%chk=000183853.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183853

0 1
Cl 0.971862 -4.020933 -0.046129
O -1.912927 -0.746986 0.359215
O -1.576758 -2.880634 -0.293527
O 4.206101 2.026087 0.465514
N 4.393298 -0.274822 0.203576
N 6.337173 1.138418 0.454707
C -4.497691 0.951258 -0.803851
C -4.977787 0.896942 0.703019
C -3.895237 -0.464196 -1.039386
C -3.902088 0.010603 1.395261
C -3.375682 -0.944640 0.319722
C -5.632523 1.242489 -1.791438
C -3.388707 1.999204 -1.005187
C -5.062221 2.276499 1.364574
C -6.348474 0.207800 0.835471
C -1.105748 -1.808181 0.010308
C 0.311184 -1.398945 0.079033
C 1.345384 -2.346686 0.048551
C 0.659975 -0.035807 0.171648
C 2.686544 -1.976706 0.100549
C 1.987916 0.365360 0.222419
C 3.012139 -0.602823 0.184080
C 4.920984 1.045668 0.345233
C 6.877652 2.521758 0.364204
C 7.206100 0.110105 -0.167404
H -3.088390 -0.445518 -1.791200
H -4.652823 -1.162397 -1.433299
H -4.304309 -0.528886 2.265368
H -3.069821 0.629162 1.785366
H -3.579802 -2.015204 0.516944
H -5.251913 1.325889 -2.815727
H -6.393778 0.456079 -1.797453
H -6.133528 2.186091 -1.550810
H -3.752964 3.017592 -0.843706
H -2.986466 1.958389 -2.023002
H -2.550392 1.822413 -0.320357
H -5.450573 2.202685 2.386427
H -5.729326 2.942592 0.807126
H -4.085261 2.767018 1.428970
H -7.148752 0.812257 0.396738
H -6.359668 -0.769600 0.342764
H -6.610257 0.045882 1.886552
H -0.141909 0.711783 0.204097
H 3.460598 -2.740852 0.076288
H 2.238569 1.431504 0.298001
H 5.041984 -1.067066 0.214285
H 6.146602 3.242298 0.785016
H 7.100943 2.832948 -0.667820
H 7.795456 2.584138 0.971896
H 7.033721 -0.870508 0.309229
H 8.267468 0.360513 0.011068
H 7.061221 0.014966 -1.256420


%chk=000183853-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000183853

0 1
Cl 1.157249 -4.035580 -0.290036
O -1.872518 -0.618289 0.440309
O -1.561102 -2.768082 -0.411030
O 4.405359 2.189217 0.307105
N 4.500611 -0.156862 0.065664
N 6.484818 1.117140 0.183483
C -4.611943 0.962294 -0.771424
C -5.144021 0.869910 0.727187
C -3.956761 -0.440513 -0.969085
C -3.978872 0.117343 1.449938
C -3.358183 -0.841237 0.405413
C -5.720675 1.228889 -1.815608
C -3.522339 2.061619 -0.921493
C -5.429108 2.241580 1.382676
C -6.439503 0.013814 0.820240
C -1.074000 -1.679951 -0.020355
C 0.371158 -1.310330 0.023465
C 1.433401 -2.244737 -0.113894
C 0.749099 0.054957 0.186864
C 2.778381 -1.844213 -0.093479
C 2.083131 0.486767 0.202873
C 3.123360 -0.473189 0.060240
C 5.086496 1.123787 0.193648
C 7.187267 2.407423 0.288923
C 7.294071 -0.106851 0.077894
H -3.184742 -0.439661 -1.758474
H -4.717704 -1.186458 -1.266247
H -4.330165 -0.418824 2.349358
H -3.199921 0.829320 1.776949
H -3.519837 -1.910685 0.620673
H -5.284621 1.292964 -2.830578
H -6.477667 0.425069 -1.829164
H -6.239301 2.186543 -1.617432
H -3.947699 3.073704 -0.794961
H -3.078892 2.010268 -1.933737
H -2.701304 1.935959 -0.193725
H -5.813609 2.104082 2.411333
H -6.195592 2.804886 0.816471
H -4.522374 2.868263 1.449463
H -7.297453 0.523999 0.346653
H -6.325915 -0.975792 0.340818
H -6.699136 -0.158090 1.881837
H -0.054102 0.787074 0.299479
H 3.559602 -2.605842 -0.195495
H 2.340319 1.539744 0.320428
H 5.126277 -0.956127 -0.042735
H 6.431390 3.204515 0.350341
H 7.825060 2.582209 -0.598326
H 7.818789 2.440536 1.197181
H 7.093217 -0.814771 0.907737
H 8.358973 0.166103 0.139542
H 7.148130 -0.628894 -0.890399


