6.646541 -0.851211 0.290353
C 5.946516 1.939922 -0.147490
C 6.808378 -0.172453 -1.084964
C 4.275653 -0.735801 0.999485
C 7.261531 1.958041 -2.222137
C 3.149191 0.068081 1.651046
C 0.149970 -1.757267 0.495135
C -1.228341 -1.185482 0.254798
C 1.218170 -0.680221 0.403236
C 0.495515 -2.843995 -0.526763
C -1.475801 -0.318654 -0.819709
C -2.280423 -1.550604 1.108018
C -3.813965 -0.188894 -0.187219
C -2.760951 0.177593 -1.040264
C -3.566878 -1.054468 0.889725
C -5.175309 0.331369 -0.429048
C -5.857703 1.078588 0.543339
C -5.823041 0.088672 -1.651837
C -7.142662 1.580302 0.325360
C -7.109883 0.581198 -1.882415
C -7.769015 1.325952 -0.897847
H 6.775941 1.388812 1.800897
H 5.031585 1.753663 1.839268
H 6.402986 -1.931285 0.159392
H 7.593200 -0.785976 0.871862
H 6.196111 3.014558 -0.012277
H 4.976580 1.896511 -0.688110
H 5.915913 -0.379147 -1.715078
H 7.683963 -0.613808 -1.608688
H 8.127416 1.503183 -2.730726
H 7.508810 3.019645 -2.059736
H 6.395566 1.902926 -2.898479
H 3.299581 0.192668 2.740683
H 2.986670 1.043899 1.153787
H 0.199819 -2.207714 1.527038
H 0.483683 -2.457362 -1.554531
H -0.224538 -3.669615 -0.477206
H 1.497466 -3.260413 -0.342077
H -0.654276 -0.021035 -1.478100
H -2.099843 -2.222158 1.946363
H -2.944944 0.858453 -1.870686
H -4.380205 -1.338520 1.557723
H -5.314189 -0.493491 -2.420681
H -7.646280 2.161000 1.097995
H -7.602237 0.384001 -2.833973
H -8.771727 1.709257 -1.082739


%chk=000185459-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000185459

0 1
Cl -5.601419 1.451042 2.300409
O 1.880591 -0.576335 1.523301
O 3.917838 -1.835589 0.265004
O 1.344497 -0.014919 -0.675400
N 5.462481 -0.122757 0.601653
N 7.594909 1.261143 -0.735678
C 5.854408 1.234883 1.032241
C 6.557333 -0.885497 -0.038956
C 6.460983 2.015352 -0.154207
C 7.156792 -0.077412 -1.204950
C 4.197336 -0.678196 0.700624
C 8.300774 2.024401 -1.783472
C 3.117380 0.200759 1.384388
C 0.017609 -1.736596 0.533818
C -1.387262 -1.164944 0.328395
C 1.110601 -0.688432 0.352038
C 0.321612 -2.906126 -0.453116
C -1.735910 -0.435464 -0.837042
C -2.390104 -1.396235 1.302397
C -4.057188 -0.185933 -0.039218
C -3.049154 0.043576 -1.014938
C -3.704660 -0.916942 1.125069
C -5.450801 0.289781 -0.287632
C -6.257124 0.985148 0.652118
C -6.045713 0.043151 -1.560403
C -7.571872 1.405081 0.367503
C -7.357569 0.454568 -1.870411
C -8.129342 1.135086 -0.901501
H 6.617159 1.155218 1.832369
H 4.987904 1.784103 1.431963
H 6.138810 -1.842470 -0.389414
H 7.345510 -1.084074 0.713502
H 6.831916 2.992670 0.207223
H 5.656656 2.210435 -0.910762
H 6.397540 -0.000701 -2.024573
H 8.035442 -0.616239 -1.604981
H 9.177759 1.450190 -2.131464
H 8.663106 2.981303 -1.366989
H 7.661052 2.252678 -2.672604
H 3.398659 0.471466 2.414574
H 2.922292 1.108931 0.783954
H 0.103888 -2.116249 1.566011
H 0.247750 -2.556989 -1.497286
H -0.408787 -3.719424 -0.300819
H 1.341437 -3.294354 -0.285941
H -0.968930 -0.222105 -1.588948
H -2.141518 -1.960276 2.209712
H -3.293230 0.627796 -1.909956
H -4.461387 -1.121082 1.888560
H -5.458087 -0.509244 -2.301796
H -8.144245 1.944920 1.127470
H -7.777625 0.237119 -2.858048
H -9.151599 1.457985 -1.124588


