%chk=000272007.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272007

0 1
Cl 5.411983 3.457214 0.122712
O 0.868600 -2.386399 0.260561
O 1.085296 1.163748 0.305484
O 2.976569 -3.065522 -0.175645
N -2.519455 -0.067316 0.959674
N 2.430987 -0.738195 -0.014554
C 0.122152 -1.119312 0.429159
C -0.942679 -1.081864 -0.661120
C -0.463928 -1.135464 1.836801
C -1.921469 0.075755 -0.409089
C -1.453687 0.027508 2.012995
C 1.206078 -0.028696 0.245977
C -3.574456 0.975069 1.196860
C 2.208166 -2.165102 -0.001893
C -4.749061 0.764130 0.270468
C 3.719856 -0.133205 -0.258914
C -5.269874 1.844601 -0.455951
C -5.341419 -0.502752 0.155228
C 3.909962 1.230623 0.025542
C 4.773488 -0.908096 -0.778463
C -6.378670 1.657548 -1.286941
C -6.446326 -0.684475 -0.679330
C 5.165865 1.783618 -0.222412
C 6.016213 -0.315474 -1.009638
C -6.968274 0.395070 -1.400401
C 6.229211 1.039217 -0.735333
H -1.491086 -2.052140 -0.651871
H -0.494746 -1.001328 -1.669051
H 0.326081 -1.097237 2.609705
H -0.987657 -2.107706 1.988118
H -1.404318 1.050491 -0.558523
H -2.748410 0.026224 -1.154165
H -1.939649 -0.055429 3.009889
H -0.904549 0.996688 1.992724
H -3.182111 2.013086 1.110010
H -3.934156 0.862564 2.248123
H -4.817295 2.830677 -0.376208
H -4.924954 -1.342547 0.713280
H 3.101410 1.854358 0.421625
H 4.638331 -1.971977 -0.997545
H -6.782709 2.498951 -1.847384
H -6.903022 -1.668923 -0.767665
H 6.831871 -0.920148 -1.410710
H -7.830933 0.251989 -2.047691
H 7.198474 1.501176 -0.916737


%chk=000272007-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000272007

0 1
Cl 5.751933 3.232644 0.832641
O 0.891467 -2.408908 0.334833
O 1.149084 1.186717 0.170226
O 3.085304 -3.115766 0.005686
N -2.491032 0.099595 0.856670
N 2.486274 -0.786745 0.017947
C 0.164062 -1.090657 0.419718
C -0.920355 -1.065057 -0.680393
C -0.477227 -0.988317 1.822314
C -1.884934 0.124941 -0.498273
C -1.454729 0.202937 1.912334
C 1.279859 -0.059773 0.194142
C -3.565268 1.110988 1.016321
C 2.254659 -2.204354 0.107130
C -4.808079 0.797430 0.187798
C 3.785920 -0.206239 -0.217429
C -5.529511 1.836879 -0.448432
C -5.287818 -0.533046 0.084059
C 4.089252 1.057549 0.349272
C 4.741222 -0.890597 -1.009113
C -6.714268 1.557220 -1.168512
C -6.467903 -0.816269 -0.637838
C 5.358570 1.607902 0.105155
C 6.006885 -0.305662 -1.222305
C -7.187797 0.228819 -1.264843
C 6.333868 0.953558 -0.670241
H -1.485533 -2.010884 -0.596507
H -0.453943 -1.029907 -1.681766
H 0.303497 -0.904506 2.600410
H -1.031885 -1.929152 1.990379
H -1.345496 1.084449 -0.685772
H -2.694207 0.042668 -1.244564
H -1.953047 0.175205 2.899109
H -0.886620 1.162385 1.846880
H -3.209226 2.143255 0.770618
H -3.839901 1.121039 2.090680
H -5.162706 2.869164 -0.382443
H -4.715706 -1.333961 0.565889
H 3.353518 1.599393 0.944644
H 4.509755 -1.870539 -1.430018
H -7.261847 2.371688 -1.656323
H -6.828215 -1.848916 -0.711204
H 6.748763 -0.835274 -1.828281
H -8.104093 0.009483 -1.824497
H 7.313152 1.409620 -0.838401


