%chk=000183318.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183318

0 1
Cl 4.399615 -0.934513 -1.936743
N 0.026642 -1.420942 0.388161
N 1.124080 0.689133 0.643528
N 2.081486 -1.129903 -0.716361
N 2.411601 2.689881 0.829714
N 3.315523 0.947840 -0.460107
C -1.177025 -0.975611 1.150876
C -2.240666 -0.527131 0.160518
C -1.629616 -2.121301 2.058002
C -3.161810 -1.421923 -0.397832
C -2.272013 0.825059 -0.215772
C 1.079221 -0.587624 0.103247
C -4.117456 -0.965655 -1.311658
C -3.226669 1.277291 -1.129174
C -4.153178 0.382991 -1.676717
C 2.263513 1.418425 0.341376
C 3.143698 -0.312312 -0.941075
C 1.396311 3.310320 1.700738
H -0.884567 -0.100278 1.802621
H -2.540798 -1.842405 2.603370
H -0.859968 -2.364119 2.803036
H -1.849945 -3.044193 1.508886
H -0.018702 -2.321624 -0.092355
H -3.140804 -2.475653 -0.125560
H -1.538333 1.519922 0.197379
H -4.832948 -1.665032 -1.740941
H -3.247069 2.326563 -1.418891
H -4.897102 0.736594 -2.388280
H 3.253774 3.214368 0.604368
H 0.410895 3.344375 1.197553
H 1.699009 4.336187 1.960963
H 1.262901 2.727567 2.632529


%chk=000183318-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000183318

0 1
Cl 4.626709 -0.624546 -1.993759
N -0.091197 -0.751470 -0.266734
N 1.347659 0.785673 0.800406
N 2.114419 -0.653504 -1.027548
N 2.910904 2.283207 1.729235
N 3.658949 0.909852 -0.005287
C -1.248148 -0.422601 0.599927
C -2.530430 -0.447552 -0.245699
C -1.265578 -1.326200 1.852756
C -3.677466 -1.190116 0.126181
C -2.578104 0.323607 -1.438411
C 1.144971 -0.185932 -0.146722
C -4.844819 -1.164103 -0.672990
C -3.740211 0.351177 -2.237424
C -4.881319 -0.394601 -1.856415
C 2.614471 1.303694 0.825649
C 3.307857 -0.053990 -0.874224
C 1.939679 2.826378 2.682206
H -1.065552 0.614651 0.940899
H -2.067704 -1.021383 2.548776
H -0.301749 -1.230295 2.380412
H -1.413618 -2.388645 1.587710
H -0.181712 -1.484638 -0.973748
H -3.670022 -1.794128 1.039168
H -1.694841 0.900263 -1.738602
H -5.722880 -1.745847 -0.370453
H -3.758366 0.952034 -3.153578
H -5.785232 -0.375266 -2.475328
H 3.869803 2.630914 1.698930
H 1.096320 3.314039 2.160451
H 2.445315 3.568770 3.320527
H 1.521492 2.026852 3.319088


