%chk=000183316.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183316

0 1
Cl -4.101181 -1.922118 1.896238
N 0.214995 -1.586931 -0.557722
N -1.060455 0.430216 -0.393128
N -2.509451 2.310211 -0.187038
N -1.817951 -1.684930 0.618924
N -3.227750 0.288411 0.778050
C 1.352651 -0.904523 -1.242202
C 2.406662 -0.555517 -0.202572
C 1.869889 -1.818375 -2.354745
C 3.415573 -1.454735 0.164566
C 2.338628 0.701530 0.418554
C -0.892254 -0.915106 -0.102638
C 4.358767 -1.093738 1.132146
C 3.281450 1.058689 1.385077
C 4.295068 0.162576 1.741611
C -2.246722 0.989500 0.059471
C -1.561912 3.168837 -0.948058
C -2.161683 4.553324 -1.149569
C -2.935806 -1.018609 1.011565
H 0.967885 0.047151 -1.713944
H 2.737828 -1.365429 -2.851705
H 1.100079 -1.984558 -3.120363
H 2.182143 -2.804566 -1.991796
H 0.350887 -2.552922 -0.253673
H 3.472565 -2.437917 -0.299059
H 1.537565 1.394563 0.154231
H 5.142516 -1.795495 1.412502
H 3.224485 2.034410 1.864703
H 5.029566 0.441766 2.494809
H -0.595853 3.226161 -0.391992
H -1.333316 2.683639 -1.927688
H -3.381862 2.713105 0.152507
H -3.101771 4.520989 -1.716077
H -2.364107 5.063142 -0.198645
H -1.470726 5.193749 -1.714539


%chk=000183316-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000183316

0 1
Cl -4.363637 -1.646848 1.951528
N 0.297128 -1.102621 0.153954
N -1.217661 0.624855 -0.391212
N -2.847039 2.274742 -0.803109
N -1.884081 -1.306035 0.960672
N -3.503853 0.429728 0.470577
C 1.416302 -0.506654 -0.612141
C 2.708754 -0.610519 0.213318
C 1.490855 -1.118097 -2.029090
C 3.916978 -1.120673 -0.321333
C 2.702462 -0.152167 1.558400
C -0.957481 -0.569545 0.230119
C 5.090568 -1.172819 0.467252
C 3.870862 -0.203022 2.347008
C 5.073152 -0.714697 1.802795
C -2.498299 1.085388 -0.234604
C -1.926504 3.114155 -1.588100
C -2.615599 4.428045 -1.990356
C -3.098121 -0.730325 1.014479
H 1.147566 0.561291 -0.721695
H 2.249585 -0.601774 -2.644244
H 0.513151 -1.001682 -2.526440
H 1.739137 -2.194400 -1.995584
H 0.428493 -2.002775 0.621120
H 3.952845 -1.482707 -1.353834
H 1.771599 0.239940 1.985204
H 6.016086 -1.572271 0.037249
H 3.846080 0.154672 3.382452
H 5.981992 -0.756294 2.413324
H -1.019535 3.314645 -0.987376
H -1.592702 2.557563 -2.485385
H -3.816439 2.566148 -0.664549
H -3.510373 4.239772 -2.612215
H -2.922802 5.008158 -1.101074
H -1.923069 5.053323 -2.579309


